data_2kyr_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 2kyr _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.61 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 17.1 pttt . . . . . 0 N--CA 1.48 1.038 0 CA-C-O 121.302 0.573 . . . . 0.0 110.847 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.54 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.0 tmtp? -146.34 143.61 29.22 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -170.374 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.493 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.2 tt -132.29 141.9 49.17 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 175.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.517 HD12 ' HA ' ' A' ' 55' ' ' ILE . 21.0 pt -132.57 169.79 21.26 Favored 'Isoleucine or valine' 0 C--O 1.241 0.653 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 170.501 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.55 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -153.64 169.74 22.53 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.354 175.636 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.1 tt -143.03 113.5 7.38 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 178.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.454 ' HA ' ' O ' ' A' ' 64' ' ' SER . 56.3 m -101.05 113.53 26.63 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 175.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.475 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -126.8 119.0 25.79 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 122.626 0.37 . . . . 0.0 110.405 -178.035 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.523 ' SG ' ' HB2' ' A' ' 13' ' ' MET . 51.7 t -125.26 138.53 31.86 Favored Pre-proline 0 N--CA 1.472 0.64 0 C-N-CA 123.339 0.656 . . . . 0.0 111.185 -172.635 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.406 ' HD2' ' HG ' ' A' ' 11' ' ' CYS . 57.4 Cg_endo -68.38 -20.42 42.27 Favored 'Trans proline' 0 C--N 1.378 2.109 0 C-N-CA 123.096 2.531 . . . . 0.0 112.606 172.319 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.523 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 60.5 mtt -75.91 -46.36 30.38 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.635 0.774 . . . . 0.0 110.01 178.674 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 141.92 -161.49 27.13 Favored Glycine 0 C--N 1.346 1.138 0 CA-C-N 116.038 -0.528 . . . . 0.0 113.307 176.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 52.9 mt -74.2 -26.61 60.37 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 -170.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.73 -43.34 94.25 Favored 'General case' 0 N--CA 1.485 1.32 0 CA-C-O 121.498 0.666 . . . . 0.0 110.971 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 8.6 t-160 -71.56 -38.1 71.0 Favored 'General case' 0 C--O 1.247 0.935 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.385 -178.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 51.6 p -66.45 -32.02 73.14 Favored 'General case' 0 C--N 1.35 0.604 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.869 178.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 18.6 m-30 -72.14 -30.35 64.95 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.049 0.54 . . . . 0.0 111.694 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 41.0 mtm -67.28 -40.19 86.09 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 120.758 0.313 . . . . 0.0 110.456 173.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.46 -36.6 74.01 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.363 176.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.56 -50.38 58.78 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.828 0.851 . . . . 0.0 110.301 -178.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.476 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 8.7 tp-100 -58.32 -43.94 88.4 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.737 0.815 . . . . 0.0 110.44 179.098 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.411 ' HB1' ' HB3' ' A' ' 92' ' ' ALA . . . -62.73 -54.39 39.88 Favored 'General case' 0 CA--C 1.55 0.96 0 CA-C-N 115.66 -0.7 . . . . 0.0 112.052 -178.204 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 92.1 mt -64.69 -29.61 70.61 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.196 0.598 . . . . 0.0 111.536 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.476 ' O ' HG22 ' A' ' 30' ' ' VAL . 32.9 tt0 -65.91 -55.27 17.78 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.812 0.695 . . . . 0.0 110.012 -179.385 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.496 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 27.5 mm-40 -52.44 -47.5 66.37 Favored 'General case' 0 N--CA 1.484 1.261 0 O-C-N 124.359 1.037 . . . . 0.0 110.432 178.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.427 ' HB1' ' HA ' ' A' ' 93' ' ' ALA . . . -56.49 -51.68 67.59 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.502 1.121 . . . . 0.0 111.925 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.55 -23.39 65.42 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 115.332 -0.849 . . . . 0.0 113.184 178.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.476 HG22 ' O ' ' A' ' 26' ' ' GLU . 53.9 t -74.88 -37.6 42.13 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 178.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.496 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 17.4 mm-40 -72.75 -21.48 61.01 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.745 177.393 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -80.64 -13.76 58.76 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.532 0.733 . . . . 0.0 111.76 174.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 105.0 -37.79 3.62 Favored Glycine 0 C--N 1.347 1.191 0 N-CA-C 114.278 0.471 . . . . 0.0 114.278 167.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.61 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -76.75 -179.4 5.35 Favored 'General case' 0 N--CA 1.483 1.207 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -175.897 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.54 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 8.8 tp10 -73.05 153.06 41.01 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 114.453 -1.248 . . . . 0.0 110.31 176.496 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.493 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 6.7 p -142.46 128.06 17.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 123.273 0.629 . . . . 0.0 110.595 176.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 49.7 tptt -136.39 114.51 11.48 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 177.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.55 HG12 ' HB3' ' A' ' 7' ' ' ALA . 59.2 mt -117.39 111.31 34.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.925 0 C-N-CA 122.6 0.36 . . . . 0.0 111.877 -174.327 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -77.99 141.79 38.7 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.614 0.766 . . . . 0.0 109.099 171.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.411 HG23 ' HB2' ' A' ' 9' ' ' CYS . 17.4 p -124.64 117.51 24.44 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.53 0.732 . . . . 0.0 109.294 -177.666 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.475 ' O ' ' HA ' ' A' ' 10' ' ' ALA . 42.1 mt-30 -109.81 135.79 50.16 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.578 0.751 . . . . 0.0 110.146 178.44 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -161.68 179.59 36.97 Favored Glycine 0 C--N 1.336 0.57 0 N-CA-C 111.929 -0.468 . . . . 0.0 111.929 178.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.24 -14.51 63.0 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.127 0.571 . . . . 0.0 111.998 -179.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -84.78 -27.37 26.91 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.468 0.707 . . . . 0.0 111.347 176.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 147.19 -157.67 27.48 Favored Glycine 0 C--N 1.344 0.986 0 CA-C-N 116.413 -0.358 . . . . 0.0 112.545 -179.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.435 HG12 ' HG2' ' A' ' 41' ' ' GLN . 70.2 mt -127.48 132.35 69.39 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 C-N-CA 123.711 0.804 . . . . 0.0 109.995 178.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.411 ' HB3' ' OG1' ' A' ' 40' ' ' THR . 8.2 tp-100 -126.91 150.25 49.4 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.198 0.999 . . . . 0.0 110.586 -178.143 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 19.7 t30 61.43 41.5 12.69 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 124.966 1.306 . . . . 0.0 110.219 174.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 22.6 tpp180 -48.35 122.34 5.27 Favored 'General case' 0 C--N 1.356 0.873 0 C-N-CA 125.277 1.431 . . . . 0.0 112.544 -176.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 36.9 mt -66.73 148.99 51.18 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 114.605 -1.179 . . . . 0.0 110.621 170.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 34.4 p -104.45 167.81 9.5 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 172.24 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.61 -34.49 71.19 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-O 121.019 0.438 . . . . 0.0 110.461 175.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -63.76 -48.64 76.12 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.847 175.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -54.18 -42.35 69.57 Favored 'General case' 0 N--CA 1.496 1.873 0 C-N-CA 123.321 0.648 . . . . 0.0 111.791 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.592 HG23 ' HG3' ' A' ' 78' ' ' ARG . 43.2 mt -75.28 -27.96 19.97 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.939 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.041 -176.205 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -75.51 -45.9 35.49 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.485 0.714 . . . . 0.0 111.117 176.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -61.38 -35.3 77.1 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.342 1.057 . . . . 0.0 110.77 178.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -53.15 100.49 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.579 0 O-C-N 125.001 1.438 . . . . 0.0 112.582 -174.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 30.2 m -63.94 -36.45 84.0 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 114.673 -1.149 . . . . 0.0 109.067 167.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.467 HG22 HG22 ' A' ' 99' ' ' ILE . 80.0 mt -129.05 140.45 49.2 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 CA-C-N 114.769 -1.105 . . . . 0.0 109.794 178.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.53 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 35.1 mt -129.89 141.37 46.6 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 171.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.6 mp -127.02 112.55 29.22 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 CA-C-N 118.344 0.52 . . . . 0.0 109.632 172.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 8.6 m170 -89.17 83.95 6.52 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-O 121.745 0.783 . . . . 0.0 109.322 170.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.454 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 20.6 p -80.32 79.86 6.85 Favored 'General case' 0 C--O 1.24 0.567 0 CA-C-N 114.361 -1.29 . . . . 0.0 109.312 176.509 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 27.6 m -126.21 161.52 31.79 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 CA-C-O 121.685 0.755 . . . . 0.0 111.943 -170.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -123.08 -17.24 6.75 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 114.491 -1.231 . . . . 0.0 109.592 175.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 6.7 m -131.92 159.22 43.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 124.699 1.2 . . . . 0.0 108.401 173.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 79.0 m -64.45 111.83 6.46 Favored Pre-proline 0 CA--C 1.544 0.714 0 O-C-N 123.8 0.688 . . . . 0.0 109.663 177.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.503 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 55.8 Cg_endo -68.14 142.23 55.17 Favored 'Trans proline' 0 C--N 1.376 2.01 0 C-N-CA 122.175 1.916 . . . . 0.0 110.651 -179.157 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -65.36 -21.87 66.74 Favored 'General case' 0 N--CA 1.482 1.141 0 CA-C-O 121.327 0.584 . . . . 0.0 111.63 -173.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.809 ' HB3' HH11 ' A' ' 74' ' ' ARG . 4.0 m-20 -104.46 12.61 33.1 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.201 1.0 . . . . 0.0 112.737 -174.511 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.503 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 5.6 p30 -60.06 -24.95 64.98 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.558 0.743 . . . . 0.0 112.384 -176.044 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -60.89 -32.4 71.86 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.887 1.275 . . . . 0.0 113.08 -179.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.809 HH11 ' HB3' ' A' ' 71' ' ' ASP . 40.1 mtp180 -68.36 -25.32 65.02 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 124.338 1.055 . . . . 0.0 111.569 -179.418 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.407 ' HB3' HG23 ' A' ' 80' ' ' VAL . 33.0 m-85 -103.07 -2.21 27.87 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 114.139 -1.392 . . . . 0.0 111.277 -175.511 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -54.79 -42.76 72.16 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 124.639 1.176 . . . . 0.0 111.933 -179.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 58.5 p -82.86 -13.69 55.68 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.642 0.777 . . . . 0.0 112.358 -177.087 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.592 ' HG3' HG23 ' A' ' 55' ' ' ILE . 33.3 mmt180 -103.64 164.54 11.6 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.706 0.802 . . . . 0.0 111.63 -169.01 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -83.38 99.35 10.0 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 123.748 0.819 . . . . 0.0 110.146 -177.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.53 ' HA ' ' HB ' ' A' ' 61' ' ' ILE . 51.4 t -112.28 135.68 50.87 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 C-N-CA 123.643 0.777 . . . . 0.0 110.514 -174.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 73.6 m-85 -104.26 88.58 3.02 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 107.367 -1.345 . . . . 0.0 107.367 175.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -86.92 116.13 24.79 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 114.619 -1.173 . . . . 0.0 109.676 -172.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.437 HG13 ' HA ' ' A' ' 64' ' ' SER . 43.6 pt -126.24 -172.58 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 124.693 1.197 . . . . 0.0 110.106 -179.459 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 15.9 p -82.79 147.34 28.45 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.728 169.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.463 HD12 ' HB2' ' A' ' 11' ' ' CYS . 6.5 tt -62.85 -27.69 69.51 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.381 176.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.659 ' HG2' ' HE2' ' A' ' 90' ' ' LYS . 10.1 tt0 -71.11 -40.52 71.42 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 122.725 0.41 . . . . 0.0 111.113 177.016 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.408 ' HB3' HD12 ' A' ' 83' ' ' ILE . 24.5 t70 -59.86 -33.54 71.94 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.101 0.561 . . . . 0.0 110.195 176.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.54 -28.44 69.86 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.881 0.872 . . . . 0.0 112.739 177.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 63.9 mt -88.03 -49.04 14.77 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.992 0 C-N-CA 123.287 0.635 . . . . 0.0 110.273 -179.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.659 ' HE2' ' HG2' ' A' ' 86' ' ' GLN . 0.1 OUTLIER -79.46 -30.69 42.24 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 -173.599 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -123.31 16.8 9.81 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.148 0.579 . . . . 0.0 110.851 -170.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . 0.411 ' HB3' ' HB1' ' A' ' 24' ' ' ALA . . . -40.22 -59.01 1.36 Allowed 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 124.304 1.042 . . . . 0.0 113.584 -173.111 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.427 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . . . -63.56 -39.5 94.55 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 114.919 -1.037 . . . . 0.0 111.165 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -60.6 -46.78 93.76 Favored Glycine 0 C--N 1.354 1.553 0 O-C-N 124.304 1.003 . . . . 0.0 112.055 -178.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.437 ' O ' HG13 ' A' ' 99' ' ' ILE . 34.1 mt -53.53 -62.21 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 124.893 1.277 . . . . 0.0 110.219 177.478 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.7 mp -55.04 -53.8 30.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 O-C-N 124.178 0.924 . . . . 0.0 111.227 -174.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.16 -28.93 69.15 Favored 'General case' 0 N--CA 1.485 1.302 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -175.072 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 50.5 mm-40 -71.93 -36.76 70.02 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 122.572 0.349 . . . . 0.0 110.418 176.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . 0.467 HG22 HG22 ' A' ' 60' ' ' ILE . 55.3 mt -71.82 -35.59 55.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 179.403 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -59.05 -49.46 77.8 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-N 114.337 -1.301 . . . . 0.0 111.13 177.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -79.5 -25.96 41.69 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -175.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 65.2 mtm -69.04 -53.68 19.17 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 122.575 0.35 . . . . 0.0 110.393 174.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 26.6 mt -61.44 -49.22 85.36 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.281 177.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.522 ' O ' ' HG2' ' A' ' 108' ' ' GLN . . . -56.02 -39.97 72.73 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 122.961 0.505 . . . . 0.0 111.55 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 30.6 t -62.28 -45.84 91.46 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 123.981 0.8 . . . . 0.0 110.652 -177.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -78.82 -19.8 51.22 Favored 'General case' 0 N--CA 1.483 1.193 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 179.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 20.3 mm-40 -85.25 -12.62 52.06 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 122.84 0.456 . . . . 0.0 111.841 178.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.522 ' HG2' ' O ' ' A' ' 104' ' ' ALA . 76.8 mm-40 . . . . . 0 CA--C 1.556 1.21 0 CA-C-O 119.214 -0.422 . . . . 0.0 110.129 175.057 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.456 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 3.2 pttt . . . . . 0 N--CA 1.482 1.132 0 CA-C-O 120.963 0.411 . . . . 0.0 110.229 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.435 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 3.6 tmtp? -143.86 139.56 29.31 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 -172.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.476 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 8.6 tt -128.86 140.15 51.82 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 176.45 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 23.1 pt -128.87 158.4 41.44 Favored 'Isoleucine or valine' 0 C--O 1.24 0.594 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 170.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.58 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -147.19 169.53 19.14 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 177.386 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.425 HD22 ' OE1' ' A' ' 41' ' ' GLN . 5.4 tt -143.68 117.9 9.56 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 -179.144 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.501 ' HA ' ' O ' ' A' ' 64' ' ' SER . 61.5 m -108.39 108.41 19.36 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.88 0.872 . . . . 0.0 109.364 176.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -123.3 124.11 42.25 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 122.783 0.433 . . . . 0.0 110.697 -179.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.764 ' SG ' HD11 ' A' ' 85' ' ' LEU . 1.3 m -142.67 144.61 30.74 Favored Pre-proline 0 N--CA 1.483 1.209 0 C-N-CA 123.218 0.607 . . . . 0.0 111.766 -179.493 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -83.65 -14.57 7.74 Favored 'Trans proline' 0 C--N 1.373 1.868 0 C-N-CA 123.496 2.797 . . . . 0.0 112.447 174.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 23.1 ttt -60.38 -53.23 60.14 Favored 'General case' 0 C--N 1.357 0.908 0 C-N-CA 123.411 0.684 . . . . 0.0 109.671 174.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 157.48 175.26 28.21 Favored Glycine 0 C--O 1.246 0.87 0 CA-C-N 115.136 -0.938 . . . . 0.0 112.047 -179.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 29.9 mt -67.37 -20.61 65.59 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 122.925 0.49 . . . . 0.0 111.877 177.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.9 -45.53 82.54 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-O 121.008 0.433 . . . . 0.0 110.792 174.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.435 ' ND1' ' SG ' ' A' ' 11' ' ' CYS . 12.1 t-160 -68.48 -44.8 73.97 Favored 'General case' 0 C--O 1.242 0.666 0 CA-C-N 115.366 -0.833 . . . . 0.0 109.86 -179.174 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.474 ' HA ' HD13 ' A' ' 85' ' ' LEU . 47.5 p -64.7 -37.99 89.48 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.413 -176.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.481 ' HZ ' ' HG2' ' A' ' 47' ' ' GLN . 13.2 m-85 -74.25 -28.2 61.11 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.191 0.596 . . . . 0.0 112.0 -178.044 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 67.5 mtm -69.63 -36.7 76.36 Favored 'General case' 0 N--CA 1.483 1.222 0 CA-C-N 118.024 0.375 . . . . 0.0 110.483 173.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.02 -40.2 71.92 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.95 174.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.32 -42.75 83.11 Favored 'General case' 0 C--O 1.217 -0.613 0 C-N-CA 123.715 0.806 . . . . 0.0 110.334 -178.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.471 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 8.9 tp-100 -61.7 -47.23 86.23 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.463 0.705 . . . . 0.0 109.503 178.556 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.494 ' HB1' ' HB3' ' A' ' 92' ' ' ALA . . . -62.03 -52.8 62.51 Favored 'General case' 0 CA--C 1.552 1.038 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.698 -177.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 75.6 mt -64.54 -32.63 74.35 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.535 0.734 . . . . 0.0 111.635 -179.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.538 ' HA ' HG21 ' A' ' 36' ' ' VAL . 30.6 tt0 -65.89 -55.7 15.6 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 123.688 0.617 . . . . 0.0 110.141 -179.129 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.543 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 19.9 mm-40 -55.82 -44.36 77.8 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 124.456 1.097 . . . . 0.0 110.255 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -57.01 -50.44 72.72 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.162 0.985 . . . . 0.0 111.66 177.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.62 -22.88 65.32 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 123.671 0.788 . . . . 0.0 113.096 178.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.451 HG21 ' O ' ' A' ' 26' ' ' GLU . 55.1 t -75.97 -40.16 37.81 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.543 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 7.1 mm-40 -72.67 -18.53 61.55 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.513 177.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -80.93 -12.28 59.43 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.112 0.965 . . . . 0.0 111.302 173.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 82.77 23.43 55.88 Favored Glycine 0 C--N 1.349 1.298 0 N-CA-C 114.764 0.666 . . . . 0.0 114.764 167.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.456 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.1 OUTLIER -129.55 176.96 7.57 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.283 0.633 . . . . 0.0 111.089 173.138 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.435 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 11.7 tp10 -72.86 153.39 41.06 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.131 178.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.538 HG21 ' HA ' ' A' ' 26' ' ' GLU . 6.4 p -141.5 128.96 21.36 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 C-N-CA 123.426 0.69 . . . . 0.0 110.637 179.603 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 47.7 tptt -135.78 111.13 9.08 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.521 0.728 . . . . 0.0 109.568 179.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.58 HG12 ' HB3' ' A' ' 7' ' ' ALA . 48.4 mt -116.15 113.45 43.23 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.235 0 N-CA-C 112.767 0.654 . . . . 0.0 112.767 -172.604 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -79.22 117.65 20.43 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 123.933 0.893 . . . . 0.0 110.047 176.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.44 ' OG1' ' HB3' ' A' ' 47' ' ' GLN . 3.3 p -103.51 103.93 13.95 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.237 0.615 . . . . 0.0 110.623 -179.612 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.425 ' OE1' HD22 ' A' ' 8' ' ' LEU . 31.3 mt-30 -98.62 132.17 44.23 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 -179.576 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -148.29 179.85 24.82 Favored Glycine 0 C--O 1.241 0.588 0 N-CA-C 111.483 -0.647 . . . . 0.0 111.483 177.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.78 -23.75 67.49 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.46 0.704 . . . . 0.0 111.348 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -67.76 -44.47 77.44 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.819 1.247 . . . . 0.0 110.173 174.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 150.61 -175.79 29.47 Favored Glycine 0 C--N 1.336 0.54 0 CA-C-N 114.822 -1.081 . . . . 0.0 111.482 -175.292 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.46 HG23 ' NH1' ' A' ' 49' ' ' ARG . 67.6 mt -98.86 111.66 29.03 Favored 'Isoleucine or valine' 0 C--O 1.24 0.587 0 C-N-CA 123.685 0.794 . . . . 0.0 109.78 -179.412 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.481 ' HG2' ' HZ ' ' A' ' 19' ' ' PHE . 8.5 tp-100 -96.33 148.48 22.71 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.104 0.962 . . . . 0.0 110.084 177.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 25.8 t30 79.82 -54.21 0.39 Allowed 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 126.264 1.826 . . . . 0.0 111.571 173.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.46 ' NH1' HG23 ' A' ' 46' ' ' ILE . 17.7 tpp180 65.32 144.63 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.238 0 C-N-CA 125.347 1.459 . . . . 0.0 112.918 176.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 37.8 mt -112.29 129.9 56.12 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.391 1.077 . . . . 0.0 109.86 173.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 39.7 p -95.92 165.34 12.32 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.931 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.53 -30.46 63.08 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.479 0.712 . . . . 0.0 111.317 177.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -67.79 -47.34 69.4 Favored 'General case' 0 C--N 1.353 0.731 0 C-N-CA 123.699 0.8 . . . . 0.0 110.959 176.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -56.33 -44.42 79.98 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.386 0.674 . . . . 0.0 110.902 178.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.494 HG22 ' HG3' ' A' ' 78' ' ' ARG . 33.1 mt -72.39 -36.85 56.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 O-C-N 124.483 1.115 . . . . 0.0 111.277 -175.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.42 -44.01 68.79 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.385 0.674 . . . . 0.0 111.124 -178.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -86.31 -8.1 57.97 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.305 0.642 . . . . 0.0 111.998 -177.006 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.69 108.45 1.72 Allowed 'General case' 0 N--CA 1.473 0.71 0 O-C-N 123.709 0.63 . . . . 0.0 111.053 178.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 17.3 m -62.1 -37.22 84.28 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.429 167.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.517 HG21 HG22 ' A' ' 99' ' ' ILE . 76.5 mt -132.25 141.89 44.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 C-N-CA 124.363 1.065 . . . . 0.0 110.346 -176.543 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 27.2 mt -131.85 132.2 61.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 C-N-CA 123.916 0.887 . . . . 0.0 108.812 172.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.4 mp -119.23 133.25 66.67 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 172.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . 0.508 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 11.7 m170 -109.58 84.96 2.01 Favored 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 167.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.504 ' HA ' HG13 ' A' ' 83' ' ' ILE . 28.0 p -81.31 85.39 6.41 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 114.514 -1.221 . . . . 0.0 108.995 174.095 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 35.9 m -126.85 160.59 35.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-O 121.783 0.802 . . . . 0.0 111.982 -171.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -118.2 -19.01 9.18 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 114.007 -1.452 . . . . 0.0 109.116 176.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 5.8 m -132.19 160.49 42.45 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 C-N-CA 125.533 1.533 . . . . 0.0 108.037 176.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 63.8 m -59.47 116.78 17.77 Favored Pre-proline 0 C--O 1.244 0.766 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 174.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.512 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 37.9 Cg_endo -63.27 140.15 75.7 Favored 'Trans proline' 0 C--N 1.372 1.792 0 C-N-CA 121.949 1.766 . . . . 0.0 110.702 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -59.34 -38.11 79.51 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 123.92 0.762 . . . . 0.0 110.551 -174.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.428 ' HB3' ' HG3' ' A' ' 74' ' ' ARG . 4.4 m-20 -104.12 30.45 5.21 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 114.51 -1.223 . . . . 0.0 111.385 -174.13 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.512 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 7.2 p30 -59.89 -27.82 67.03 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.413 0.685 . . . . 0.0 110.858 177.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -60.04 -32.83 71.27 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.258 1.423 . . . . 0.0 112.262 176.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.428 ' HG3' ' HB3' ' A' ' 71' ' ' ASP . 12.1 mmp_? -66.26 -30.82 71.33 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 124.202 1.001 . . . . 0.0 111.715 -176.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -108.29 -2.06 19.56 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.962 -169.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -62.3 -35.27 78.52 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.265 0.626 . . . . 0.0 112.204 -172.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 69.8 p -75.74 -15.43 60.28 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.412 0.685 . . . . 0.0 112.014 -179.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.494 ' HG3' HG22 ' A' ' 55' ' ' ILE . 38.0 mmt180 -109.32 163.22 13.59 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.751 0.82 . . . . 0.0 111.153 -173.872 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 33.2 m-20 -76.42 109.25 9.98 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.463 0.705 . . . . 0.0 110.357 177.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 44.3 t -113.69 137.58 46.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 123.437 0.695 . . . . 0.0 109.918 179.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 79.7 m-85 -101.75 89.82 3.81 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 176.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.508 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 42.5 mt-10 -83.19 125.54 31.66 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.725 -174.631 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.504 HG13 ' HA ' ' A' ' 64' ' ' SER . 42.1 pt -136.09 -174.35 1.08 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 C-N-CA 124.928 1.291 . . . . 0.0 108.84 -179.558 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 22.0 p -87.45 152.3 22.34 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 120.911 0.386 . . . . 0.0 110.02 169.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.764 HD11 ' SG ' ' A' ' 11' ' ' CYS . 8.0 tt -66.26 -27.34 67.87 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.905 178.843 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.585 ' HG2' ' HE3' ' A' ' 90' ' ' LYS . 35.6 tt0 -63.76 -43.45 96.39 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.461 0.705 . . . . 0.0 110.719 173.782 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -61.61 -31.64 71.72 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.577 0.751 . . . . 0.0 110.818 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.02 -33.17 75.4 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.664 0.785 . . . . 0.0 112.433 177.159 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 86.0 mt -79.03 -46.79 23.44 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.846 0 C-N-CA 123.634 0.773 . . . . 0.0 110.524 -177.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.585 ' HE3' ' HG2' ' A' ' 86' ' ' GLN . 18.6 ptpt -81.9 -43.04 18.69 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.114 0.566 . . . . 0.0 111.994 -174.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 62.9 t30 -113.77 28.49 8.72 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.762 0.825 . . . . 0.0 110.907 -169.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . 0.494 ' HB3' ' HB1' ' A' ' 24' ' ' ALA . . . -45.02 -62.1 1.37 Allowed 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -175.562 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.56 -36.51 82.9 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.056 -0.974 . . . . 0.0 110.913 -179.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -61.1 -48.54 85.45 Favored Glycine 0 C--N 1.354 1.569 0 O-C-N 124.616 1.198 . . . . 0.0 112.752 -178.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 22.5 mt -55.74 -56.77 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.169 0.988 . . . . 0.0 110.245 178.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.415 HG21 ' OH ' ' A' ' 34' ' ' TYR . 1.7 mp -55.75 -50.91 64.85 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.048 0 O-C-N 124.247 0.967 . . . . 0.0 111.71 -177.342 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -32.19 73.14 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 112.041 0.386 . . . . 0.0 112.041 -176.577 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -64.81 -39.02 92.9 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 123.7 0.625 . . . . 0.0 109.734 178.234 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . 0.517 HG22 HG21 ' A' ' 60' ' ' ILE . 53.2 mt -73.14 -39.07 56.32 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.983 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -56.7 -48.99 76.47 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.973 0.909 . . . . 0.0 111.243 178.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -74.66 -32.35 62.21 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 123.631 0.582 . . . . 0.0 111.483 -175.282 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 69.3 mtm -66.02 -47.75 73.39 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 122.582 0.353 . . . . 0.0 110.688 175.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 30.5 mt -68.02 -39.18 81.09 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.411 179.103 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.15 -28.65 69.56 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.045 0.538 . . . . 0.0 111.083 177.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 18.2 t -74.15 -43.27 58.05 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 123.155 0.582 . . . . 0.0 110.949 -178.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -76.63 -34.88 58.32 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 122.93 0.492 . . . . 0.0 111.513 -179.144 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -75.85 -24.1 55.76 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 122.966 0.507 . . . . 0.0 111.574 -178.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 32.3 mm-40 . . . . . 0 N--CA 1.478 0.964 0 CA-C-O 118.458 -0.782 . . . . 0.0 109.789 177.608 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 43.9 pttt . . . . . 0 N--CA 1.471 0.577 0 CA-C-O 120.676 0.275 . . . . 0.0 110.607 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.589 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.1 tmtp? -141.25 137.37 32.49 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 -170.187 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.482 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 10.2 tt -130.01 130.32 44.84 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 178.381 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.5 HD13 HD12 ' A' ' 50' ' ' LEU . 14.2 pt -121.34 165.61 16.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 172.589 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.549 ' HB1' HG12 ' A' ' 38' ' ' ILE . . . -152.09 169.15 23.11 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.641 176.51 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.9 tt -141.45 115.46 9.25 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.516 ' HA ' ' O ' ' A' ' 64' ' ' SER . 62.1 m -107.24 111.61 24.09 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 177.68 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.448 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -125.69 112.66 16.37 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 122.474 0.31 . . . . 0.0 111.106 -175.181 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.501 ' HB2' HD11 ' A' ' 85' ' ' LEU . 36.0 t -127.43 136.2 28.58 Favored Pre-proline 0 N--CA 1.473 0.693 0 C-N-CA 123.791 0.836 . . . . 0.0 110.442 -179.261 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -76.07 -19.48 15.65 Favored 'Trans proline' 0 C--N 1.365 1.447 0 C-N-CA 122.972 2.448 . . . . 0.0 112.791 177.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.451 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 21.7 mmt -71.89 -31.94 66.93 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.513 0.725 . . . . 0.0 110.663 -178.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 149.24 175.67 21.82 Favored Glycine 0 C--N 1.348 1.216 0 CA-C-N 115.789 -0.642 . . . . 0.0 112.675 177.198 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.6 mt -73.67 -19.57 60.79 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.582 0.753 . . . . 0.0 112.509 -179.395 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.04 -44.09 87.2 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-O 121.189 0.518 . . . . 0.0 111.325 177.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 11.9 t-160 -66.69 -41.51 87.93 Favored 'General case' 0 C--O 1.247 0.923 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.275 179.075 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 34.2 p -66.77 -32.78 74.29 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.99 -178.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.6 m-30 -69.49 -31.63 70.01 Favored 'General case' 0 C--N 1.354 0.772 0 C-N-CA 123.246 0.618 . . . . 0.0 111.25 178.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 64.5 mtm -67.01 -41.15 87.14 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-O 120.639 0.257 . . . . 0.0 110.901 175.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.14 -44.55 83.88 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.065 174.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.13 -41.28 97.27 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.954 0.901 . . . . 0.0 110.895 -177.415 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -57.17 -54.75 43.21 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.981 0.912 . . . . 0.0 109.949 177.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.06 -42.87 93.79 Favored 'General case' 0 CA--C 1.553 1.06 0 CA-C-N 114.953 -1.021 . . . . 0.0 111.99 -174.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.409 HD13 ' OG ' ' A' ' 64' ' ' SER . 89.2 mt -68.11 -35.77 78.68 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 123.13 0.572 . . . . 0.0 111.265 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.521 ' HA ' HG23 ' A' ' 36' ' ' VAL . 35.6 tt0 -62.19 -53.0 61.56 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 123.837 0.71 . . . . 0.0 109.725 -178.455 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.434 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 45.3 mt-10 -54.59 -46.77 73.82 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 114.547 -1.206 . . . . 0.0 110.402 179.442 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.58 -52.12 67.03 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.323 1.049 . . . . 0.0 111.729 -178.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.94 -24.31 67.48 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 178.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 50.5 t -77.09 -42.35 31.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.414 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 19.6 mm-40 -66.67 -28.39 68.42 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 114.604 -1.18 . . . . 0.0 110.344 175.24 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -80.18 -25.08 39.89 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.211 1.005 . . . . 0.0 111.923 176.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.96 32.74 7.74 Favored Glycine 0 C--N 1.344 0.999 0 N-CA-C 114.264 0.466 . . . . 0.0 114.264 170.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -102.4 163.48 12.21 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 117.36 0.58 . . . . 0.0 109.592 168.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.589 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 41.0 tt0 -73.66 124.97 26.99 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 106.502 -1.666 . . . . 0.0 106.502 158.509 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.521 HG23 ' HA ' ' A' ' 26' ' ' GLU . 13.5 p -111.27 137.32 44.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 CA-C-N 118.635 0.652 . . . . 0.0 110.72 -174.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 45.0 tptt -148.21 111.77 5.02 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 178.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.549 HG12 ' HB1' ' A' ' 7' ' ' ALA . 48.9 mt -116.94 110.63 31.98 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 122.602 0.361 . . . . 0.0 111.891 -173.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -77.92 115.25 17.52 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 123.238 0.615 . . . . 0.0 109.658 176.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 7.0 p -95.76 108.09 20.38 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.938 177.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.551 ' HG2' HG12 ' A' ' 46' ' ' ILE . 42.2 mt-30 -100.97 154.02 19.04 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.256 0.623 . . . . 0.0 110.679 176.2 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -171.08 -178.39 41.56 Favored Glycine 0 C--O 1.238 0.379 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.617 178.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.34 -26.05 66.3 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.089 0.556 . . . . 0.0 111.327 178.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -65.8 -39.41 90.91 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.495 0.718 . . . . 0.0 110.117 171.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 142.18 -151.99 23.32 Favored Glycine 0 C--N 1.341 0.852 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.969 -178.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.551 HG12 ' HG2' ' A' ' 41' ' ' GLN . 65.2 mt -113.21 145.25 19.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 123.683 0.793 . . . . 0.0 110.067 -174.112 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -140.01 149.28 43.02 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.865 0.866 . . . . 0.0 110.137 -179.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 44.1 t30 79.1 -49.94 0.43 Allowed 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 126.487 1.915 . . . . 0.0 110.043 178.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 21.7 tpp180 66.86 122.82 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.869 1.667 . . . . 0.0 113.339 169.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.5 HD12 HD13 ' A' ' 6' ' ' ILE . 39.4 mt -92.31 146.41 23.72 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 114.772 -1.104 . . . . 0.0 110.55 172.481 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.418 ' O ' HG13 ' A' ' 55' ' ' ILE . 66.4 p -105.12 166.63 10.26 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.744 0.818 . . . . 0.0 109.693 176.478 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.06 -29.49 69.77 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 122.931 0.492 . . . . 0.0 110.562 176.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -72.27 -41.14 67.06 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.43 177.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -59.5 -43.49 93.34 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 122.836 0.454 . . . . 0.0 110.927 177.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.618 HG22 ' HG3' ' A' ' 78' ' ' ARG . 23.1 mt -74.38 -32.32 30.62 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 O-C-N 123.961 0.788 . . . . 0.0 110.891 -176.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.57 -41.5 62.83 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.434 0.694 . . . . 0.0 111.619 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -91.27 -3.04 57.26 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.554 0.742 . . . . 0.0 111.398 -177.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.55 106.22 1.11 Allowed 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 122.948 0.499 . . . . 0.0 110.437 176.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 27.7 m -60.26 -36.92 78.9 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.846 0.858 . . . . 0.0 109.44 169.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 72.8 mt -137.27 143.35 34.68 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 123.904 0.882 . . . . 0.0 110.315 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.502 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 26.3 mt -127.81 135.64 62.48 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 171.46 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -124.12 111.16 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 CA-C-N 118.405 0.548 . . . . 0.0 109.526 173.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 12.1 m170 -88.24 85.28 6.89 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-O 121.586 0.708 . . . . 0.0 109.524 174.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.516 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 25.0 m -81.01 82.64 6.92 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.542 176.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 29.5 m -125.93 155.78 35.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 CA-C-O 121.965 0.888 . . . . 0.0 112.209 -170.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -107.87 -25.07 11.39 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 113.91 -1.496 . . . . 0.0 109.365 175.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 15.0 m -131.4 171.15 18.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 125.328 1.451 . . . . 0.0 108.664 176.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 22.1 m -64.72 116.87 32.85 Favored Pre-proline 0 CA--C 1.55 0.974 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 171.533 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.43 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 37.0 Cg_endo -66.71 145.56 75.91 Favored 'Trans proline' 0 C--N 1.372 1.773 0 C-N-CA 121.506 1.471 . . . . 0.0 110.388 174.393 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 -64.52 -28.98 70.02 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.241 0.616 . . . . 0.0 111.406 -176.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.577 ' HB3' HH11 ' A' ' 74' ' ' ARG . 0.9 OUTLIER -103.17 18.24 22.19 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.468 1.107 . . . . 0.0 111.616 -173.901 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.43 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 6.7 p30 -56.65 -32.4 65.32 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 124.385 1.074 . . . . 0.0 113.018 -175.274 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.424 ' HA ' ' HB2' ' A' ' 76' ' ' GLU . 2.1 pp20? -76.38 -18.16 59.01 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.704 0.802 . . . . 0.0 112.515 -171.17 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.577 HH11 ' HB3' ' A' ' 71' ' ' ASP . 41.0 mtp180 -67.4 -26.68 66.55 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.018 0.927 . . . . 0.0 111.312 174.063 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -104.01 -4.36 23.43 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 114.463 -1.244 . . . . 0.0 111.017 -176.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.424 ' HB2' ' HA ' ' A' ' 73' ' ' GLU . 37.9 tt0 -61.96 -32.2 72.61 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 124.579 1.152 . . . . 0.0 112.474 -173.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 32.0 t -92.13 3.91 54.29 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.392 0.677 . . . . 0.0 111.836 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.618 ' HG3' HG22 ' A' ' 55' ' ' ILE . 39.8 mmt180 -117.61 166.3 12.56 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.718 0.807 . . . . 0.0 111.446 -177.036 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -79.35 94.24 5.46 Favored 'General case' 0 C--O 1.244 0.789 0 C-N-CA 123.675 0.79 . . . . 0.0 110.673 -177.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.502 ' HA ' ' HB ' ' A' ' 61' ' ' ILE . 60.8 t -104.97 141.35 20.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 124.151 0.98 . . . . 0.0 110.727 -178.369 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -114.52 88.71 2.92 Favored 'General case' 0 C--O 1.24 0.553 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 174.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -84.59 120.97 26.97 Favored 'General case' 0 C--N 1.346 0.442 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.363 -174.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.432 HD12 ' HB3' ' A' ' 87' ' ' ASP . 48.5 pt -125.24 -179.33 2.35 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 124.434 1.094 . . . . 0.0 109.466 177.491 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 24.1 p -76.83 148.22 36.68 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.533 168.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.501 HD11 ' HB2' ' A' ' 11' ' ' CYS . 4.7 tt -62.51 -28.64 69.98 Favored 'General case' 0 N--CA 1.481 1.098 0 O-C-N 124.046 0.841 . . . . 0.0 111.27 179.47 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -64.3 -44.92 90.14 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.285 0.634 . . . . 0.0 111.266 176.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.432 ' HB3' HD12 ' A' ' 83' ' ' ILE . 24.3 t70 -59.98 -31.47 69.94 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.542 0.737 . . . . 0.0 110.649 -177.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.19 -26.61 64.92 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.943 0.897 . . . . 0.0 112.922 179.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 57.0 mt -85.24 -40.1 14.55 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.964 0 C-N-CA 123.111 0.564 . . . . 0.0 110.459 -179.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.41 ' HZ1' ' HB3' ' A' ' 90' ' ' LYS . 0.1 OUTLIER -88.44 -56.1 3.45 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 122.793 0.437 . . . . 0.0 111.795 -176.625 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -95.46 20.53 9.35 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.843 0.857 . . . . 0.0 110.959 -170.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . 0.455 ' HA ' HD12 ' A' ' 95' ' ' ILE . . . -43.22 -62.34 1.08 Allowed 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 124.607 1.163 . . . . 0.0 114.132 -172.575 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.21 -34.59 75.35 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.028 178.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.07 -43.04 99.38 Favored Glycine 0 C--N 1.351 1.407 0 O-C-N 124.495 1.122 . . . . 0.0 112.758 178.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.455 HD12 ' HA ' ' A' ' 92' ' ' ALA . 22.2 mt -62.37 -57.96 9.71 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 C-N-CA 124.185 0.994 . . . . 0.0 109.973 -177.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.403 HG13 HD11 ' A' ' 5' ' ' LEU . 2.0 mp -58.4 -45.71 89.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 O-C-N 124.093 0.87 . . . . 0.0 110.608 -175.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 2.5 pptp? -69.72 -27.62 65.13 Favored 'General case' 0 N--CA 1.48 1.047 0 O-C-N 123.605 0.565 . . . . 0.0 111.556 -177.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 38.9 mm-40 -62.91 -42.55 99.83 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 174.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 13.1 mt -78.43 -33.36 17.22 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.387 -175.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -54.79 -53.69 51.87 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.604 1.162 . . . . 0.0 111.281 171.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -72.16 -33.77 67.97 Favored 'General case' 0 N--CA 1.48 1.064 0 O-C-N 123.594 0.559 . . . . 0.0 111.25 -175.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 71.1 mtm -64.29 -49.3 72.34 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 122.937 0.495 . . . . 0.0 110.592 177.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 36.8 mt -67.05 -42.16 88.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 C-N-CA 123.232 0.613 . . . . 0.0 110.302 177.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.88 -12.56 61.61 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 122.925 0.49 . . . . 0.0 111.843 -179.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 29.9 t -92.4 -39.71 11.28 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 122.609 0.364 . . . . 0.0 110.804 176.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -78.71 -28.18 45.07 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.757 0.423 . . . . 0.0 111.458 -177.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.7 mm-40 -84.35 -41.33 16.87 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.175 0.59 . . . . 0.0 109.876 178.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 76.3 mm-40 . . . . . 0 C--O 1.255 1.35 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.632 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.622 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 13.4 pttt . . . . . 0 C--O 1.247 0.962 0 CA-C-O 121.291 0.567 . . . . 0.0 111.179 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.515 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.2 tmtp? -142.96 142.48 31.66 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 121.102 0.477 . . . . 0.0 109.81 -171.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.476 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.0 tt -131.34 136.17 47.86 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 176.084 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.422 HG23 ' HE2' ' A' ' 4' ' ' LYS . 17.1 pt -126.72 159.1 36.76 Favored 'Isoleucine or valine' 0 C--O 1.239 0.509 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 170.306 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.563 ' HB2' HG12 ' A' ' 38' ' ' ILE . . . -145.28 168.91 19.32 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 176.534 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.417 HD23 ' OE1' ' A' ' 41' ' ' GLN . 4.3 tt -144.88 112.09 6.02 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 -176.915 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.509 ' HA ' ' O ' ' A' ' 64' ' ' SER . 49.9 m -101.25 109.65 21.54 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.068 0.947 . . . . 0.0 109.12 176.385 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -127.47 115.81 19.46 Favored 'General case' 0 N--CA 1.489 1.513 0 CA-C-O 120.839 0.352 . . . . 0.0 110.674 -178.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.535 ' HB2' HD12 ' A' ' 85' ' ' LEU . 44.0 t -123.43 142.93 40.06 Favored Pre-proline 0 N--CA 1.476 0.855 0 C-N-CA 123.926 0.89 . . . . 0.0 110.247 -176.501 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.502 ' HD2' ' HG ' ' A' ' 11' ' ' CYS . 71.8 Cg_endo -72.58 -16.64 26.97 Favored 'Trans proline' 0 C--N 1.37 1.687 0 C-N-CA 122.938 2.425 . . . . 0.0 113.093 174.404 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 82.8 mtp -72.67 -54.91 7.72 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.393 0.677 . . . . 0.0 111.078 -179.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 161.3 -177.76 37.5 Favored Glycine 0 C--N 1.342 0.875 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.845 -175.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 39.9 mt -75.19 -14.44 60.54 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -177.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.41 -49.73 76.42 Favored 'General case' 0 C--O 1.249 1.066 0 CA-C-O 121.337 0.589 . . . . 0.0 111.086 177.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.474 ' HA ' ' HE2' ' A' ' 20' ' ' MET . 5.8 t-160 -64.98 -40.24 94.67 Favored 'General case' 0 C--O 1.248 1.004 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.224 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 32.7 p -67.3 -36.43 81.49 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.307 -178.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.8 m-30 -69.26 -32.84 72.31 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.127 0.571 . . . . 0.0 111.453 -178.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' MET . . . . . 0.474 ' HE2' ' HA ' ' A' ' 17' ' ' HIS . 62.5 mtm -67.93 -38.2 82.58 Favored 'General case' 0 N--CA 1.483 1.175 0 O-C-N 123.175 0.297 . . . . 0.0 110.81 175.76 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -69.7 -40.53 76.26 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.364 174.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.7 -37.1 81.81 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.899 0.88 . . . . 0.0 110.562 -178.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.473 ' O ' ' HG3' ' A' ' 27' ' ' GLU . 32.6 tt0 -62.52 -53.01 61.14 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.846 175.661 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.75 -47.5 77.98 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 115.587 -0.733 . . . . 0.0 112.183 -173.074 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 85.1 mt -64.43 -34.46 78.25 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.07 0.548 . . . . 0.0 111.431 178.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.479 ' O ' HG22 ' A' ' 30' ' ' VAL . 38.3 tt0 -61.92 -54.76 37.5 Favored 'General case' 0 C--N 1.349 0.578 0 O-C-N 123.686 0.616 . . . . 0.0 109.894 177.618 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.554 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 44.9 mt-10 -49.42 -52.12 30.78 Favored 'General case' 0 N--CA 1.48 1.048 0 O-C-N 124.632 1.207 . . . . 0.0 110.73 179.54 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.451 ' HB2' ' HA ' ' A' ' 93' ' ' ALA . . . -56.18 -52.05 65.81 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.807 1.243 . . . . 0.0 112.098 -179.664 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.38 -22.52 66.25 Favored 'General case' 0 CA--C 1.55 0.947 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 179.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.479 HG22 ' O ' ' A' ' 26' ' ' GLU . 55.8 t -76.25 -37.5 32.08 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.256 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 178.597 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.554 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 16.2 mm-40 -76.48 -19.89 57.55 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 114.725 -1.125 . . . . 0.0 110.475 178.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -78.44 -19.0 54.11 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.672 0.789 . . . . 0.0 111.198 172.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 97.01 1.24 59.75 Favored Glycine 0 C--N 1.349 1.263 0 N-CA-C 115.2 0.84 . . . . 0.0 115.2 165.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.622 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -108.24 173.58 6.26 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-N 117.85 0.825 . . . . 0.0 112.089 176.255 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.515 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 34.2 tt0 -71.07 145.91 49.6 Favored 'General case' 0 C--N 1.35 0.612 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.656 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.476 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 7.4 p -135.34 128.64 48.72 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 122.741 0.416 . . . . 0.0 111.165 -179.566 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.5 tptt -135.75 115.55 13.02 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 176.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.563 HG12 ' HB2' ' A' ' 7' ' ' ALA . 49.3 mt -117.09 113.42 42.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 N-CA-C 111.995 0.369 . . . . 0.0 111.995 -176.16 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -75.62 147.81 39.25 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.894 0.878 . . . . 0.0 109.221 171.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.424 HG23 ' HB2' ' A' ' 9' ' ' CYS . 13.6 p -134.57 123.93 24.65 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.156 0.983 . . . . 0.0 109.208 -176.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.455 ' HG2' HG22 ' A' ' 46' ' ' ILE . 23.7 mt-30 -125.62 136.5 53.33 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 -176.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -163.59 -160.42 11.58 Favored Glycine 0 N--CA 1.465 0.605 0 C-N-CA 121.851 -0.214 . . . . 0.0 112.677 -179.1 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.91 -28.77 69.16 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.957 0.903 . . . . 0.0 111.787 177.235 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -86.27 2.35 47.54 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.021 0.928 . . . . 0.0 111.51 -178.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 94.22 -157.48 22.65 Favored Glycine 0 C--N 1.34 0.773 0 N-CA-C 112.134 -0.386 . . . . 0.0 112.134 -176.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.455 HG22 ' HG2' ' A' ' 41' ' ' GLN . 40.8 mt -106.44 144.86 14.94 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 C-N-CA 123.601 0.76 . . . . 0.0 110.306 -172.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -143.02 148.12 36.23 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.005 1.322 . . . . 0.0 108.822 -174.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 10.1 t30 58.86 40.96 22.14 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 124.362 1.065 . . . . 0.0 110.517 175.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 9.5 tpp180 -47.35 133.28 12.62 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.763 1.625 . . . . 0.0 113.069 -172.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 47.5 mt -83.35 126.75 33.03 Favored 'General case' 0 C--O 1.242 0.693 0 C-N-CA 123.879 0.872 . . . . 0.0 110.383 173.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.415 ' O ' HG13 ' A' ' 55' ' ' ILE . 37.0 p -88.79 164.5 15.21 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.664 178.323 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.74 -30.37 67.45 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.148 0.579 . . . . 0.0 110.963 175.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.415 ' O ' ' HG3' ' A' ' 57' ' ' GLU . 29.2 tt0 -66.91 -48.48 68.57 Favored 'General case' 0 C--N 1.355 0.819 0 C-N-CA 122.972 0.509 . . . . 0.0 110.57 175.36 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -50.84 -44.96 59.47 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 123.504 0.721 . . . . 0.0 111.355 177.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 51' ' ' THR . 26.4 mt -72.5 -35.68 51.99 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.051 0 CA-C-N 114.449 -1.25 . . . . 0.0 111.107 -177.152 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.45 -37.17 77.22 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.49 0.716 . . . . 0.0 111.172 179.41 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.415 ' HG3' ' O ' ' A' ' 53' ' ' GLN . 57.6 mt-10 -75.13 -33.46 61.57 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.746 0.818 . . . . 0.0 110.773 177.723 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -54.93 99.81 0.03 OUTLIER 'General case' 0 C--N 1.355 0.81 0 O-C-N 124.699 1.249 . . . . 0.0 112.315 -172.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 23.8 m -63.19 -32.9 74.4 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-N 114.531 -1.213 . . . . 0.0 109.241 168.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.454 HG23 HG22 ' A' ' 99' ' ' ILE . 81.5 mt -133.71 139.04 49.6 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 C-N-CA 124.367 1.067 . . . . 0.0 109.827 -179.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.6 mt -131.39 130.55 62.94 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 173.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.3 mp -116.25 126.09 73.58 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 172.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 14.8 m170 -99.98 86.09 3.19 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 167.271 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.509 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 20.0 p -80.41 81.87 6.57 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 114.633 -1.167 . . . . 0.0 108.94 174.363 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.4 ' O ' ' HA ' ' A' ' 84' ' ' THR . 29.8 m -129.87 165.05 30.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.225 -170.377 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -121.98 -14.83 7.95 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.445 1.098 . . . . 0.0 109.318 170.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 9.4 m -127.97 177.05 6.45 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 125.013 1.325 . . . . 0.0 109.516 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 37.2 m -75.9 118.47 71.34 Favored Pre-proline 0 CA--C 1.545 0.75 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 173.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.527 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 48.4 Cg_endo -65.97 146.81 83.63 Favored 'Trans proline' 0 C--N 1.373 1.82 0 C-N-CA 122.141 1.894 . . . . 0.0 111.18 175.239 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -65.33 -41.06 94.36 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.341 0.657 . . . . 0.0 110.624 -177.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -88.39 15.2 8.14 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 115.349 -0.841 . . . . 0.0 112.146 -175.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.527 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 6.0 p30 -55.69 -28.62 56.56 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 123.859 0.864 . . . . 0.0 112.041 -177.144 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.541 ' HG3' ' HG3' ' A' ' 74' ' ' ARG . 8.9 pt-20 -56.53 -37.22 70.18 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 124.694 1.198 . . . . 0.0 112.343 175.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.541 ' HG3' ' HG3' ' A' ' 73' ' ' GLU . 81.4 mtt85 -80.11 -17.05 53.61 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.815 1.246 . . . . 0.0 112.079 -176.713 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.472 ' HB3' HG23 ' A' ' 80' ' ' VAL . 66.6 m-85 -107.4 -2.68 20.31 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.574 0.749 . . . . 0.0 110.999 178.041 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -55.06 -49.04 72.62 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.494 1.118 . . . . 0.0 112.663 -172.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 81.0 p -91.6 0.51 57.49 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.127 0.571 . . . . 0.0 112.379 -176.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -104.62 161.52 14.06 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.276 0.63 . . . . 0.0 111.202 -170.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 -72.67 93.57 1.65 Allowed 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.355 0.662 . . . . 0.0 110.929 -175.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.472 HG23 ' HB3' ' A' ' 75' ' ' PHE . 44.2 t -116.85 133.01 64.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 123.206 0.602 . . . . 0.0 110.86 -175.077 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 66.1 m-85 -105.84 91.3 3.69 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.776 1.23 . . . . 0.0 108.553 177.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -78.88 110.12 13.78 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.611 0.764 . . . . 0.0 110.87 -175.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.434 HG13 ' HA ' ' A' ' 64' ' ' SER . 42.1 pt -117.31 -173.78 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 124.471 1.109 . . . . 0.0 109.561 176.043 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.4 ' HA ' ' O ' ' A' ' 65' ' ' VAL . 40.4 p -86.8 149.73 24.64 Favored 'General case' 0 C--O 1.239 0.539 0 CA-C-O 121.071 0.462 . . . . 0.0 110.376 170.449 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.535 HD12 ' HB2' ' A' ' 11' ' ' CYS . 7.2 tt -64.52 -30.61 71.64 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.779 177.149 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -64.47 -43.79 93.1 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.879 176.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -63.74 -28.84 70.16 Favored 'General case' 0 N--CA 1.479 1.015 0 O-C-N 123.516 0.51 . . . . 0.0 110.629 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.1 -32.89 74.82 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.739 0.816 . . . . 0.0 112.292 177.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 64.6 mt -79.96 -42.69 22.28 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.835 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.414 -177.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -85.85 -47.34 9.77 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -175.086 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -106.15 25.45 10.98 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 124.081 0.952 . . . . 0.0 110.736 -170.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -41.92 -60.79 1.29 Allowed 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 124.253 1.021 . . . . 0.0 113.372 -175.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.451 ' HA ' ' HB2' ' A' ' 28' ' ' ALA . . . -65.0 -34.1 77.64 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.602 -178.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.69 -45.8 93.6 Favored Glycine 0 C--N 1.346 1.103 0 O-C-N 124.183 0.927 . . . . 0.0 112.253 -178.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 22.6 mt -60.1 -57.09 13.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 124.445 1.098 . . . . 0.0 110.266 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.9 mp -56.42 -50.05 74.24 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 O-C-N 123.945 0.778 . . . . 0.0 110.846 -178.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.87 -27.98 67.14 Favored 'General case' 0 N--CA 1.485 1.298 0 O-C-N 123.389 0.431 . . . . 0.0 111.304 -176.245 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.414 ' O ' ' HG3' ' A' ' 102' ' ' MET . 48.4 mm-40 -65.65 -40.78 92.82 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.316 0.646 . . . . 0.0 109.896 175.365 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . 0.454 HG22 HG23 ' A' ' 60' ' ' ILE . 32.7 mt -75.83 -34.05 27.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 N-CA-C 109.152 -0.685 . . . . 0.0 109.152 -176.815 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -60.54 -50.34 73.92 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 114.419 -1.264 . . . . 0.0 111.147 174.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -72.19 -33.3 67.55 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 122.751 0.42 . . . . 0.0 110.969 -176.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.414 ' HG3' ' O ' ' A' ' 98' ' ' GLU . 69.3 mtm -63.63 -58.2 7.69 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 122.751 0.42 . . . . 0.0 110.148 177.689 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 63.4 mt -62.38 -41.29 91.17 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.929 0 O-C-N 123.893 0.746 . . . . 0.0 110.587 -179.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.22 -32.52 74.24 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 122.541 0.337 . . . . 0.0 111.562 179.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 38.5 t -73.52 -37.43 65.65 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-O 120.887 0.375 . . . . 0.0 110.717 -176.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -85.16 -25.77 27.23 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.808 -177.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -85.6 -40.17 16.53 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 122.811 0.444 . . . . 0.0 111.516 178.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 81.8 mm-40 . . . . . 0 CA--C 1.55 0.978 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 174.943 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.6 pttt . . . . . 0 N--CA 1.484 1.251 0 CA-C-O 121.078 0.466 . . . . 0.0 110.782 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.538 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 3.8 tmtp? -144.03 143.67 31.29 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -173.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.488 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.0 tt -134.56 142.18 46.9 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 177.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.44 HD11 ' HA ' ' A' ' 55' ' ' ILE . 21.6 pt -133.39 168.43 24.13 Favored 'Isoleucine or valine' 0 C--O 1.243 0.742 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 170.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.554 ' HB2' HG12 ' A' ' 38' ' ' ILE . . . -152.3 169.99 21.15 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.342 175.384 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.4 tt -140.24 112.19 7.57 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 106.811 -1.551 . . . . 0.0 106.811 178.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.491 ' HB2' HG21 ' A' ' 40' ' ' THR . 68.9 m -102.05 109.35 21.04 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 177.263 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.451 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -128.71 113.79 15.81 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 122.759 0.424 . . . . 0.0 111.273 -176.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.72 ' SG ' HD12 ' A' ' 85' ' ' LEU . 2.2 m -130.98 146.61 62.9 Favored Pre-proline 0 N--CA 1.474 0.727 0 C-N-CA 123.481 0.712 . . . . 0.0 110.111 174.038 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -88.39 15.76 2.01 Favored 'Trans proline' 0 C--N 1.37 1.694 0 C-N-CA 123.331 2.688 . . . . 0.0 111.427 175.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 16.9 tpt -138.27 76.13 1.56 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.455 1.102 . . . . 0.0 109.16 178.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.77 132.31 4.25 Favored Glycine 0 C--N 1.34 0.802 0 CA-C-N 115.123 -0.944 . . . . 0.0 114.186 167.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 22.4 mt -66.39 -22.45 66.24 Favored 'General case' 0 C--O 1.216 -0.707 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 163.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.21 -40.09 73.48 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.316 0.646 . . . . 0.0 110.921 171.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.492 ' ND1' HD23 ' A' ' 85' ' ' LEU . 4.5 t-80 -68.99 -45.13 71.39 Favored 'General case' 0 C--O 1.245 0.865 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 178.39 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 35.5 p -66.19 -30.0 70.38 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.798 -178.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -80.12 -27.21 39.18 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.181 0.593 . . . . 0.0 111.418 -178.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 66.6 mtm -66.7 -38.72 87.32 Favored 'General case' 0 N--CA 1.482 1.142 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 171.098 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -72.55 -40.15 66.92 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.518 176.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.61 -51.58 58.54 Favored 'General case' 0 C--O 1.217 -0.635 0 C-N-CA 123.851 0.86 . . . . 0.0 109.979 -177.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.426 HE21 ' HG2' ' A' ' 27' ' ' GLU . 23.8 tp60 -62.81 -38.89 92.49 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 123.766 0.666 . . . . 0.0 110.52 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.514 ' HB1' ' HB1' ' A' ' 92' ' ' ALA . . . -62.42 -53.43 54.94 Favored 'General case' 0 CA--C 1.551 1.013 0 O-C-N 123.642 0.589 . . . . 0.0 111.419 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 93.4 mt -66.47 -29.86 70.07 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 123.491 0.716 . . . . 0.0 111.295 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.52 ' HA ' HG21 ' A' ' 36' ' ' VAL . 38.4 tt0 -64.84 -54.73 26.51 Favored 'General case' 0 C--N 1.346 0.449 0 C-N-CA 123.581 0.753 . . . . 0.0 109.807 -179.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.475 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 12.7 mm-40 -55.21 -49.09 72.82 Favored 'General case' 0 N--CA 1.479 1.025 0 O-C-N 124.505 1.128 . . . . 0.0 110.355 178.64 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.426 ' HB1' ' HA ' ' A' ' 93' ' ' ALA . . . -56.78 -46.68 81.35 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.656 1.183 . . . . 0.0 111.795 -178.102 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.78 -28.96 68.05 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 115.147 -0.933 . . . . 0.0 112.681 177.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 26' ' ' GLU . 56.1 t -72.86 -37.35 54.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 179.148 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 9.1 mm-40 -72.21 -26.98 62.26 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.641 178.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.45 -32.85 72.05 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.294 0.638 . . . . 0.0 110.902 172.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 104.33 18.8 12.42 Favored Glycine 0 C--N 1.346 1.121 0 N-CA-C 114.606 0.602 . . . . 0.0 114.606 169.359 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -122.19 -179.85 4.3 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.174 0.59 . . . . 0.0 111.334 175.51 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.538 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 12.2 tp10 -73.31 152.53 40.91 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.093 178.448 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.52 HG21 ' HA ' ' A' ' 26' ' ' GLU . 7.3 p -142.45 128.41 17.81 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 C-N-CA 123.296 0.638 . . . . 0.0 110.796 178.897 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.8 tptt -136.87 114.82 11.4 Favored 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 176.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.554 HG12 ' HB2' ' A' ' 7' ' ' ALA . 50.6 mt -119.17 116.39 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 122.746 0.418 . . . . 0.0 111.786 -173.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -87.08 119.81 27.69 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.894 0.877 . . . . 0.0 110.024 175.467 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.491 HG21 ' HB2' ' A' ' 9' ' ' CYS . 26.7 p -99.71 109.21 21.68 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.679 0.792 . . . . 0.0 111.144 178.606 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.451 ' O ' ' HA ' ' A' ' 10' ' ' ALA . 46.4 mt-30 -96.93 139.4 33.02 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.425 0.69 . . . . 0.0 110.095 173.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -164.89 175.73 40.78 Favored Glycine 0 C--N 1.341 0.806 0 N-CA-C 111.882 -0.487 . . . . 0.0 111.882 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.85 -12.33 60.35 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 122.625 0.37 . . . . 0.0 111.504 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -77.71 -28.22 50.85 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.27 0.628 . . . . 0.0 110.147 171.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 143.26 -169.79 25.68 Favored Glycine 0 C--N 1.346 1.137 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.391 -177.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 64.5 mt -113.29 145.5 19.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 123.123 0.569 . . . . 0.0 109.465 176.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -142.86 151.31 40.94 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.349 0.659 . . . . 0.0 110.197 -176.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.432 ' HB3' ' O ' ' A' ' 38' ' ' ILE . 10.4 t30 58.74 45.88 15.05 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 125.017 1.327 . . . . 0.0 110.075 178.173 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.6 tpp180 -52.21 120.77 5.83 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.111 1.364 . . . . 0.0 112.16 -175.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 37.5 mt -64.11 146.12 54.75 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.276 1.03 . . . . 0.0 110.979 172.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 67.2 p -104.29 167.3 9.84 Favored 'General case' 0 C--O 1.244 0.77 0 C-N-CA 123.304 0.642 . . . . 0.0 110.145 175.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.99 -35.27 74.66 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.049 0.54 . . . . 0.0 110.321 174.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 -60.98 -51.84 67.54 Favored 'General case' 0 CA--C 1.546 0.81 0 CA-C-N 114.393 -1.276 . . . . 0.0 110.53 174.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 31.3 m-20 -53.67 -46.28 70.59 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 123.633 0.773 . . . . 0.0 112.261 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.544 HG23 ' HG3' ' A' ' 78' ' ' ARG . 23.0 mt -73.2 -31.01 32.81 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.078 0 O-C-N 123.834 0.708 . . . . 0.0 110.974 -175.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.64 -37.57 70.84 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.229 0.612 . . . . 0.0 111.103 177.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -77.33 -26.42 52.12 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.032 0.933 . . . . 0.0 111.118 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -56.93 99.65 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.063 0.945 . . . . 0.0 112.431 -175.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 27.4 m -63.56 -37.9 89.09 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 115.156 -0.929 . . . . 0.0 108.901 168.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.488 HG23 HG21 ' A' ' 99' ' ' ILE . 80.5 mt -128.45 140.71 48.48 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.767 179.369 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.448 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 33.2 mt -131.3 137.23 56.02 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 173.006 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.2 mp -123.29 112.84 35.2 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 173.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 9.9 m170 -89.91 84.03 6.19 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-O 121.815 0.817 . . . . 0.0 108.972 171.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.449 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 23.4 p -83.27 84.58 7.44 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 114.302 -1.317 . . . . 0.0 108.926 177.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.402 ' O ' ' HA ' ' A' ' 84' ' ' THR . 34.6 m -127.88 163.61 31.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 121.535 0.684 . . . . 0.0 111.988 -170.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -113.67 -28.78 7.34 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.761 1.224 . . . . 0.0 108.98 174.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 12.9 m -124.18 162.67 25.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 125.18 1.392 . . . . 0.0 108.591 176.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 55.4 m -68.67 116.52 41.56 Favored Pre-proline 0 CA--C 1.549 0.912 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 174.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.558 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 31.1 Cg_endo -64.35 150.43 88.29 Favored 'Trans proline' 0 C--N 1.375 1.97 0 C-N-CA 122.466 2.111 . . . . 0.0 112.081 178.346 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -67.45 -30.95 70.81 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.589 0.756 . . . . 0.0 110.261 178.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.51 ' HB3' ' HD3' ' A' ' 74' ' ' ARG . 3.8 m-20 -94.13 12.73 25.51 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 114.42 -1.264 . . . . 0.0 112.162 -174.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.558 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 59.5 t30 -60.22 -35.29 75.1 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.097 0.959 . . . . 0.0 112.471 -174.695 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.96 -17.86 62.04 Favored 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -175.651 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.51 ' HD3' ' HB3' ' A' ' 71' ' ' ASP . 58.3 mtp180 -64.41 -25.96 68.25 Favored 'General case' 0 N--CA 1.485 1.304 0 CA-C-O 121.427 0.632 . . . . 0.0 111.631 174.525 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -100.69 17.85 20.84 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.652 1.181 . . . . 0.0 110.556 -175.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -50.18 -52.09 38.39 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 125.356 1.462 . . . . 0.0 113.105 -174.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 21.6 t -99.41 5.62 46.27 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.409 0.683 . . . . 0.0 112.082 -171.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.544 ' HG3' HG23 ' A' ' 55' ' ' ILE . 34.7 mmt180 -106.18 145.78 31.09 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.473 0.709 . . . . 0.0 111.063 -173.34 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -68.65 99.58 1.02 Allowed 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.718 0.807 . . . . 0.0 110.923 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.448 ' HA ' ' HB ' ' A' ' 61' ' ' ILE . 57.5 t -109.69 128.25 65.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 123.515 0.726 . . . . 0.0 110.322 -178.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 73.3 m-85 -98.25 92.51 5.75 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 124.423 1.089 . . . . 0.0 108.16 174.363 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -85.76 129.86 34.71 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.473 -175.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.439 HG13 ' HA ' ' A' ' 64' ' ' SER . 41.7 pt -137.45 -172.78 0.78 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.844 0 C-N-CA 124.926 1.29 . . . . 0.0 108.86 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.402 ' HA ' ' O ' ' A' ' 65' ' ' VAL . 26.2 p -84.98 149.98 25.23 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.061 0.458 . . . . 0.0 109.969 167.531 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.72 HD12 ' SG ' ' A' ' 11' ' ' CYS . 8.2 tt -65.42 -29.04 69.68 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.578 177.639 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.475 ' HG2' ' HE3' ' A' ' 90' ' ' LYS . 35.7 tt0 -59.99 -46.06 90.71 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.638 173.703 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -62.41 -32.67 73.54 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.327 0.651 . . . . 0.0 110.633 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.37 -32.64 74.12 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.584 0.754 . . . . 0.0 112.365 176.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 94.3 mt -78.21 -50.72 18.93 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 123.491 0.716 . . . . 0.0 110.713 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.475 ' HE3' ' HG2' ' A' ' 86' ' ' GLN . 18.6 ptpt -82.56 -33.36 28.14 Favored 'General case' 0 N--CA 1.484 1.26 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -172.126 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -120.5 22.99 11.06 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.896 0.879 . . . . 0.0 110.442 -168.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . 0.514 ' HB1' ' HB1' ' A' ' 24' ' ' ALA . . . -42.33 -60.28 1.54 Allowed 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 124.353 1.061 . . . . 0.0 113.428 -174.575 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.426 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . . . -63.42 -36.96 85.45 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.072 -179.782 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -62.13 -47.55 89.06 Favored Glycine 0 C--N 1.355 1.618 0 O-C-N 124.479 1.112 . . . . 0.0 112.078 -177.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.412 ' O ' HG13 ' A' ' 99' ' ' ILE . 23.2 mt -55.79 -58.66 4.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 124.598 1.159 . . . . 0.0 110.333 177.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.8 mp -55.25 -51.3 57.14 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 O-C-N 124.246 0.966 . . . . 0.0 111.043 -177.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.74 -29.53 68.78 Favored 'General case' 0 N--CA 1.486 1.357 0 O-C-N 123.417 0.448 . . . . 0.0 112.163 -175.357 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 59.7 mm-40 -71.25 -32.41 68.72 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.153 0.581 . . . . 0.0 110.381 177.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . 0.488 HG21 HG23 ' A' ' 60' ' ' ILE . 48.0 mt -78.22 -36.23 20.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.33 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -57.86 -48.48 79.66 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 114.446 -1.252 . . . . 0.0 111.275 177.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -74.22 -34.93 63.83 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 123.92 0.762 . . . . 0.0 111.44 -178.173 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 64.5 mtm -64.58 -50.82 65.74 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 122.679 0.392 . . . . 0.0 110.615 178.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 39.2 mt -66.41 -42.45 90.47 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.383 178.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.24 -28.23 69.21 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 117.683 0.22 . . . . 0.0 111.049 178.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 36.8 t -75.03 -41.52 59.1 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 122.044 -0.41 . . . . 0.0 110.364 -178.136 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -78.56 -34.77 46.77 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 122.84 0.456 . . . . 0.0 111.469 -177.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 14.3 mm-40 -82.67 -43.37 16.99 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.072 0.549 . . . . 0.0 111.81 -174.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 . . . . . 0 CA--C 1.554 1.112 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 177.546 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.525 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 4.7 pttt . . . . . 0 N--CA 1.49 1.543 0 CA-C-O 120.796 0.331 . . . . 0.0 110.669 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.53 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 5.0 tmtp? -143.71 144.2 31.75 Favored 'General case' 0 N--CA 1.481 1.091 0 CA-C-O 121.454 0.645 . . . . 0.0 110.66 -175.099 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.489 ' N ' ' HD3' ' A' ' 4' ' ' LYS . 8.8 tt -130.8 135.67 47.97 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 125.246 1.418 . . . . 0.0 107.902 175.04 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.432 HG13 HG21 ' A' ' 61' ' ' ILE . 20.3 pt -126.1 161.94 30.7 Favored 'Isoleucine or valine' 0 C--O 1.242 0.693 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 171.656 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.571 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -148.94 166.61 28.09 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 122.96 0.504 . . . . 0.0 110.015 175.674 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.449 HD23 ' HG3' ' A' ' 41' ' ' GLN . 4.1 tt -136.58 123.38 21.24 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 178.268 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.546 ' HA ' ' O ' ' A' ' 64' ' ' SER . 78.0 m -112.51 112.63 24.31 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 123.61 0.764 . . . . 0.0 109.244 177.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.427 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -126.27 120.74 30.74 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 122.855 0.462 . . . . 0.0 111.547 -176.51 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.791 ' SG ' HD13 ' A' ' 85' ' ' LEU . 1.4 m -127.31 144.64 51.45 Favored Pre-proline 0 N--CA 1.485 1.323 0 C-N-CA 123.957 0.903 . . . . 0.0 111.45 -178.924 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -74.53 -23.61 14.7 Favored 'Trans proline' 0 C--N 1.379 2.176 0 C-N-CA 122.869 2.379 . . . . 0.0 113.161 177.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 76.9 mtm -76.11 -41.28 50.72 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 173.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 138.08 -156.03 23.65 Favored Glycine 0 C--N 1.347 1.173 0 N-CA-C 114.675 0.63 . . . . 0.0 114.675 172.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.3 mt -75.18 -18.48 60.16 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 114.783 1.401 . . . . 0.0 114.783 -164.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.98 -48.65 80.82 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-O 121.466 0.65 . . . . 0.0 110.761 178.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.523 ' HA ' ' HE1' ' A' ' 20' ' ' MET . 1.5 t-80 -66.18 -39.25 89.57 Favored 'General case' 0 C--O 1.246 0.868 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.264 -179.701 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 40.8 p -67.89 -36.34 80.07 Favored 'General case' 0 C--N 1.349 0.581 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.444 -175.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -72.49 -25.24 61.34 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 123.389 0.43 . . . . 0.0 111.616 178.329 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' MET . . . . . 0.523 ' HE1' ' HA ' ' A' ' 17' ' ' HIS . 56.3 mtm -63.08 -45.44 92.11 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-O 120.87 0.367 . . . . 0.0 110.055 170.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -69.72 -38.07 76.78 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.423 177.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.94 -43.09 84.11 Favored 'General case' 0 C--O 1.216 -0.682 0 C-N-CA 123.599 0.76 . . . . 0.0 110.735 -177.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.402 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 8.4 tp-100 -66.06 -42.2 89.79 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.064 0.546 . . . . 0.0 110.23 -179.558 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.03 -49.61 67.11 Favored 'General case' 0 CA--C 1.556 1.179 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.988 -178.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.425 HD13 ' OG ' ' A' ' 64' ' ' SER . 86.6 mt -66.52 -32.6 74.05 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.184 0.594 . . . . 0.0 111.789 178.595 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.5 ' HA ' HG21 ' A' ' 36' ' ' VAL . 46.0 tt0 -59.89 -53.54 56.72 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 123.907 0.754 . . . . 0.0 109.686 179.069 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.402 ' HG2' ' O ' ' A' ' 23' ' ' GLN . 30.4 mm-40 -54.07 -52.4 61.06 Favored 'General case' 0 N--CA 1.477 0.888 0 O-C-N 124.719 1.262 . . . . 0.0 110.834 178.707 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.401 ' HB1' ' HA ' ' A' ' 93' ' ' ALA . . . -56.15 -45.84 79.5 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.515 1.126 . . . . 0.0 112.109 -177.247 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.21 -29.71 67.73 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 115.364 -0.834 . . . . 0.0 113.063 177.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.438 HG21 ' O ' ' A' ' 26' ' ' GLU . 52.2 t -72.63 -38.55 59.16 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -71.79 -23.35 61.56 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 114.548 -1.205 . . . . 0.0 111.061 178.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.49 -22.31 59.14 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.411 0.684 . . . . 0.0 111.657 176.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 105.06 0.34 41.49 Favored Glycine 0 C--N 1.352 1.423 0 CA-C-O 119.555 -0.581 . . . . 0.0 114.512 171.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.525 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.1 OUTLIER -113.38 -179.87 3.76 Favored 'General case' 0 N--CA 1.485 1.319 0 CA-C-N 117.642 0.721 . . . . 0.0 111.901 177.427 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.53 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 38.2 tt0 -79.06 152.76 30.68 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.053 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.5 HG21 ' HA ' ' A' ' 26' ' ' GLU . 11.0 p -132.18 141.68 44.74 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 123.647 0.779 . . . . 0.0 110.548 177.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 49.1 tptt -147.22 119.52 8.37 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 172.012 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.571 HG12 ' HB3' ' A' ' 7' ' ' ALA . 47.9 mt -120.74 112.45 36.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 C-N-CA 122.938 0.495 . . . . 0.0 111.954 -175.43 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 46.5 tt0 -80.98 117.13 21.33 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.467 0.707 . . . . 0.0 109.423 174.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 21.7 p -98.87 115.74 29.53 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.814 0.845 . . . . 0.0 110.177 178.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.449 ' HG3' HD23 ' A' ' 8' ' ' LEU . 11.0 mt-30 -108.64 151.43 26.15 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.414 0.686 . . . . 0.0 109.917 175.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -172.81 -177.14 41.93 Favored Glycine 0 C--N 1.337 0.596 0 CA-C-N 116.73 -0.214 . . . . 0.0 112.872 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.69 -19.23 65.14 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.637 0.775 . . . . 0.0 112.527 -179.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -79.61 -31.74 41.71 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.623 0.769 . . . . 0.0 110.775 174.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 143.18 -158.71 27.31 Favored Glycine 0 C--N 1.339 0.738 0 N-CA-C 111.184 -0.766 . . . . 0.0 111.184 -176.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.407 HG23 ' HG2' ' A' ' 41' ' ' GLN . 30.0 mt -117.62 154.99 19.47 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 123.031 0.532 . . . . 0.0 109.963 179.541 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -149.8 152.62 35.49 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.198 0.999 . . . . 0.0 109.937 -179.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 18.8 t30 60.99 42.02 13.26 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 124.72 1.208 . . . . 0.0 109.89 176.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 10.1 tpt180 -54.68 121.59 8.83 Favored 'General case' 0 C--N 1.356 0.853 0 C-N-CA 125.098 1.359 . . . . 0.0 112.157 -169.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 44.4 mt -67.31 144.27 55.96 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.805 0.842 . . . . 0.0 110.118 172.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.432 ' O ' HG13 ' A' ' 55' ' ' ILE . 31.6 p -111.53 172.46 6.88 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.822 0.849 . . . . 0.0 109.392 177.053 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.44 -30.07 68.23 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 122.862 0.465 . . . . 0.0 111.381 176.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -64.33 -47.54 79.01 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.827 0.851 . . . . 0.0 110.814 176.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -59.74 -45.04 93.44 Favored 'General case' 0 N--CA 1.48 1.041 0 O-C-N 123.858 0.724 . . . . 0.0 111.028 179.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.536 HG21 ' HG3' ' A' ' 78' ' ' ARG . 26.7 mt -73.23 -28.87 26.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 C-N-CA 123.671 0.788 . . . . 0.0 111.017 -176.125 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -74.74 -49.04 22.47 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.249 0.62 . . . . 0.0 111.13 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -81.16 -9.34 59.82 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.407 0.683 . . . . 0.0 111.753 -176.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.59 101.15 0.17 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.521 0.729 . . . . 0.0 111.299 179.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 24.0 m -61.53 -38.03 85.93 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 115.021 -0.99 . . . . 0.0 109.102 168.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.498 HG21 HG23 ' A' ' 99' ' ' ILE . 73.1 mt -130.32 140.4 48.95 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.767 0 CA-C-N 114.819 -1.082 . . . . 0.0 110.174 -179.316 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.432 HG21 HG13 ' A' ' 6' ' ' ILE . 20.5 mt -133.01 131.56 58.88 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 C-N-CA 123.685 0.794 . . . . 0.0 109.098 172.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.0 mp -119.84 134.77 62.3 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 173.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 7.5 m170 -109.35 85.43 2.1 Favored 'General case' 0 N--CA 1.487 1.419 0 CA-C-N 118.931 0.787 . . . . 0.0 109.339 168.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.546 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 19.4 m -77.78 82.11 4.18 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 114.288 -1.324 . . . . 0.0 109.595 175.011 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.418 ' O ' ' HA ' ' A' ' 84' ' ' THR . 21.6 m -127.26 152.67 35.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 121.47 0.652 . . . . 0.0 111.313 -172.426 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -103.13 -29.02 11.59 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.315 1.046 . . . . 0.0 108.936 174.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 16.4 m -133.9 163.35 37.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 125.479 1.512 . . . . 0.0 108.447 177.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 26.3 m -64.72 117.59 39.78 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 122.942 0.497 . . . . 0.0 110.618 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.44 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 37.9 Cg_endo -67.6 148.81 78.94 Favored 'Trans proline' 0 C--N 1.374 1.874 0 C-N-CA 122.149 1.9 . . . . 0.0 111.079 175.037 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -63.51 -33.12 74.88 Favored 'General case' 0 N--CA 1.483 1.223 0 CA-C-O 121.242 0.544 . . . . 0.0 110.572 -179.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.491 ' HB3' ' HD3' ' A' ' 74' ' ' ARG . 1.3 m-20 -94.9 16.23 16.58 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.322 1.049 . . . . 0.0 112.357 -174.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.44 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 5.1 p30 -60.37 -36.08 77.2 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.256 0.622 . . . . 0.0 112.403 -174.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.64 -21.15 63.57 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.761 0.824 . . . . 0.0 112.945 -174.12 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.491 ' HD3' ' HB3' ' A' ' 71' ' ' ASP . 77.1 mtp180 -62.66 -42.89 99.86 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-O 122.215 1.007 . . . . 0.0 110.286 174.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -89.91 -17.97 27.01 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 113.72 -1.582 . . . . 0.0 111.04 -172.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -63.5 -27.38 69.23 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.311 0.645 . . . . 0.0 110.488 178.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 45.1 t -62.89 -34.73 78.04 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 124.071 0.948 . . . . 0.0 111.554 172.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.536 ' HG3' HG21 ' A' ' 55' ' ' ILE . 20.7 mmt180 -95.39 -175.98 3.64 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.329 1.052 . . . . 0.0 111.62 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -94.44 120.29 34.45 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.576 0.751 . . . . 0.0 109.826 173.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 62.1 t -130.42 148.49 33.13 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.163 0 C-N-CA 124.213 1.005 . . . . 0.0 110.296 -174.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -107.68 90.89 3.44 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.02 0.928 . . . . 0.0 109.342 173.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -75.68 111.52 11.1 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.42 0.688 . . . . 0.0 110.362 178.28 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.458 HG13 ' HA ' ' A' ' 64' ' ' SER . 44.2 pt -119.36 -175.53 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 124.489 1.116 . . . . 0.0 109.16 175.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.418 ' HA ' ' O ' ' A' ' 65' ' ' VAL . 22.0 p -83.2 148.14 27.62 Favored 'General case' 0 C--O 1.238 0.455 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 168.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.791 HD13 ' SG ' ' A' ' 11' ' ' CYS . 5.8 tt -62.41 -26.9 68.73 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.665 0.786 . . . . 0.0 111.482 178.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.512 ' HG2' ' HE3' ' A' ' 90' ' ' LYS . 33.7 tt0 -67.04 -40.62 87.2 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 123.795 0.838 . . . . 0.0 111.171 175.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.425 ' HB3' HD13 ' A' ' 83' ' ' ILE . 22.8 t70 -61.52 -29.84 70.25 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.456 0.702 . . . . 0.0 111.067 178.495 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -70.31 -18.52 63.1 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.715 0.806 . . . . 0.0 112.998 178.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 66.2 mt -95.91 -40.58 10.94 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.826 0 C-N-CA 123.518 0.727 . . . . 0.0 110.392 -179.258 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.512 ' HE3' ' HG2' ' A' ' 86' ' ' GLN . 18.1 ptpt -88.67 -31.05 18.7 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.196 0.598 . . . . 0.0 112.361 -175.044 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . 0.442 HD21 HG13 ' A' ' 95' ' ' ILE . 6.0 t30 -126.58 26.78 6.23 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.374 0.669 . . . . 0.0 110.185 -170.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -49.15 -61.12 2.25 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.817 0.847 . . . . 0.0 113.026 -174.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.401 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . . . -59.24 -39.74 83.73 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.872 177.852 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -55.97 -47.38 80.29 Favored Glycine 0 C--N 1.353 1.517 0 O-C-N 124.886 1.366 . . . . 0.0 112.991 179.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.442 HG13 HD21 ' A' ' 91' ' ' ASN . 26.0 mt -58.32 -56.9 13.31 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 124.052 0.941 . . . . 0.0 110.053 -179.824 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.8 mp -57.25 -50.62 76.12 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.185 0 O-C-N 124.034 0.834 . . . . 0.0 111.42 -176.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.65 -29.73 70.34 Favored 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -176.751 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -66.71 -38.44 86.74 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.487 0.715 . . . . 0.0 110.236 177.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . 0.498 HG23 HG21 ' A' ' 60' ' ' ILE . 22.2 mt -77.92 -34.31 19.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 -177.669 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -61.14 -46.17 91.66 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.553 1.141 . . . . 0.0 111.821 177.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -74.53 -32.84 62.61 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 123.158 0.286 . . . . 0.0 111.465 -178.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 65.1 mtm -65.74 -45.57 82.11 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 122.638 0.375 . . . . 0.0 110.62 175.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 48.0 mt -65.93 -38.83 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 O-C-N 123.46 0.475 . . . . 0.0 109.938 176.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.36 -21.78 66.24 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.147 0.579 . . . . 0.0 111.371 177.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 44.6 t -88.58 -38.15 15.11 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 122.944 0.497 . . . . 0.0 111.199 -178.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -77.24 -25.48 51.61 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 122.396 0.278 . . . . 0.0 110.885 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 17.0 mm-40 -85.04 -50.24 7.62 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.02 0.528 . . . . 0.0 110.054 174.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 24.4 mm-40 . . . . . 0 CA--C 1.55 0.945 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 177.664 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 47.9 pttt . . . . . 0 N--CA 1.473 0.676 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.591 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.3 tmtp? -141.8 140.84 33.12 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 -172.873 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.472 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 10.1 tt -129.36 134.9 48.11 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 177.528 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.414 HD13 HD13 ' A' ' 50' ' ' LEU . 17.7 pt -128.01 165.17 27.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 173.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.565 ' HB2' HG12 ' A' ' 38' ' ' ILE . . . -152.48 169.08 23.48 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 122.775 0.43 . . . . 0.0 110.078 178.18 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.5 tt -139.73 114.28 9.25 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 -179.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.489 ' HA ' ' O ' ' A' ' 64' ' ' SER . 85.6 m -106.39 111.09 23.52 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 177.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.512 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -127.38 122.48 33.76 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 122.785 0.434 . . . . 0.0 111.235 -176.756 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.704 ' SG ' HD12 ' A' ' 85' ' ' LEU . 1.2 m -136.55 139.65 30.01 Favored Pre-proline 0 N--CA 1.474 0.74 0 C-N-CA 123.728 0.811 . . . . 0.0 109.878 176.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -75.91 -10.01 19.66 Favored 'Trans proline' 0 C--N 1.373 1.867 0 C-N-CA 122.856 2.371 . . . . 0.0 111.504 178.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 44.6 mtt -69.3 -56.97 5.98 Favored 'General case' 0 C--N 1.35 0.624 0 C-N-CA 124.93 1.292 . . . . 0.0 109.718 177.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 163.0 175.1 33.68 Favored Glycine 0 C--N 1.349 1.266 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.89 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 28.9 mt -69.89 -22.52 63.22 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.388 0.675 . . . . 0.0 112.759 -179.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -55.66 -44.65 77.45 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-O 120.956 0.408 . . . . 0.0 111.025 175.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -71.33 -36.5 71.57 Favored 'General case' 0 C--O 1.247 0.934 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.81 -178.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.408 ' HA ' HD11 ' A' ' 85' ' ' LEU . 44.8 p -70.97 -31.22 67.72 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.822 -178.396 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 -74.4 -28.13 60.95 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.298 0.639 . . . . 0.0 111.013 178.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 71.0 mtp -58.92 -51.26 70.81 Favored 'General case' 0 N--CA 1.483 1.189 0 CA-C-O 121.214 0.53 . . . . 0.0 109.838 169.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.01 -40.08 94.37 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.771 177.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.93 -37.11 78.7 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.876 0.87 . . . . 0.0 111.461 -176.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.417 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 8.4 tp-100 -64.5 -48.13 76.34 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.264 0.626 . . . . 0.0 109.715 178.273 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.11 -51.36 66.84 Favored 'General case' 0 CA--C 1.554 1.101 0 CA-C-N 115.221 -0.9 . . . . 0.0 111.934 -176.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 85.4 mt -63.91 -34.57 78.27 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.415 0.686 . . . . 0.0 112.048 -179.309 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.444 ' O ' HG21 ' A' ' 30' ' ' VAL . 39.0 tt0 -60.66 -56.72 17.9 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 123.979 0.799 . . . . 0.0 110.324 -179.022 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.469 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 21.3 mm-40 -56.96 -44.58 82.76 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 124.673 1.233 . . . . 0.0 111.196 -178.534 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.59 -49.45 77.42 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.839 0.855 . . . . 0.0 111.688 -179.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.15 -21.99 63.97 Favored 'General case' 0 CA--C 1.552 1.04 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 177.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.444 HG21 ' O ' ' A' ' 26' ' ' GLU . 42.3 t -73.61 -42.79 55.35 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.261 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 179.272 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 9.0 mm-40 -76.08 -20.3 57.82 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 114.559 -1.201 . . . . 0.0 110.814 -178.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -84.09 -14.6 50.0 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.719 0.808 . . . . 0.0 111.586 173.212 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 86.25 33.4 14.47 Favored Glycine 0 C--N 1.344 0.986 0 N-CA-C 114.792 0.677 . . . . 0.0 114.792 166.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -101.95 -179.19 3.93 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 117.781 0.791 . . . . 0.0 109.371 165.478 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.591 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 11.4 tp10 -87.71 132.31 34.17 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 156.618 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.472 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 8.7 p -117.47 135.74 56.88 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.27 0 CA-C-N 119.057 0.844 . . . . 0.0 110.667 -176.269 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.4 tptt -144.44 119.0 9.71 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.333 0.653 . . . . 0.0 109.278 177.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.565 HG12 ' HB2' ' A' ' 7' ' ' ALA . 46.6 mt -121.21 112.22 34.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 C-N-CA 123.082 0.553 . . . . 0.0 111.725 -173.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 49.0 tt0 -80.86 116.41 20.83 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.409 0.684 . . . . 0.0 110.115 175.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.423 ' HG1' ' HB3' ' A' ' 47' ' ' GLN . 22.6 p -97.26 114.31 26.04 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.841 0.856 . . . . 0.0 110.749 178.197 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.512 ' O ' ' HA ' ' A' ' 10' ' ' ALA . 45.7 mt-30 -105.09 137.27 43.11 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.918 0.887 . . . . 0.0 109.08 174.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -170.35 -165.84 28.33 Favored Glycine 0 C--N 1.345 1.041 0 C-N-CA 121.423 -0.417 . . . . 0.0 113.597 -177.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.99 -29.22 68.18 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.908 0.883 . . . . 0.0 112.601 -176.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -80.08 -11.25 59.78 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.283 0.633 . . . . 0.0 110.955 176.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 119.75 -157.35 15.57 Favored Glycine 0 C--N 1.345 1.075 0 N-CA-C 111.642 -0.583 . . . . 0.0 111.642 -179.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 55.4 mt -107.31 144.74 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 179.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.423 ' HB3' ' HG1' ' A' ' 40' ' ' THR . 9.0 tp-100 -145.7 150.42 36.24 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.944 0.898 . . . . 0.0 109.514 -174.439 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.6 t30 60.64 43.87 12.08 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.554 1.142 . . . . 0.0 110.058 177.119 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 19.9 tpp180 -53.37 124.2 14.08 Favored 'General case' 0 C--N 1.357 0.921 0 C-N-CA 124.863 1.265 . . . . 0.0 112.796 -173.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.457 ' HB2' HH22 ' A' ' 74' ' ' ARG . 51.4 mt -69.9 140.45 53.12 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 114.49 -1.232 . . . . 0.0 110.96 170.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 70.1 p -101.86 164.74 11.57 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.627 0.771 . . . . 0.0 109.76 178.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.59 -32.13 64.94 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 122.913 0.485 . . . . 0.0 110.744 173.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 44.8 tt0 -61.9 -53.65 52.84 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.96 0.904 . . . . 0.0 110.962 173.304 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -57.68 -41.06 80.8 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 123.257 0.623 . . . . 0.0 111.886 -177.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.54 HG21 ' HG3' ' A' ' 78' ' ' ARG . 55.0 mt -72.08 -31.32 39.52 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.125 0 C-N-CA 123.77 0.828 . . . . 0.0 110.962 -177.654 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.72 -45.19 53.72 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.362 0.665 . . . . 0.0 111.337 176.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -65.7 -32.92 74.74 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.159 0.984 . . . . 0.0 111.121 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -51.92 102.6 0.05 OUTLIER 'General case' 0 CA--C 1.543 0.693 0 O-C-N 124.857 1.348 . . . . 0.0 112.322 -174.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 29.0 m -61.25 -37.96 84.99 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.089 165.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 91.7 mt -137.05 139.52 44.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 124.255 1.022 . . . . 0.0 110.371 -176.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.445 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 23.5 mt -126.05 141.21 46.36 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 172.6 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.0 mp -129.52 111.92 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 CA-C-N 118.248 0.476 . . . . 0.0 109.827 174.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . 0.402 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 12.7 m170 -87.74 85.67 7.08 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-O 121.618 0.723 . . . . 0.0 110.021 174.204 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.489 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 19.6 m -82.87 83.22 7.84 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 114.605 -1.179 . . . . 0.0 109.7 176.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.422 ' O ' ' HA ' ' A' ' 84' ' ' THR . 31.3 m -129.17 158.76 41.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 CA-C-O 121.668 0.747 . . . . 0.0 112.487 -170.482 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -113.97 -14.66 12.42 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.116 1.366 . . . . 0.0 109.445 175.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.3 m -134.1 150.24 31.03 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 125.786 1.635 . . . . 0.0 107.94 174.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 50.0 m -64.12 111.39 5.34 Favored Pre-proline 0 CA--C 1.548 0.903 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 174.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.549 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 33.4 Cg_endo -62.79 148.43 93.42 Favored 'Trans proline' 0 C--N 1.38 2.187 0 C-N-CA 122.467 2.111 . . . . 0.0 112.223 -173.721 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -65.13 -32.46 74.16 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.645 -179.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -96.55 15.66 20.96 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 115.084 -0.962 . . . . 0.0 112.424 -175.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.549 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 51.6 t30 -58.16 -33.51 69.3 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 124.033 0.933 . . . . 0.0 112.137 -179.189 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.42 -23.54 65.55 Favored 'General case' 0 N--CA 1.485 1.283 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -175.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.457 HH22 ' HB2' ' A' ' 50' ' ' LEU . 40.7 mtp180 -64.51 -38.12 89.92 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.385 0.674 . . . . 0.0 112.021 174.44 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -91.13 -3.04 57.43 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-N 114.615 -1.175 . . . . 0.0 111.357 -174.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -60.46 -30.65 69.81 Favored 'General case' 0 CA--C 1.554 1.099 0 C-N-CA 124.471 1.108 . . . . 0.0 112.021 -176.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 52.7 p -74.95 -18.68 60.35 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 124.048 0.939 . . . . 0.0 112.802 179.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.54 ' HG3' HG21 ' A' ' 55' ' ' ILE . 19.9 mmt180 -116.7 168.62 10.04 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.594 0.757 . . . . 0.0 111.881 -166.173 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -76.95 102.65 6.5 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.719 0.808 . . . . 0.0 110.349 -178.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.445 ' HA ' ' HB ' ' A' ' 61' ' ' ILE . 58.1 t -112.75 129.28 68.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 123.427 0.691 . . . . 0.0 110.807 -177.47 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 -99.87 90.08 4.31 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.387 1.075 . . . . 0.0 108.41 176.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.402 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 47.3 mt-10 -79.29 126.87 31.35 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.953 -176.514 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.536 HD12 ' HB3' ' A' ' 87' ' ' ASP . 38.2 pt -140.91 -172.9 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 C-N-CA 125.278 1.431 . . . . 0.0 109.137 178.729 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.422 ' HA ' ' O ' ' A' ' 65' ' ' VAL . 34.4 p -85.21 153.89 22.33 Favored 'General case' 0 C--N 1.346 0.45 0 CA-C-O 121.071 0.463 . . . . 0.0 110.324 168.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.704 HD12 ' SG ' ' A' ' 11' ' ' CYS . 7.6 tt -63.99 -27.54 69.19 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.039 176.179 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.459 ' HG2' ' HE2' ' A' ' 90' ' ' LYS . 35.7 tt0 -64.34 -42.96 96.0 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.864 0.866 . . . . 0.0 111.48 176.226 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.536 ' HB3' HD12 ' A' ' 83' ' ' ILE . 30.1 t70 -62.12 -30.86 71.32 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.462 0.705 . . . . 0.0 111.131 -179.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.402 ' HB3' ' HB3' ' A' ' 64' ' ' SER . . . -67.46 -27.44 67.03 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.852 0.861 . . . . 0.0 112.885 178.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 37.6 mt -88.11 -45.96 15.83 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 C-N-CA 123.01 0.524 . . . . 0.0 109.996 -178.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.459 ' HE2' ' HG2' ' A' ' 86' ' ' GLN . 0.2 OUTLIER -78.82 -38.06 39.08 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 122.942 0.497 . . . . 0.0 112.089 -175.423 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -122.25 25.34 9.01 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.377 0.671 . . . . 0.0 110.56 -167.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.07 -59.37 3.18 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.401 0.68 . . . . 0.0 112.499 -176.186 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.06 -37.4 76.96 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 114.781 -1.1 . . . . 0.0 111.109 178.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.55 -50.7 60.03 Favored Glycine 0 C--N 1.354 1.548 0 O-C-N 124.578 1.174 . . . . 0.0 112.62 -178.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.421 ' O ' HG13 ' A' ' 99' ' ' ILE . 33.4 mt -54.38 -57.38 6.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 124.463 1.105 . . . . 0.0 110.126 -179.082 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.0 mp -56.8 -51.36 68.33 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.986 0 O-C-N 124.192 0.932 . . . . 0.0 111.021 -176.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.48 -28.12 68.32 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -176.838 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 35.7 mm-40 -70.91 -33.2 70.3 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.554 0.742 . . . . 0.0 110.652 178.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . 0.421 HG13 ' O ' ' A' ' 95' ' ' ILE . 19.4 mt -82.14 -33.19 11.38 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 178.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -57.0 -49.76 74.8 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.479 1.112 . . . . 0.0 111.091 174.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -74.12 -33.93 63.75 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 123.576 0.548 . . . . 0.0 111.7 -177.046 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 66.8 mtm -63.13 -53.55 51.76 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 122.173 0.189 . . . . 0.0 110.6 175.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 21.7 mt -64.57 -39.32 85.2 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 O-C-N 123.821 0.701 . . . . 0.0 110.674 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.82 -42.08 99.57 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 122.263 0.225 . . . . 0.0 110.833 178.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 14.8 t -69.78 -35.4 74.85 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 122.703 0.401 . . . . 0.0 111.166 -172.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -81.18 -28.69 34.86 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 122.811 0.444 . . . . 0.0 111.618 179.169 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -87.26 -21.78 25.59 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.078 0.551 . . . . 0.0 112.033 -178.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 . . . . . 0 N--CA 1.481 1.089 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 175.032 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 37.8 pttt . . . . . 0 N--CA 1.478 0.93 0 CA-C-O 120.94 0.4 . . . . 0.0 110.516 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.569 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.2 tmtp? -142.42 134.49 27.36 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 -175.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.449 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.9 tt -127.08 136.82 52.69 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 179.091 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 19.6 pt -128.22 164.23 30.42 Favored 'Isoleucine or valine' 0 C--O 1.243 0.724 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 173.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.542 ' HB2' HG12 ' A' ' 38' ' ' ILE . . . -152.28 165.74 33.98 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.877 177.504 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.499 HD23 ' HG3' ' A' ' 41' ' ' GLN . 3.2 tt -137.34 109.95 7.51 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 -179.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.497 ' HA ' ' O ' ' A' ' 64' ' ' SER . 64.1 m -102.25 113.25 26.37 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 123.725 0.81 . . . . 0.0 108.966 177.472 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.418 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -129.01 124.08 34.01 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 122.703 0.401 . . . . 0.0 111.032 -176.887 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.724 ' SG ' HD12 ' A' ' 85' ' ' LEU . 1.3 m -144.17 148.88 43.13 Favored Pre-proline 0 N--CA 1.477 0.891 0 C-N-CA 123.753 0.821 . . . . 0.0 110.552 178.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -81.61 -7.16 12.62 Favored 'Trans proline' 0 C--N 1.373 1.863 0 C-N-CA 122.725 2.283 . . . . 0.0 111.411 176.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 55.0 mtt -70.52 -20.83 62.8 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.68 1.192 . . . . 0.0 110.991 177.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.17 -178.59 17.89 Favored Glycine 0 C--N 1.344 1.007 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.943 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 39.2 mt -72.33 -22.55 61.16 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 112.832 0.679 . . . . 0.0 112.832 -175.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.66 -43.53 93.91 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-N 118.484 0.584 . . . . 0.0 111.479 178.074 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.4 t-160 -70.07 -39.63 75.52 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.391 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.431 ' HA ' HD11 ' A' ' 85' ' ' LEU . 48.7 p -68.45 -28.08 66.73 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.419 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.1 m-30 -75.7 -28.23 58.55 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.599 0.76 . . . . 0.0 111.185 177.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' MET . . . . . 0.443 ' HE2' HD11 ' A' ' 89' ' ' ILE . 78.7 mtp -61.26 -46.14 91.59 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-O 121.303 0.573 . . . . 0.0 109.654 171.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.93 -38.05 69.93 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 114.888 -1.051 . . . . 0.0 111.507 178.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.23 -42.32 93.5 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.65 0.78 . . . . 0.0 110.837 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.404 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 24.2 tp60 -66.22 -43.49 86.52 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 122.812 0.445 . . . . 0.0 109.991 178.265 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.478 ' HB2' ' HB2' ' A' ' 92' ' ' ALA . . . -60.27 -56.53 20.42 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.912 -177.102 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.405 HD12 ' OG ' ' A' ' 64' ' ' SER . 96.6 mt -65.59 -30.49 71.23 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.789 0.835 . . . . 0.0 111.894 -179.275 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.505 ' HA ' HG23 ' A' ' 36' ' ' VAL . 35.5 tt0 -60.03 -55.37 34.77 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 123.733 0.646 . . . . 0.0 110.054 176.504 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.539 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 55.4 mm-40 -53.03 -51.12 62.72 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 124.513 1.133 . . . . 0.0 110.518 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.74 -49.8 72.1 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.454 1.102 . . . . 0.0 112.032 -177.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.94 -23.57 64.17 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 113.508 0.929 . . . . 0.0 113.508 177.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.48 HG21 ' O ' ' A' ' 26' ' ' GLU . 49.0 t -75.87 -43.23 39.75 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 -179.707 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.539 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 24.6 mm-40 -69.81 -33.36 72.24 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 114.486 -1.234 . . . . 0.0 110.134 179.32 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -77.35 -19.21 56.63 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.558 0.743 . . . . 0.0 111.707 176.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 89.67 39.16 6.32 Favored Glycine 0 C--N 1.342 0.861 0 N-CA-C 114.722 0.649 . . . . 0.0 114.722 166.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -104.53 170.27 7.99 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 165.197 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.569 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 45.4 tt0 -78.99 129.45 34.46 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 156.048 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.505 HG23 ' HA ' ' A' ' 26' ' ' GLU . 12.2 p -113.97 137.5 46.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 CA-C-N 118.336 0.516 . . . . 0.0 110.01 -175.626 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 47.8 tptt -144.38 113.33 6.8 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 177.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.542 HG12 ' HB2' ' A' ' 7' ' ' ALA . 61.3 mt -118.3 110.96 32.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 122.55 0.34 . . . . 0.0 111.418 -175.321 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -74.29 142.1 45.26 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 123.805 0.691 . . . . 0.0 109.136 171.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 14.0 p -128.0 117.55 21.9 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.745 0.818 . . . . 0.0 109.219 -176.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.499 ' HG3' HD23 ' A' ' 8' ' ' LEU . 8.2 mt-30 -110.17 128.85 55.7 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 178.428 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -152.79 -176.37 25.28 Favored Glycine 0 C--N 1.336 0.564 0 N-CA-C 112.113 -0.395 . . . . 0.0 112.113 -177.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.51 -27.67 69.43 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.711 0.805 . . . . 0.0 111.695 -179.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -72.57 -36.32 68.16 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.972 0.909 . . . . 0.0 110.751 177.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 146.64 -159.42 27.99 Favored Glycine 0 C--N 1.347 1.155 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.054 -177.052 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 76.1 mt -111.57 131.96 61.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 123.397 0.679 . . . . 0.0 109.58 178.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -128.29 150.47 50.04 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.458 1.103 . . . . 0.0 109.691 -177.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 17.0 t30 60.63 41.42 15.32 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 124.61 1.164 . . . . 0.0 110.259 176.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 18.7 tpp180 -47.35 125.39 8.01 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 125.496 1.519 . . . . 0.0 113.142 -174.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 42.2 mt -75.09 127.93 34.35 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.778 173.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 50.1 p -87.34 161.2 18.06 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.423 176.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -57.48 -29.63 64.41 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 122.971 0.509 . . . . 0.0 111.47 175.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -73.06 -37.1 66.95 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.648 0.779 . . . . 0.0 111.378 178.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -62.02 -40.83 97.04 Favored 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 110.332 -0.247 . . . . 0.0 110.332 174.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.557 HG21 ' HG3' ' A' ' 78' ' ' ARG . 31.9 mt -73.6 -30.04 28.43 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.991 0 O-C-N 124.206 0.941 . . . . 0.0 110.888 -178.891 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.97 -48.99 31.75 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.598 0.759 . . . . 0.0 111.173 179.303 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -84.23 -4.38 58.79 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.593 0.757 . . . . 0.0 112.025 -177.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.91 104.19 0.82 Allowed 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.912 0.387 . . . . 0.0 110.58 177.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 26.1 m -60.64 -37.66 82.23 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.226 167.353 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 73.0 mt -135.65 142.45 39.32 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 C-N-CA 123.527 0.731 . . . . 0.0 110.646 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 23.4 mt -129.17 135.79 61.09 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 C-N-CA 124.105 0.962 . . . . 0.0 108.446 171.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -125.82 112.69 31.44 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 C-N-CA 123.106 0.562 . . . . 0.0 109.586 174.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . 0.458 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 16.4 m170 -88.25 86.22 7.04 Favored 'General case' 0 N--CA 1.485 1.319 0 CA-C-N 118.833 0.742 . . . . 0.0 109.45 172.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.497 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 23.1 m -82.92 81.62 8.54 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-N 114.808 -1.087 . . . . 0.0 109.466 176.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 28.0 m -126.88 159.05 37.25 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-O 121.677 0.751 . . . . 0.0 112.252 -170.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -117.54 -21.57 8.52 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.106 1.362 . . . . 0.0 108.822 173.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 12.3 m -126.04 156.83 36.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 125.106 1.362 . . . . 0.0 108.197 175.203 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 38.7 m -65.79 118.29 50.23 Favored Pre-proline 0 CA--C 1.546 0.812 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 177.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.529 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 56.2 Cg_endo -69.49 146.38 61.67 Favored 'Trans proline' 0 C--N 1.373 1.839 0 C-N-CA 121.683 1.589 . . . . 0.0 110.705 175.385 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -62.69 -48.28 79.99 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-O 121.538 0.685 . . . . 0.0 111.196 -175.358 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -94.76 26.58 3.47 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 114.76 -1.109 . . . . 0.0 111.789 -170.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.529 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 6.5 p30 -60.19 -27.75 67.41 Favored 'General case' 0 CA--C 1.557 1.237 0 C-N-CA 124.616 1.166 . . . . 0.0 112.043 -178.557 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.98 -13.1 60.01 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.06 0.944 . . . . 0.0 112.809 -177.334 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -69.53 -23.28 63.57 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-O 121.34 0.591 . . . . 0.0 110.66 171.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -104.21 7.72 36.08 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 124.932 1.293 . . . . 0.0 110.563 -177.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -56.6 -52.47 64.72 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 124.883 1.273 . . . . 0.0 112.584 -171.069 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 48.4 t -86.79 -2.6 58.69 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.193 0.997 . . . . 0.0 112.046 -175.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.557 ' HG3' HG21 ' A' ' 55' ' ' ILE . 25.2 mmt180 -103.41 159.72 15.33 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.925 0.89 . . . . 0.0 110.12 -173.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -77.1 99.2 5.28 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-O 121.222 0.534 . . . . 0.0 111.211 -176.291 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 41.6 t -112.44 142.02 26.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 123.982 0.913 . . . . 0.0 110.501 -177.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -116.94 93.29 4.13 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.487 1.115 . . . . 0.0 108.656 177.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.458 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 42.1 mt-10 -81.81 114.53 20.5 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.598 -176.589 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.514 HD12 ' HB3' ' A' ' 87' ' ' ASP . 45.2 pt -125.46 -173.78 0.95 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.882 0 C-N-CA 124.704 1.201 . . . . 0.0 109.008 177.244 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 40.4 p -80.88 152.52 28.09 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-O 120.935 0.397 . . . . 0.0 110.0 168.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.724 HD12 ' SG ' ' A' ' 11' ' ' CYS . 6.7 tt -62.59 -26.09 68.42 Favored 'General case' 0 CA--C 1.551 1.012 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.724 173.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.57 ' HG2' ' HE2' ' A' ' 90' ' ' LYS . 34.6 tt0 -64.98 -45.6 84.97 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.733 0.813 . . . . 0.0 111.292 176.387 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.514 ' HB3' HD12 ' A' ' 83' ' ' ILE . 20.3 t70 -61.57 -30.71 70.84 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.375 0.67 . . . . 0.0 111.102 -178.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.97 -43.42 95.83 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.514 0.726 . . . . 0.0 111.794 175.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.443 HD11 ' HE2' ' A' ' 20' ' ' MET . 75.3 mt -68.45 -41.22 83.16 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.926 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.271 -177.164 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.57 ' HE2' ' HG2' ' A' ' 86' ' ' GLN . 0.2 OUTLIER -87.35 -53.22 4.95 Favored 'General case' 0 N--CA 1.485 1.299 0 CA-C-O 120.964 0.412 . . . . 0.0 111.938 -175.607 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -102.73 28.15 6.36 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.3 1.04 . . . . 0.0 110.667 -166.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . 0.478 ' HB2' ' HB2' ' A' ' 24' ' ' ALA . . . -43.56 -62.5 1.06 Allowed 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.835 0.854 . . . . 0.0 112.922 -175.272 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.24 -39.17 85.79 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.177 -0.92 . . . . 0.0 110.958 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . 0.412 ' O ' ' HG2' ' A' ' 98' ' ' GLU . . . -58.79 -53.91 42.35 Favored Glycine 0 C--N 1.353 1.508 0 O-C-N 124.72 1.262 . . . . 0.0 112.828 -178.162 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 25.8 mt -51.18 -55.74 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 124.481 1.113 . . . . 0.0 110.624 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.8 mp -57.96 -50.61 77.37 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.112 0 O-C-N 124.199 0.937 . . . . 0.0 111.298 -176.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.36 -27.42 66.23 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 122.91 0.484 . . . . 0.0 112.174 -176.359 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.412 ' HG2' ' O ' ' A' ' 94' ' ' GLY . 57.7 mm-40 -67.15 -38.75 86.03 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.232 0.613 . . . . 0.0 109.753 176.811 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . 0.406 ' O ' HG13 ' A' ' 103' ' ' ILE . 21.1 mt -77.06 -37.17 25.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -52.13 -51.72 56.11 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 124.735 1.214 . . . . 0.0 111.981 174.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -71.46 -33.14 69.06 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 123.505 0.503 . . . . 0.0 111.218 -177.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 71.0 mtm -67.49 -39.24 85.21 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 122.617 0.367 . . . . 0.0 111.042 175.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.49 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 9.3 mt -70.08 -42.8 79.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 176.871 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.37 -21.2 66.23 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.242 0.617 . . . . 0.0 111.23 179.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 26.3 t -85.19 -42.18 14.95 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 122.931 0.492 . . . . 0.0 110.09 179.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.49 ' HG2' ' HA ' ' A' ' 103' ' ' ILE . 13.1 pt-20 -76.35 -23.3 54.19 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 122.897 0.479 . . . . 0.0 111.599 -178.05 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.9 mm-40 -90.02 -39.86 12.68 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.122 0.569 . . . . 0.0 110.535 177.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 80.3 mm-40 . . . . . 0 CA--C 1.554 1.104 0 CA-C-O 118.587 -0.72 . . . . 0.0 109.495 179.891 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.656 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 27.9 pttt . . . . . 0 C--O 1.245 0.838 0 CA-C-O 121.487 0.66 . . . . 0.0 111.04 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.579 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.9 tmtp? -143.75 143.68 31.49 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.477 -172.606 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.481 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.0 tt -128.01 131.13 49.22 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 174.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 18.7 pt -122.98 161.72 24.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 108.482 -0.932 . . . . 0.0 108.482 170.097 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.54 ' HB2' HG12 ' A' ' 38' ' ' ILE . . . -146.48 171.34 15.21 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.001 176.444 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.5 tt -146.48 117.31 7.66 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 -178.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.508 ' HA ' ' O ' ' A' ' 64' ' ' SER . 56.2 m -104.73 112.86 26.11 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.932 0.893 . . . . 0.0 109.239 176.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.526 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -128.36 117.24 21.08 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 122.496 0.318 . . . . 0.0 111.183 -178.206 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.754 ' SG ' HD11 ' A' ' 85' ' ' LEU . 1.3 m -138.78 141.78 31.77 Favored Pre-proline 0 N--CA 1.484 1.226 0 C-N-CA 123.89 0.876 . . . . 0.0 110.868 178.186 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -82.94 -7.66 11.21 Favored 'Trans proline' 0 C--N 1.375 1.928 0 C-N-CA 123.434 2.756 . . . . 0.0 111.533 176.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 47.9 ttm -65.12 -30.15 71.07 Favored 'General case' 0 C--N 1.354 0.764 0 C-N-CA 124.738 1.215 . . . . 0.0 110.318 170.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 125.79 -176.08 17.43 Favored Glycine 0 C--N 1.346 1.126 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.407 179.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 48.9 mt -78.17 -21.75 49.72 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 -173.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.82 -41.96 88.06 Favored 'General case' 0 N--CA 1.488 1.463 0 CA-C-N 118.922 0.783 . . . . 0.0 110.898 178.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.43 ' ND1' HD21 ' A' ' 85' ' ' LEU . 4.9 t-80 -67.55 -44.63 77.83 Favored 'General case' 0 C--O 1.247 0.94 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.165 -179.603 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 50.1 p -65.76 -36.43 83.53 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 114.816 -1.084 . . . . 0.0 110.916 -178.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -68.62 -30.82 69.64 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.34 0.656 . . . . 0.0 111.352 -179.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' MET . . . . . 0.43 ' HE1' ' HA ' ' A' ' 17' ' ' HIS . 64.7 mtm -68.28 -40.55 81.77 Favored 'General case' 0 N--CA 1.485 1.293 0 CA-C-O 120.473 0.178 . . . . 0.0 111.1 175.266 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.63 -38.48 83.94 Favored 'General case' 0 N--CA 1.485 1.29 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.133 175.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.8 -39.35 80.17 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.084 0.953 . . . . 0.0 110.975 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.4 tp60 -62.71 -50.91 69.24 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.672 0.789 . . . . 0.0 109.513 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.15 -50.63 69.66 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 124.265 0.978 . . . . 0.0 111.956 -175.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 68.2 mt -63.93 -34.22 77.48 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 122.95 0.5 . . . . 0.0 111.743 179.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.406 ' O ' HG23 ' A' ' 30' ' ' VAL . 42.4 tt0 -63.39 -54.12 41.75 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 122.463 0.305 . . . . 0.0 110.313 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -51.28 -50.74 58.7 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 124.616 1.198 . . . . 0.0 111.445 179.357 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.43 ' HB1' HD11 ' A' ' 96' ' ' ILE . . . -67.48 -35.85 79.96 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 115.177 -0.92 . . . . 0.0 112.195 -176.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.04 -25.84 59.01 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.073 0.549 . . . . 0.0 111.716 178.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 26' ' ' GLU . 53.7 t -71.73 -39.37 68.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 175.205 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -65.87 -29.52 69.98 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 114.688 -1.142 . . . . 0.0 111.088 174.521 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -82.49 1.5 37.38 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 123.45 0.7 . . . . 0.0 112.41 177.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.96 -45.93 1.77 Allowed Glycine 0 C--N 1.353 1.503 0 N-CA-C 114.423 0.529 . . . . 0.0 114.423 165.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.656 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.1 OUTLIER -71.56 175.72 5.34 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -174.418 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.579 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 37.8 tt0 -77.07 144.03 38.83 Favored 'General case' 0 C--N 1.351 0.638 0 CA-C-N 114.446 -1.252 . . . . 0.0 109.111 178.515 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.481 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 9.3 p -128.66 135.92 61.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 122.66 0.384 . . . . 0.0 110.944 -178.612 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.9 tptt -142.46 113.35 7.5 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.248 0.619 . . . . 0.0 109.482 174.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.54 HG12 ' HB2' ' A' ' 7' ' ' ALA . 40.7 mt -117.54 112.78 40.24 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 122.854 0.462 . . . . 0.0 111.536 -176.376 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.497 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 32.0 tt0 -84.59 124.14 31.1 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.176 0.591 . . . . 0.0 110.288 177.262 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.548 ' HG1' ' HB3' ' A' ' 47' ' ' GLN . 24.9 p -100.95 105.27 16.49 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.871 0.868 . . . . 0.0 110.413 177.213 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.526 ' O ' ' HA ' ' A' ' 10' ' ' ALA . 40.0 mt-30 -95.35 141.83 28.45 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 172.219 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -162.19 -176.95 34.81 Favored Glycine 0 N--CA 1.464 0.564 0 CA-C-O 120.019 -0.323 . . . . 0.0 112.718 -177.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.6 -28.91 67.6 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.73 0.812 . . . . 0.0 111.807 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -72.69 -43.93 62.45 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.147 0.979 . . . . 0.0 110.363 175.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 148.69 -158.58 27.72 Favored Glycine 0 C--N 1.345 1.044 0 CA-C-N 115.257 -0.883 . . . . 0.0 112.007 -175.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 64.8 mt -106.82 138.6 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 123.699 0.8 . . . . 0.0 110.146 -175.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.548 ' HB3' ' HG1' ' A' ' 40' ' ' THR . 8.9 tp-100 -140.02 151.23 45.29 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.903 0.881 . . . . 0.0 109.191 -177.384 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 21.7 t30 57.57 48.27 14.61 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 124.507 1.123 . . . . 0.0 109.702 -177.016 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 32.0 tpt180 -48.4 123.36 6.46 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 126.228 1.811 . . . . 0.0 113.704 -173.09 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.497 ' HG ' ' HB2' ' A' ' 39' ' ' GLU . 52.2 mt -75.17 135.54 41.08 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 124.086 0.954 . . . . 0.0 110.318 170.595 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 44.4 p -103.77 173.03 6.48 Favored 'General case' 0 C--O 1.244 0.808 0 C-N-CA 124.164 0.985 . . . . 0.0 109.38 177.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.09 -33.81 73.93 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 122.813 0.445 . . . . 0.0 110.759 175.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -63.96 -44.75 91.83 Favored 'General case' 0 C--N 1.359 0.982 0 O-C-N 124.066 0.854 . . . . 0.0 110.944 178.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -57.99 -47.84 81.81 Favored 'General case' 0 N--CA 1.48 1.045 0 O-C-N 123.8 0.688 . . . . 0.0 110.983 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.534 HG23 ' HG3' ' A' ' 78' ' ' ARG . 14.2 mt -74.94 -28.83 21.57 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 O-C-N 123.741 0.65 . . . . 0.0 111.256 -177.191 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.94 -44.17 70.11 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.561 0.744 . . . . 0.0 111.401 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -89.36 -9.02 51.97 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.322 0.649 . . . . 0.0 111.602 -176.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.35 96.74 0.11 Allowed 'General case' 0 C--N 1.351 0.67 0 C-N-CA 123.548 0.739 . . . . 0.0 111.647 -177.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 26.3 m -62.58 -35.99 81.25 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 114.836 -1.075 . . . . 0.0 109.745 172.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.446 HG21 HG22 ' A' ' 99' ' ' ILE . 79.8 mt -131.55 137.18 55.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 CA-C-N 114.883 -1.053 . . . . 0.0 109.209 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 30.1 mt -131.23 133.66 62.14 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 175.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -124.95 111.11 26.72 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 174.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 11.8 m170 -89.19 85.49 6.65 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-O 121.576 0.703 . . . . 0.0 109.626 173.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.508 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 18.5 p -79.29 81.27 5.58 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-N 114.531 -1.213 . . . . 0.0 108.973 175.138 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.419 ' O ' ' HA ' ' A' ' 84' ' ' THR . 35.9 m -126.51 159.72 35.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 121.631 0.729 . . . . 0.0 111.553 -171.027 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -128.89 -3.22 5.21 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.068 1.347 . . . . 0.0 109.275 176.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.8 m -138.71 158.25 30.31 Favored 'Isoleucine or valine' 0 C--N 1.349 0.564 0 C-N-CA 125.912 1.685 . . . . 0.0 107.356 168.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 39.2 m -63.41 118.43 43.78 Favored Pre-proline 0 CA--C 1.547 0.828 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 175.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.468 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 58.9 Cg_endo -67.37 146.44 75.05 Favored 'Trans proline' 0 C--N 1.377 2.054 0 C-N-CA 122.095 1.863 . . . . 0.0 110.686 179.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -61.82 -38.79 89.47 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-O 121.752 0.787 . . . . 0.0 110.752 -176.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -94.57 16.54 15.19 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 114.514 -1.221 . . . . 0.0 112.417 -172.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.468 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 4.1 p30 -54.11 -26.59 28.2 Favored 'General case' 0 CA--C 1.565 1.541 0 C-N-CA 123.965 0.906 . . . . 0.0 110.766 174.404 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -56.13 -45.52 79.52 Favored 'General case' 0 CA--C 1.565 1.52 0 C-N-CA 125.836 1.654 . . . . 0.0 112.702 171.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 58.7 mtt85 -71.02 -17.77 62.61 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 124.6 1.16 . . . . 0.0 112.656 -176.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.505 ' HB3' HG21 ' A' ' 80' ' ' VAL . 77.1 m-85 -103.23 19.12 20.22 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.048 0.939 . . . . 0.0 110.991 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 13.7 tp10 -57.33 -56.51 20.91 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.409 1.083 . . . . 0.0 112.305 -174.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 64.8 p -86.2 -9.78 55.93 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.674 0.789 . . . . 0.0 112.453 -174.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.534 ' HG3' HG23 ' A' ' 55' ' ' ILE . 38.5 mmt180 -91.37 157.11 17.28 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 123.357 0.663 . . . . 0.0 111.927 -170.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -82.14 97.96 8.46 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.668 0.787 . . . . 0.0 109.751 -178.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.505 HG21 ' HB3' ' A' ' 75' ' ' PHE . 41.6 t -110.73 118.43 57.22 Favored 'Isoleucine or valine' 0 C--O 1.24 0.602 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.96 -174.854 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -86.39 89.41 7.87 Favored 'General case' 0 C--O 1.24 0.574 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 172.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -84.52 125.37 32.34 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.157 -177.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.598 HD12 ' HB3' ' A' ' 87' ' ' ASP . 39.0 pt -135.2 -175.37 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 125.024 1.33 . . . . 0.0 109.224 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.419 ' HA ' ' O ' ' A' ' 65' ' ' VAL . 24.8 p -79.57 151.35 30.71 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.847 0.356 . . . . 0.0 110.475 168.241 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.754 HD11 ' SG ' ' A' ' 11' ' ' CYS . 6.5 tt -61.88 -32.15 72.49 Favored 'General case' 0 N--CA 1.48 1.059 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.492 176.066 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 31.2 tt0 -59.83 -43.55 94.51 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.794 0.838 . . . . 0.0 111.181 175.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.598 ' HB3' HD12 ' A' ' 83' ' ' ILE . 5.1 t70 -60.31 -31.67 70.5 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.95 0.9 . . . . 0.0 110.773 -176.621 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.93 -28.74 63.67 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.468 0.707 . . . . 0.0 112.831 178.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 86.0 mt -77.92 -48.14 24.01 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.874 0 C-N-CA 123.041 0.536 . . . . 0.0 110.32 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -80.31 -43.17 21.71 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.075 0.55 . . . . 0.0 112.323 -176.25 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -114.46 27.86 9.16 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.507 0.723 . . . . 0.0 110.557 -168.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -45.38 -60.08 2.34 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 124.063 0.945 . . . . 0.0 112.781 -177.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.66 -41.38 94.9 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 114.074 -1.421 . . . . 0.0 110.702 177.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -62.81 -42.1 99.74 Favored Glycine 0 C--N 1.354 1.566 0 O-C-N 124.391 1.057 . . . . 0.0 113.301 -173.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.411 ' O ' HG13 ' A' ' 99' ' ' ILE . 19.7 mt -63.25 -57.51 11.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 123.909 0.884 . . . . 0.0 108.682 179.45 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.43 HD11 ' HB1' ' A' ' 28' ' ' ALA . 82.6 mt -58.61 -45.77 90.44 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 CA-C-N 114.04 -1.437 . . . . 0.0 111.722 -174.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -33.07 73.5 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 122.755 0.422 . . . . 0.0 111.365 -177.531 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -67.5 -37.56 83.01 Favored 'General case' 0 C--N 1.355 0.809 0 O-C-N 123.614 0.571 . . . . 0.0 110.404 177.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . 0.446 HG22 HG21 ' A' ' 60' ' ' ILE . 57.1 mt -75.14 -34.94 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 -177.128 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -63.37 -49.5 73.59 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 114.892 -1.049 . . . . 0.0 111.374 176.081 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -73.57 -30.7 63.19 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-O 119.613 -0.232 . . . . 0.0 111.307 -177.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.462 ' O ' ' HG2' ' A' ' 106' ' ' GLU . 68.3 mtm -65.47 -61.97 1.8 Allowed 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 175.165 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 41.3 mt -58.58 -48.49 85.44 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 O-C-N 123.932 0.77 . . . . 0.0 111.419 -176.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.83 -37.55 88.01 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -175.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 15.3 t -80.88 -23.47 39.0 Favored 'General case' 0 N--CA 1.484 1.275 0 CA-C-N 117.763 0.256 . . . . 0.0 111.643 -172.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 102' ' ' MET . 11.6 pt-20 -86.79 -41.69 13.89 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 122.549 0.34 . . . . 0.0 111.058 176.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -73.26 -35.62 66.23 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.025 0.53 . . . . 0.0 110.905 -177.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 76.3 mm-40 . . . . . 0 CA--C 1.55 0.965 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 175.217 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.627 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 18.1 pttt . . . . . 0 N--CA 1.481 1.121 0 CA-C-O 121.203 0.525 . . . . 0.0 111.684 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.457 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.4 tmtp? -142.2 141.0 32.52 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-O 121.029 0.442 . . . . 0.0 109.834 -173.555 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.483 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 8.9 tt -128.4 139.58 52.3 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 176.199 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.426 HD13 HD11 ' A' ' 50' ' ' LEU . 18.3 pt -131.08 169.48 21.58 Favored 'Isoleucine or valine' 0 C--O 1.244 0.77 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 172.187 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.577 ' HB2' HG12 ' A' ' 38' ' ' ILE . . . -155.22 167.74 29.35 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.22 176.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.4 ' HA ' ' O ' ' A' ' 39' ' ' GLU . 3.8 tt -138.53 115.23 10.65 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 178.127 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.514 ' HA ' ' O ' ' A' ' 64' ' ' SER . 65.1 m -105.33 112.53 25.67 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.567 0.747 . . . . 0.0 109.045 176.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.449 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -126.51 128.26 46.62 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 122.718 0.407 . . . . 0.0 111.641 -176.387 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.743 ' SG ' HD12 ' A' ' 85' ' ' LEU . 20.9 m -125.82 151.15 70.65 Favored Pre-proline 0 N--CA 1.476 0.83 0 C-N-CA 124.24 1.016 . . . . 0.0 109.989 175.516 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -82.15 -0.54 10.32 Favored 'Trans proline' 0 C--N 1.374 1.897 0 C-N-CA 122.757 2.304 . . . . 0.0 112.099 173.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 46.6 ttm -99.4 -62.36 1.25 Allowed 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.307 1.043 . . . . 0.0 110.458 -173.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 179.52 -178.22 48.57 Favored Glycine 0 C--N 1.347 1.168 0 CA-C-N 115.96 -0.564 . . . . 0.0 113.336 -176.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 74.6 mt -82.32 -17.13 46.84 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 -174.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.6 -45.99 91.92 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-N 118.69 0.677 . . . . 0.0 110.998 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 8.0 t-160 -68.88 -36.6 78.28 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.406 -179.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.443 ' HA ' HD11 ' A' ' 85' ' ' LEU . 36.2 p -68.81 -30.31 68.85 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.566 179.643 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.448 ' HA ' ' HB1' ' A' ' 22' ' ' ALA . 19.8 m-85 -77.48 -22.35 51.43 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.467 0.707 . . . . 0.0 111.681 177.048 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' MET . . . . . 0.476 ' HE2' HD13 ' A' ' 89' ' ' ILE . 77.6 mtp -66.49 -44.33 82.93 Favored 'General case' 0 N--CA 1.486 1.336 0 CA-C-O 121.322 0.582 . . . . 0.0 109.471 171.379 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.73 -37.49 70.58 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 114.687 -1.142 . . . . 0.0 111.101 176.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.448 ' HB1' ' HA ' ' A' ' 19' ' ' PHE . . . -70.32 -34.01 72.19 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.437 0.695 . . . . 0.0 110.85 -179.318 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.1 tt0 -61.85 -55.37 30.5 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.342 0.657 . . . . 0.0 109.328 173.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.68 -44.37 86.42 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 114.372 -1.286 . . . . 0.0 112.447 -170.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.426 HD11 ' OG ' ' A' ' 64' ' ' SER . 96.2 mt -70.04 -34.77 73.66 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 122.745 0.418 . . . . 0.0 111.323 178.299 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.439 ' O ' HG21 ' A' ' 30' ' ' VAL . 36.8 tt0 -60.49 -55.45 33.3 Favored 'General case' 0 C--N 1.354 0.796 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 178.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -54.14 -50.2 67.47 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 124.579 1.174 . . . . 0.0 110.886 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.4 -45.1 92.43 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.162 0.985 . . . . 0.0 112.201 -176.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.58 -24.81 61.15 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 178.423 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.439 HG21 ' O ' ' A' ' 26' ' ' GLU . 40.6 t -70.43 -43.04 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 175.582 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -62.63 -34.04 76.24 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 114.588 -1.187 . . . . 0.0 111.064 178.193 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.68 -42.28 95.47 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.478 0.711 . . . . 0.0 111.65 177.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 135.09 -43.96 1.21 Allowed Glycine 0 C--N 1.348 1.207 0 CA-C-N 116.861 -0.154 . . . . 0.0 113.206 174.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.627 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -71.6 177.88 3.85 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 -177.266 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.457 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 30.2 tt0 -78.66 154.66 30.0 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 115.083 -0.962 . . . . 0.0 109.505 178.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.483 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 7.1 p -134.94 136.61 51.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 123.226 0.61 . . . . 0.0 110.138 176.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 45.9 tptt -143.69 113.83 7.32 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 175.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.577 HG12 ' HB2' ' A' ' 7' ' ' ALA . 41.5 mt -116.01 109.85 29.6 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 C-N-CA 122.654 0.382 . . . . 0.0 111.844 -174.232 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.4 ' O ' ' HA ' ' A' ' 8' ' ' LEU . 32.7 tt0 -76.08 135.63 39.88 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 172.067 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 12.2 p -118.93 119.04 33.16 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 123.657 0.783 . . . . 0.0 109.65 -177.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.449 ' O ' ' HA ' ' A' ' 10' ' ' ALA . 40.4 mt-30 -109.65 137.68 47.11 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 123.796 0.838 . . . . 0.0 109.969 179.153 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -164.45 176.31 40.36 Favored Glycine 0 C--O 1.243 0.664 0 N-CA-C 112.136 -0.386 . . . . 0.0 112.136 179.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.72 -19.79 66.03 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.292 0.637 . . . . 0.0 112.034 -179.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -74.56 -40.32 61.73 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.159 0.584 . . . . 0.0 110.876 173.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 156.06 -158.02 28.28 Favored Glycine 0 C--N 1.343 0.97 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.004 -176.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.422 HG12 ' HG2' ' A' ' 41' ' ' GLN . 74.6 mt -124.12 137.98 55.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 C-N-CA 123.316 0.647 . . . . 0.0 109.769 177.364 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -132.98 152.42 51.95 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.178 0.991 . . . . 0.0 109.636 -178.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.1 t30 63.58 36.82 10.74 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 124.24 1.016 . . . . 0.0 110.238 175.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.407 HH22 HD12 ' A' ' 46' ' ' ILE . 20.2 tpp180 -45.26 122.51 3.47 Favored 'General case' 0 C--N 1.362 1.117 0 C-N-CA 126.088 1.755 . . . . 0.0 112.762 -175.675 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.426 HD11 HD13 ' A' ' 6' ' ' ILE . 41.1 mt -76.2 147.17 38.59 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.264 172.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 17.1 p -104.86 171.88 7.08 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 175.204 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.7 -29.33 70.58 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 122.664 0.386 . . . . 0.0 111.231 175.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -64.94 -46.93 79.55 Favored 'General case' 0 C--N 1.354 0.781 0 O-C-N 123.759 0.662 . . . . 0.0 110.243 176.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -56.25 -46.09 79.78 Favored 'General case' 0 N--CA 1.484 1.267 0 O-C-N 123.928 0.768 . . . . 0.0 111.403 179.02 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.576 HG23 ' HG3' ' A' ' 78' ' ' ARG . 28.6 mt -74.19 -31.49 29.46 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 O-C-N 123.925 0.765 . . . . 0.0 111.121 -174.708 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.25 -50.02 30.5 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.164 0.585 . . . . 0.0 111.093 178.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -79.95 -9.56 59.69 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.4 0.68 . . . . 0.0 111.652 -176.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.82 103.25 0.42 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.297 0.639 . . . . 0.0 110.538 176.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 30.2 m -61.85 -36.08 80.16 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.656 170.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.471 HG22 HG23 ' A' ' 99' ' ' ILE . 79.8 mt -132.36 141.44 45.26 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.292 179.308 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.418 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 21.9 mt -132.12 140.78 47.07 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 123.856 0.862 . . . . 0.0 108.887 171.634 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.2 mp -126.03 116.65 46.51 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.329 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 173.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . 0.414 ' HE1' ' HA ' ' A' ' 72' ' ' ASN . 5.2 m170 -92.32 86.21 5.64 Favored 'General case' 0 N--CA 1.486 1.334 0 CA-C-O 121.739 0.78 . . . . 0.0 109.834 173.339 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.514 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 22.7 m -82.43 78.91 9.01 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 114.381 -1.282 . . . . 0.0 109.956 178.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.447 HG11 ' HG3' ' A' ' 69' ' ' PRO . 34.2 m -125.35 157.14 34.61 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 CA-C-O 121.858 0.837 . . . . 0.0 111.721 -170.074 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -107.77 -23.3 12.14 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 114.17 -1.377 . . . . 0.0 109.483 178.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 15.8 m -136.86 179.64 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 125.051 1.341 . . . . 0.0 108.757 178.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 86.8 m -69.98 116.02 39.82 Favored Pre-proline 0 CA--C 1.549 0.938 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 172.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.596 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 58.1 Cg_endo -73.31 146.8 40.82 Favored 'Trans proline' 0 C--N 1.373 1.857 0 C-N-CA 122.406 2.07 . . . . 0.0 110.859 175.833 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.417 ' HB2' HE22 ' A' ' 41' ' ' GLN . 14.2 mm-40 -67.36 -23.76 65.63 Favored 'General case' 0 N--CA 1.482 1.175 0 CA-C-O 121.219 0.533 . . . . 0.0 111.338 -175.478 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -101.6 10.06 40.57 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.152 -176.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.596 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 8.4 t30 -56.45 -34.83 67.23 Favored 'General case' 0 N--CA 1.495 1.814 0 C-N-CA 123.499 0.72 . . . . 0.0 112.021 179.592 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -57.96 -22.24 48.18 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 125.264 1.425 . . . . 0.0 113.314 179.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 43.1 mtp180 -86.03 -28.51 24.09 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.409 1.083 . . . . 0.0 112.537 -176.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 58.0 m-85 -99.98 -17.77 17.37 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.702 0.801 . . . . 0.0 111.969 -173.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -59.08 -29.49 67.38 Favored 'General case' 0 CA--C 1.559 1.292 0 C-N-CA 124.098 0.959 . . . . 0.0 113.282 -168.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 14.2 t -85.16 0.41 51.81 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.522 0.729 . . . . 0.0 112.142 -178.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.576 ' HG3' HG23 ' A' ' 55' ' ' ILE . 36.8 mmt180 -114.67 168.53 9.8 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.0 0.92 . . . . 0.0 110.081 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -75.65 86.45 2.7 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-O 121.785 0.802 . . . . 0.0 110.28 -178.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.418 ' HA ' ' HB ' ' A' ' 61' ' ' ILE . 60.2 t -101.56 125.94 55.53 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 CA-C-N 114.619 -1.173 . . . . 0.0 110.109 179.415 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -98.74 89.53 4.38 Favored 'General case' 0 C--O 1.24 0.592 0 N-CA-C 107.4 -1.333 . . . . 0.0 107.4 174.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -78.86 125.33 29.23 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.051 -177.206 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.445 HD13 ' HB3' ' A' ' 87' ' ' ASP . 46.4 pt -128.62 -174.06 1.1 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.856 0 C-N-CA 124.491 1.116 . . . . 0.0 109.379 177.388 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 23.3 p -84.36 149.3 26.13 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 109.908 -0.405 . . . . 0.0 109.908 166.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.743 HD12 ' SG ' ' A' ' 11' ' ' CYS . 7.6 tt -61.65 -31.03 71.12 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.865 179.209 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -61.51 -42.98 99.61 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 123.403 0.681 . . . . 0.0 110.938 176.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.445 ' HB3' HD13 ' A' ' 83' ' ' ILE . 9.2 t70 -62.8 -31.88 72.96 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.569 0.748 . . . . 0.0 110.913 -179.157 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.54 -14.5 63.05 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.836 0.854 . . . . 0.0 112.906 179.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.476 HD13 ' HE2' ' A' ' 20' ' ' MET . 47.5 mt -96.76 -56.6 5.07 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 123.662 0.785 . . . . 0.0 109.536 178.101 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -77.82 -30.37 51.08 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 -173.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -118.35 15.25 13.9 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.443 0.697 . . . . 0.0 110.55 -175.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . 0.426 ' HA ' HD13 ' A' ' 95' ' ' ILE . . . -41.97 -57.91 2.26 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 124.49 1.116 . . . . 0.0 113.467 -173.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.82 -41.19 97.48 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.944 179.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -58.93 -44.08 96.34 Favored Glycine 0 C--N 1.35 1.345 0 O-C-N 124.343 1.027 . . . . 0.0 112.339 -179.439 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.426 HD13 ' HA ' ' A' ' 92' ' ' ALA . 22.3 mt -59.42 -58.53 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 124.144 0.978 . . . . 0.0 110.272 -179.517 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.7 mp -54.37 -51.14 51.72 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 O-C-N 124.175 0.922 . . . . 0.0 110.832 -176.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.48 -29.82 69.36 Favored 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -175.431 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -68.34 -36.55 79.42 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 177.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . 0.471 HG23 HG22 ' A' ' 60' ' ' ILE . 38.3 mt -76.91 -36.45 25.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 -177.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -57.38 -52.58 64.8 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 114.502 -1.226 . . . . 0.0 111.063 177.291 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -71.05 -32.15 68.78 Favored 'General case' 0 CA--C 1.546 0.805 0 O-C-N 123.671 0.607 . . . . 0.0 111.838 -176.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 70.7 mtm -66.06 -53.83 33.46 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 122.837 0.455 . . . . 0.0 110.954 177.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 40.7 mt -67.7 -33.38 61.5 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.837 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.714 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -72.21 -25.36 61.63 Favored 'General case' 0 C--O 1.212 -0.917 0 CA-C-O 119.666 -0.207 . . . . 0.0 111.066 177.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 21.0 t -78.04 -38.76 43.85 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 118.01 0.368 . . . . 0.0 110.88 -178.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -72.32 -37.56 68.89 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 122.354 0.262 . . . . 0.0 111.159 178.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -84.08 -31.15 25.48 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 122.932 0.493 . . . . 0.0 111.355 -177.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 65.9 mm-40 . . . . . 0 C--O 1.25 1.111 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.124 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.559 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 14.6 pttt . . . . . 0 C--O 1.256 1.395 0 CA-C-O 121.71 0.767 . . . . 0.0 111.192 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.556 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 3.7 tmtp? -149.64 141.49 23.73 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.126 -172.428 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.481 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.6 tt -128.48 139.05 52.53 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 176.154 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 16.0 pt -130.14 165.46 30.24 Favored 'Isoleucine or valine' 0 C--O 1.241 0.625 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 168.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.525 ' HB2' HG12 ' A' ' 38' ' ' ILE . . . -152.16 169.11 23.24 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 176.304 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.1 tt -140.97 109.69 6.02 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -178.413 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.552 ' HA ' ' O ' ' A' ' 64' ' ' SER . 66.8 m -101.05 107.61 19.1 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.938 0.895 . . . . 0.0 109.463 176.848 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -125.9 115.31 19.74 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 122.852 0.461 . . . . 0.0 110.096 -177.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.557 ' SG ' ' HB3' ' A' ' 13' ' ' MET . 25.7 t -123.04 139.06 30.77 Favored Pre-proline 0 N--CA 1.476 0.846 0 C-N-CA 123.034 0.533 . . . . 0.0 110.664 -175.567 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -74.39 -15.9 22.12 Favored 'Trans proline' 0 C--N 1.374 1.911 0 C-N-CA 123.151 2.568 . . . . 0.0 112.848 170.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.557 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 44.2 ttm -69.05 -57.13 5.85 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.557 0.743 . . . . 0.0 110.282 177.779 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 164.85 171.47 31.13 Favored Glycine 0 C--O 1.245 0.812 0 CA-C-N 114.886 -1.052 . . . . 0.0 111.813 -177.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 81.0 mt -67.5 -20.01 65.4 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.246 0.619 . . . . 0.0 111.941 178.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -57.06 -45.35 83.32 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-O 121.047 0.451 . . . . 0.0 110.996 175.361 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 7.7 t-160 -73.01 -36.06 66.93 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.432 -178.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.415 ' HA ' HD13 ' A' ' 85' ' ' LEU . 37.4 p -64.41 -37.79 88.77 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.563 179.505 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -75.18 -23.42 57.72 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.416 0.687 . . . . 0.0 111.926 -179.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' MET . . . . . 0.472 ' HE2' HD11 ' A' ' 89' ' ' ILE . 83.8 mtp -61.32 -48.45 81.3 Favored 'General case' 0 N--CA 1.484 1.262 0 CA-C-O 121.173 0.511 . . . . 0.0 110.064 169.088 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.89 -38.91 73.05 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.951 178.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.48 -39.83 81.18 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.934 0.893 . . . . 0.0 111.225 -176.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.453 ' O ' ' HG3' ' A' ' 27' ' ' GLU . 16.2 tt0 -65.37 -50.35 65.89 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 123.482 0.489 . . . . 0.0 110.241 176.77 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.87 -48.98 79.35 Favored 'General case' 0 CA--C 1.551 1.013 0 O-C-N 123.829 0.705 . . . . 0.0 112.213 -174.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 73.4 mt -64.84 -37.07 86.4 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 122.97 0.508 . . . . 0.0 111.587 177.221 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.461 ' O ' HG23 ' A' ' 30' ' ' VAL . 41.3 tt0 -59.88 -55.23 36.79 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 123.35 0.406 . . . . 0.0 110.25 -179.039 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.536 ' O ' ' HG3' ' A' ' 31' ' ' GLU . 44.6 mt-10 -52.84 -53.11 53.49 Favored 'General case' 0 N--CA 1.475 0.825 0 O-C-N 124.616 1.198 . . . . 0.0 111.159 -179.584 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -62.01 -37.48 85.02 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.721 -176.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.56 -24.11 49.91 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.164 0.585 . . . . 0.0 112.503 179.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.461 HG23 ' O ' ' A' ' 26' ' ' GLU . 40.6 t -64.14 -43.87 97.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 172.748 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.536 ' HG3' ' O ' ' A' ' 27' ' ' GLU . 25.9 mt-10 -80.13 -20.78 44.16 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 113.506 -1.679 . . . . 0.0 111.643 -176.086 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.65 -16.54 62.27 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.373 0.669 . . . . 0.0 111.221 174.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 116.11 -19.01 13.79 Favored Glycine 0 C--N 1.354 1.579 0 N-CA-C 114.53 0.572 . . . . 0.0 114.53 167.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.559 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -106.02 -179.58 3.98 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 113.323 0.861 . . . . 0.0 113.323 -173.481 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.556 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 10.8 tp10 -75.77 150.27 37.81 Favored 'General case' 0 C--N 1.355 0.812 0 CA-C-N 114.479 -1.237 . . . . 0.0 109.021 175.419 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.481 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 7.1 p -137.4 132.94 46.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 122.921 0.489 . . . . 0.0 110.238 177.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 48.2 tptt -142.11 112.82 7.3 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 179.132 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.525 HG12 ' HB2' ' A' ' 7' ' ' ALA . 45.5 mt -118.6 111.08 32.3 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 -173.785 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -75.55 139.68 42.27 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.829 0.851 . . . . 0.0 109.74 174.007 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.404 ' HA ' ' O ' ' A' ' 9' ' ' CYS . 17.0 p -123.1 111.68 16.83 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.881 0.872 . . . . 0.0 109.463 -178.293 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.41 HE22 ' HB2' ' A' ' 70' ' ' GLU . 41.9 mt-30 -105.74 146.38 29.87 Favored 'General case' 0 C--O 1.243 0.744 0 CA-C-O 121.174 0.511 . . . . 0.0 111.376 -177.428 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -169.78 169.24 41.97 Favored Glycine 0 C--N 1.342 0.866 0 CA-C-N 114.917 -1.038 . . . . 0.0 111.752 175.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.94 -24.76 67.85 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.556 0.743 . . . . 0.0 111.741 -179.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -72.42 -39.93 67.5 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.201 0.6 . . . . 0.0 110.603 174.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 163.93 -173.73 40.0 Favored Glycine 0 C--N 1.344 1.027 0 CA-C-N 116.214 -0.448 . . . . 0.0 113.333 -179.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 78.2 mt -122.63 134.82 64.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.215 1.006 . . . . 0.0 108.836 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -128.89 152.76 48.18 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.931 0.892 . . . . 0.0 109.628 -179.144 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 10.3 t30 60.21 40.45 18.03 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 124.364 1.066 . . . . 0.0 109.977 176.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 17.4 tpp180 -47.58 124.54 7.18 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 125.854 1.662 . . . . 0.0 113.118 -175.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 55.0 mt -77.81 132.91 38.26 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.318 1.047 . . . . 0.0 110.6 173.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 43.0 p -96.68 169.77 9.65 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.721 177.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.09 -34.89 70.66 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 122.904 0.482 . . . . 0.0 111.204 175.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 19.9 tt0 -65.23 -46.74 79.38 Favored 'General case' 0 C--N 1.352 0.716 0 O-C-N 123.717 0.636 . . . . 0.0 110.463 178.117 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -53.66 -44.79 69.94 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 123.362 0.665 . . . . 0.0 111.71 179.267 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 45.8 mt -71.74 -32.73 46.11 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.94 0 O-C-N 124.302 1.002 . . . . 0.0 110.935 -177.47 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.35 -41.55 69.62 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.467 0.707 . . . . 0.0 111.42 178.02 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -72.3 -32.38 66.52 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.99 0.916 . . . . 0.0 111.003 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.73 102.56 0.07 Allowed 'General case' 0 N--CA 1.471 0.622 0 O-C-N 124.568 1.168 . . . . 0.0 112.587 -173.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 26.9 m -61.88 -38.59 88.87 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 124.049 0.94 . . . . 0.0 109.429 168.043 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.442 HG22 HG21 ' A' ' 99' ' ' ILE . 70.6 mt -128.44 139.78 50.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.092 -178.44 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.404 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 25.9 mt -131.21 133.49 62.38 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.286 0 C-N-CA 123.821 0.848 . . . . 0.0 108.919 171.401 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.1 mp -121.9 112.5 35.18 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.339 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 174.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . 0.505 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 9.4 m170 -86.48 86.04 7.33 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-O 121.678 0.751 . . . . 0.0 109.15 173.42 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.552 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 15.0 m -81.25 78.98 7.99 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 114.074 -1.421 . . . . 0.0 109.222 177.452 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 35.3 m -127.5 157.98 39.04 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-O 121.688 0.756 . . . . 0.0 111.537 -169.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -117.11 -10.38 10.87 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.524 1.13 . . . . 0.0 109.418 175.164 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 4.0 m -141.84 162.3 20.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 125.699 1.6 . . . . 0.0 108.498 173.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 47.0 m -61.83 114.93 12.76 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 123.286 0.634 . . . . 0.0 110.162 175.62 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.533 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 69.1 Cg_endo -70.53 151.54 64.75 Favored 'Trans proline' 0 C--N 1.377 2.055 0 C-N-CA 122.241 1.961 . . . . 0.0 110.87 178.083 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.41 ' HB2' HE22 ' A' ' 41' ' ' GLN . 11.6 mm-40 -67.57 -45.49 75.45 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-O 121.216 0.531 . . . . 0.0 111.107 -172.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -89.64 14.4 11.74 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.746 0.818 . . . . 0.0 112.305 -169.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.533 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 5.2 p30 -55.47 -27.35 47.77 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 124.83 1.252 . . . . 0.0 112.817 -176.313 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -56.89 -33.6 67.06 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.958 1.303 . . . . 0.0 113.03 -177.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -72.58 -38.15 67.97 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.929 0.892 . . . . 0.0 110.812 -175.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -77.09 -12.78 59.99 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 114.447 -1.251 . . . . 0.0 111.456 -174.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -54.48 -33.28 59.44 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 124.663 1.185 . . . . 0.0 112.352 178.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 73.5 p -73.83 -19.42 60.74 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 -177.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 40.6 mmt180 -115.46 170.25 8.55 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.756 0.822 . . . . 0.0 111.803 -170.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -76.9 93.94 3.84 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.412 0.685 . . . . 0.0 110.177 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.404 ' HA ' ' HB ' ' A' ' 61' ' ' ILE . 48.3 t -99.0 139.76 20.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.25 177.818 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -116.5 91.14 3.5 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 179.382 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.505 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 49.1 mt-10 -81.14 123.93 28.82 Favored 'General case' 0 C--N 1.35 0.623 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.756 -175.569 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.594 HD13 ' HB3' ' A' ' 87' ' ' ASP . 45.5 pt -131.33 179.57 4.22 Favored 'Isoleucine or valine' 0 C--O 1.248 1.02 0 C-N-CA 125.112 1.365 . . . . 0.0 108.764 178.227 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 3.2 m -80.34 151.59 29.4 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 109.138 -0.689 . . . . 0.0 109.138 167.06 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.531 HD11 ' HB2' ' A' ' 11' ' ' CYS . 7.8 tt -62.86 -29.95 71.13 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.18 0.592 . . . . 0.0 111.591 -178.019 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.523 ' HG2' ' HE2' ' A' ' 90' ' ' LYS . 34.5 tt0 -64.83 -37.01 86.18 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.095 0.558 . . . . 0.0 111.397 179.133 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.594 ' HB3' HD13 ' A' ' 83' ' ' ILE . 5.3 t70 -61.88 -34.06 75.32 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.881 0.872 . . . . 0.0 110.366 -179.411 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -72.23 -11.63 60.81 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.883 0.873 . . . . 0.0 113.017 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.472 HD11 ' HE2' ' A' ' 20' ' ' MET . 84.2 mt -96.43 -53.0 8.59 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 123.641 0.776 . . . . 0.0 109.723 178.27 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.523 ' HE2' ' HG2' ' A' ' 86' ' ' GLN . 0.2 OUTLIER -72.97 -42.46 63.31 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.456 0.702 . . . . 0.0 111.834 -176.453 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -117.81 26.67 9.52 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.343 1.057 . . . . 0.0 110.098 -167.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.49 -58.89 3.68 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.667 0.787 . . . . 0.0 112.956 -174.393 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -64.66 -33.92 77.08 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.103 177.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . 0.437 ' O ' ' HG2' ' A' ' 98' ' ' GLU . . . -60.5 -52.24 53.8 Favored Glycine 0 C--N 1.354 1.579 0 O-C-N 124.474 1.109 . . . . 0.0 112.269 -178.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 22.1 mt -55.73 -53.8 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 124.653 1.181 . . . . 0.0 109.933 -179.143 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 88.8 mt -57.05 -51.34 70.24 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.954 0 CA-C-N 114.47 -1.241 . . . . 0.0 111.638 -177.074 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.03 -30.44 69.66 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -178.355 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 94' ' ' GLY . 31.2 mm-40 -63.15 -41.35 99.26 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.4 0.68 . . . . 0.0 109.751 177.107 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . 0.442 HG21 HG22 ' A' ' 60' ' ' ILE . 58.5 mt -76.23 -35.25 27.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 -177.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -60.77 -48.14 83.14 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.024 0.93 . . . . 0.0 111.516 178.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -70.25 -36.85 74.75 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.952 -179.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 62.3 mtm -69.4 -52.01 31.02 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.905 0.482 . . . . 0.0 111.645 -178.033 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 20.0 mt -59.89 -49.08 85.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 O-C-N 123.677 0.611 . . . . 0.0 110.43 178.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.34 -28.21 69.85 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -178.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 32.8 t -81.4 -35.57 30.58 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 122.789 0.435 . . . . 0.0 111.551 -178.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -81.7 -30.27 32.64 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 122.368 0.267 . . . . 0.0 111.48 -178.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -76.45 -46.53 26.56 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 122.474 0.309 . . . . 0.0 110.457 178.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 86.9 mm-40 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.877 -0.583 . . . . 0.0 110.316 179.605 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 48.7 pttt . . . . . 0 N--CA 1.474 0.765 0 CA-C-O 120.936 0.398 . . . . 0.0 110.249 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.567 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.7 tmtp? -145.34 132.85 20.81 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 -169.261 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.49 HD12 HG13 ' A' ' 96' ' ' ILE . 10.4 tt -121.23 135.16 55.18 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 107.705 -1.22 . . . . 0.0 107.705 176.145 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.544 HD12 HD11 ' A' ' 50' ' ' LEU . 15.9 pt -127.92 161.27 36.33 Favored 'Isoleucine or valine' 0 C--O 1.242 0.705 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 174.75 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.546 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -152.62 167.54 28.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.12 178.654 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.534 HD23 ' HG3' ' A' ' 41' ' ' GLN . 2.5 tt -140.73 114.97 9.26 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 -178.344 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.531 ' HA ' ' O ' ' A' ' 64' ' ' SER . 56.2 m -107.08 113.14 26.42 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.817 0.847 . . . . 0.0 108.973 176.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -128.87 123.89 33.84 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 122.596 0.358 . . . . 0.0 111.225 -177.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.749 ' SG ' HD12 ' A' ' 85' ' ' LEU . 1.2 m -133.55 149.77 73.09 Favored Pre-proline 0 N--CA 1.479 0.996 0 C-N-CA 124.022 0.929 . . . . 0.0 110.362 177.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -79.52 -11.86 14.12 Favored 'Trans proline' 0 C--N 1.375 1.928 0 C-N-CA 122.596 2.197 . . . . 0.0 112.013 176.657 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 21.8 mmt -73.33 -50.61 21.16 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.309 1.043 . . . . 0.0 110.348 -176.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 158.66 -175.18 35.75 Favored Glycine 0 C--N 1.346 1.105 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.107 -179.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 74.3 mt -78.6 -16.47 57.34 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.111 0.564 . . . . 0.0 112.357 -176.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -57.69 -51.52 69.21 Favored 'General case' 0 C--O 1.25 1.088 0 CA-C-O 121.29 0.567 . . . . 0.0 111.309 177.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.438 ' ND1' HD23 ' A' ' 85' ' ' LEU . 4.3 t-80 -67.06 -38.54 85.97 Favored 'General case' 0 C--O 1.248 1.017 0 CA-C-N 114.866 -1.061 . . . . 0.0 110.213 -176.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 44.8 p -67.98 -35.68 78.76 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.968 -178.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -70.59 -26.77 63.67 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 122.839 0.455 . . . . 0.0 111.789 178.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 38.1 mtm -68.56 -43.06 77.41 Favored 'General case' 0 N--CA 1.484 1.233 0 CA-C-N 117.717 0.235 . . . . 0.0 110.603 174.009 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.91 -41.94 95.16 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.768 174.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.73 -43.8 98.14 Favored 'General case' 0 C--O 1.216 -0.705 0 CA-C-N 115.201 -0.909 . . . . 0.0 110.743 179.005 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.434 ' O ' ' HG3' ' A' ' 27' ' ' GLU . 9.0 tp-100 -62.71 -44.47 96.14 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.245 0.618 . . . . 0.0 110.816 -178.316 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.461 ' HB1' ' HB1' ' A' ' 92' ' ' ALA . . . -68.02 -49.18 63.1 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.65 -175.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 98.6 mt -64.24 -31.21 72.32 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.241 0.616 . . . . 0.0 111.694 177.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.476 ' O ' HG23 ' A' ' 30' ' ' VAL . 30.7 tt0 -63.09 -56.41 17.14 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.632 0.773 . . . . 0.0 110.17 179.113 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.434 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 49.7 mt-10 -55.05 -46.73 75.37 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 124.187 0.929 . . . . 0.0 110.657 -179.525 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.24 -51.01 71.54 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.322 1.049 . . . . 0.0 111.625 -178.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.14 -22.73 65.77 Favored 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 113.788 1.032 . . . . 0.0 113.788 178.053 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.476 HG23 ' O ' ' A' ' 26' ' ' GLU . 52.1 t -76.56 -43.66 34.87 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 178.748 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -68.45 -26.73 65.65 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 114.831 -1.077 . . . . 0.0 110.354 176.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -76.52 -26.48 55.26 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.211 1.004 . . . . 0.0 111.636 176.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 102.75 15.03 25.63 Favored Glycine 0 C--N 1.349 1.277 0 N-CA-C 114.654 0.622 . . . . 0.0 114.654 168.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.689 ' HH ' ' HG2' ' A' ' 100' ' ' GLU . 1.7 m-85 -95.54 162.54 13.59 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-N 117.844 0.822 . . . . 0.0 109.549 176.028 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.567 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 43.4 tt0 -74.0 126.19 29.94 Favored 'General case' 0 C--O 1.222 -0.373 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 160.732 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.482 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 12.5 p -115.11 132.66 63.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-N 118.772 0.715 . . . . 0.0 111.093 -172.68 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 49.3 tptt -142.33 117.55 10.12 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 179.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.546 HG12 ' HB3' ' A' ' 7' ' ' ALA . 55.9 mt -121.1 112.02 33.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -174.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.504 ' HG3' ' HA ' ' A' ' 49' ' ' ARG . 41.9 tt0 -71.09 138.91 50.13 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.249 1.02 . . . . 0.0 109.176 172.882 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 7.0 p -128.52 122.1 30.34 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 123.895 0.878 . . . . 0.0 108.911 -177.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.534 ' HG3' HD23 ' A' ' 8' ' ' LEU . 2.5 mt-30 -122.04 151.75 40.51 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.622 0.725 . . . . 0.0 111.675 -176.218 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -161.31 173.1 37.68 Favored Glycine 0 C--O 1.241 0.554 0 CA-C-N 114.086 -1.415 . . . . 0.0 110.239 172.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.02 -16.45 63.72 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 122.919 0.487 . . . . 0.0 110.993 176.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -75.7 -34.82 60.43 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 123.821 0.848 . . . . 0.0 110.674 172.067 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 154.26 -176.99 31.91 Favored Glycine 0 C--N 1.348 1.198 0 CA-C-N 116.348 -0.387 . . . . 0.0 113.163 178.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.488 HG22 ' HG2' ' A' ' 41' ' ' GLN . 44.1 mt -108.73 156.15 9.44 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 124.434 1.094 . . . . 0.0 109.677 -178.187 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -151.2 149.61 29.63 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.821 0.848 . . . . 0.0 109.514 178.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.6 t30 60.4 34.68 20.6 Favored 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 124.135 0.974 . . . . 0.0 110.623 173.079 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.504 ' HA ' ' HG3' ' A' ' 39' ' ' GLU . 23.8 ttp180 -63.2 138.64 58.61 Favored 'General case' 0 C--N 1.351 0.652 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 -168.256 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.544 HD11 HD12 ' A' ' 6' ' ' ILE . 57.8 mt -80.4 121.55 25.86 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 113.747 -1.57 . . . . 0.0 111.504 -177.833 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 43.8 p -87.62 166.92 14.35 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 114.675 -1.148 . . . . 0.0 110.229 -177.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -53.13 -34.03 54.95 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.636 0.774 . . . . 0.0 111.898 179.056 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -68.28 -48.19 65.67 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 123.906 0.754 . . . . 0.0 111.271 178.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -58.85 -41.88 88.04 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.398 0.679 . . . . 0.0 111.236 -178.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.494 HG23 ' HG3' ' A' ' 78' ' ' ARG . 41.1 mt -76.09 -35.39 28.63 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.299 -173.834 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.82 -43.81 62.23 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.23 0.612 . . . . 0.0 111.181 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -85.44 -1.31 56.9 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.436 0.694 . . . . 0.0 111.985 -177.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.98 110.2 4.33 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.034 0.534 . . . . 0.0 111.202 178.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 16.4 m -61.55 -36.0 79.35 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 124.299 1.04 . . . . 0.0 110.082 167.012 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.512 HG21 HG23 ' A' ' 99' ' ' ILE . 55.6 mt -135.26 143.13 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 C-N-CA 123.885 0.874 . . . . 0.0 110.416 -179.381 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 23.0 mt -135.17 123.49 39.67 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 123.776 0.83 . . . . 0.0 109.165 173.608 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.2 mp -111.65 140.61 30.31 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.332 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 173.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . 0.524 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 6.9 m170 -114.36 84.89 2.13 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 168.473 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.531 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 15.9 m -81.39 81.98 7.36 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 114.821 -1.081 . . . . 0.0 109.483 176.002 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 30.2 m -125.33 162.72 27.49 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-O 121.782 0.801 . . . . 0.0 112.114 -171.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -114.98 -28.35 7.05 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 114.029 -1.441 . . . . 0.0 108.776 173.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 22.8 m -137.11 168.6 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 125.371 1.469 . . . . 0.0 108.955 178.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 62.1 m -66.42 119.28 61.24 Favored Pre-proline 0 CA--C 1.551 1.013 0 C-N-CA 123.191 0.597 . . . . 0.0 111.02 179.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.498 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 57.9 Cg_endo -72.68 146.3 43.1 Favored 'Trans proline' 0 C--N 1.371 1.718 0 C-N-CA 122.406 2.07 . . . . 0.0 111.12 170.285 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -64.77 -31.98 73.46 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 123.12 0.568 . . . . 0.0 111.826 -175.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -102.81 25.6 9.06 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.461 0.704 . . . . 0.0 111.731 -177.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.498 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 5.8 p30 -60.89 -27.65 68.31 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.088 0.555 . . . . 0.0 110.726 174.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -59.94 -27.28 66.66 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 125.19 1.396 . . . . 0.0 112.985 177.344 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 81.6 mtt180 -68.59 -21.01 64.54 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.285 0.634 . . . . 0.0 111.85 178.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.436 ' HB3' HG23 ' A' ' 80' ' ' VAL . 32.3 m-85 -111.31 7.26 20.96 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.371 1.069 . . . . 0.0 111.236 -174.593 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -53.56 -47.61 69.89 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.761 1.224 . . . . 0.0 113.279 -172.392 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 94.4 p -101.55 4.2 40.81 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.277 0.631 . . . . 0.0 112.348 -174.005 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.494 ' HG3' HG23 ' A' ' 55' ' ' ILE . 29.8 mmt180 -101.65 162.67 12.73 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 122.685 0.394 . . . . 0.0 111.062 -174.216 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -76.7 91.37 3.45 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.357 0.663 . . . . 0.0 110.644 -177.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.436 HG23 ' HB3' ' A' ' 75' ' ' PHE . 31.3 t -109.78 148.96 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 123.815 0.846 . . . . 0.0 110.724 -175.873 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -121.24 89.85 3.21 Favored 'General case' 0 C--N 1.348 0.509 0 C-N-CA 124.448 1.099 . . . . 0.0 108.706 -178.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.524 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 41.9 mt-10 -79.07 122.49 26.28 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.372 -175.082 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.432 HG13 ' HA ' ' A' ' 64' ' ' SER . 46.1 pt -135.69 -176.55 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.85 0 C-N-CA 124.962 1.305 . . . . 0.0 108.954 178.254 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 23.8 p -81.4 152.48 27.42 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-O 120.878 0.37 . . . . 0.0 110.211 170.244 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.749 HD12 ' SG ' ' A' ' 11' ' ' CYS . 6.3 tt -63.86 -29.82 70.97 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.064 175.716 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -63.9 -44.75 92.05 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.85 176.039 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -60.63 -32.12 71.29 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 122.921 0.488 . . . . 0.0 110.973 -177.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.11 -35.87 81.66 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.05 0.94 . . . . 0.0 112.748 178.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 59.5 mt -76.41 -38.11 31.96 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 O-C-N 123.648 0.593 . . . . 0.0 110.621 -176.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.21 -56.94 3.11 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 122.894 0.478 . . . . 0.0 112.069 -177.675 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -98.21 29.78 3.4 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.11 0.964 . . . . 0.0 110.651 -169.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . 0.461 ' HB1' ' HB1' ' A' ' 24' ' ' ALA . . . -43.74 -63.08 0.91 Allowed 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.35 1.06 . . . . 0.0 113.316 -176.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.96 -34.04 75.39 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.357 -179.53 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . 0.445 ' O ' ' HG2' ' A' ' 98' ' ' GLU . . . -63.83 -47.48 85.77 Favored Glycine 0 C--N 1.353 1.52 0 O-C-N 124.127 0.892 . . . . 0.0 112.613 -179.321 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 19.1 mt -61.7 -53.54 46.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 123.947 0.899 . . . . 0.0 110.461 -177.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.49 HG13 HD12 ' A' ' 5' ' ' LEU . 1.9 mp -55.78 -51.04 64.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 O-C-N 124.015 0.822 . . . . 0.0 110.439 -178.615 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.72 -28.29 67.53 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 123.565 0.54 . . . . 0.0 111.781 -176.074 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.445 ' HG2' ' O ' ' A' ' 94' ' ' GLY . 63.6 mm-40 -62.0 -37.17 83.83 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.304 0.642 . . . . 0.0 109.857 174.34 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . 0.512 HG23 HG21 ' A' ' 60' ' ' ILE . 33.7 mt -79.75 -37.84 18.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.622 -178.413 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.689 ' HG2' ' HH ' ' A' ' 34' ' ' TYR . 32.2 mt-10 -60.17 -41.44 92.84 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.276 0.631 . . . . 0.0 110.974 178.191 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -74.55 -31.95 62.27 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 123.406 0.441 . . . . 0.0 110.988 -178.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 67.7 mtm -66.1 -37.95 87.02 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 122.562 0.345 . . . . 0.0 111.07 172.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.445 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 45.1 mt -69.89 -40.63 79.05 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.855 0 C-N-CA 123.161 0.584 . . . . 0.0 109.555 175.439 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.12 -18.61 64.68 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.503 0.721 . . . . 0.0 111.212 177.159 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 33.3 t -86.61 -41.48 14.23 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.421 0.688 . . . . 0.0 110.849 179.052 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.445 ' HG2' ' HA ' ' A' ' 103' ' ' ILE . 18.6 pt-20 -77.26 -28.4 53.54 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 122.828 0.451 . . . . 0.0 111.504 -176.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 79.1 mm-40 -87.99 -36.83 16.82 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 122.923 0.489 . . . . 0.0 111.044 -179.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 85.0 mm-40 . . . . . 0 N--CA 1.478 0.951 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 176.436 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.576 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 17.1 pttt . . . . . 0 C--O 1.251 1.178 0 CA-C-O 121.618 0.723 . . . . 0.0 111.271 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.567 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.0 tmtp? -147.53 146.01 29.3 Favored 'General case' 0 CA--C 1.55 0.944 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.257 -172.104 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.417 ' N ' ' HD3' ' A' ' 4' ' ' LYS . 8.5 tt -132.8 135.74 45.86 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.608 1.163 . . . . 0.0 108.116 176.116 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 20.4 pt -125.51 162.8 27.77 Favored 'Isoleucine or valine' 0 C--O 1.242 0.682 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 170.134 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.527 ' HB1' HG12 ' A' ' 38' ' ' ILE . . . -150.81 170.54 19.01 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 122.986 0.514 . . . . 0.0 110.028 177.184 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.7 tt -143.91 121.92 12.1 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 107.489 -1.301 . . . . 0.0 107.489 -178.114 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.542 ' HA ' ' O ' ' A' ' 64' ' ' SER . 64.0 m -114.8 113.62 24.48 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.874 0.87 . . . . 0.0 108.984 178.274 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.416 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -126.88 117.83 23.38 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 -174.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.74 ' SG ' HD12 ' A' ' 85' ' ' LEU . 71.5 m -118.33 144.59 35.39 Favored Pre-proline 0 N--CA 1.481 1.095 0 C-N-CA 124.687 1.195 . . . . 0.0 110.039 176.5 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -80.81 -8.99 13.32 Favored 'Trans proline' 0 C--N 1.368 1.597 0 C-N-CA 122.658 2.239 . . . . 0.0 112.671 172.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 53.5 tpp -78.71 -66.7 0.83 Allowed 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.559 0.743 . . . . 0.0 109.873 176.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 179.92 -172.84 44.47 Favored Glycine 0 C--N 1.342 0.885 0 CA-C-N 115.569 -0.741 . . . . 0.0 112.24 -176.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 89.5 mt -82.39 -13.64 56.51 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.231 0.826 . . . . 0.0 113.231 -174.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.08 -49.92 75.24 Favored 'General case' 0 CA--C 1.556 1.207 0 CA-C-O 121.098 0.475 . . . . 0.0 112.163 -179.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.47 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 10.0 t-160 -67.88 -39.44 83.69 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.103 -178.915 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 30.9 p -65.56 -32.41 73.99 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.053 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 14.7 m-30 -73.76 -30.43 62.78 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.484 0.714 . . . . 0.0 112.109 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 67.8 mtm -70.18 -36.48 74.68 Favored 'General case' 0 N--CA 1.487 1.423 0 CA-C-O 120.674 0.274 . . . . 0.0 110.452 173.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.26 -38.13 75.07 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.754 173.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.84 -42.5 81.34 Favored 'General case' 0 C--O 1.214 -0.768 0 C-N-CA 123.735 0.814 . . . . 0.0 110.575 -179.157 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.461 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 20.2 tp60 -64.79 -44.49 89.8 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 122.949 0.499 . . . . 0.0 109.875 177.672 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.53 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -62.45 -51.79 66.1 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.836 -176.295 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 98.5 mt -67.48 -29.98 69.57 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.581 0.752 . . . . 0.0 111.511 178.402 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.479 ' HA ' HG21 ' A' ' 36' ' ' VAL . 32.1 tt0 -60.36 -58.54 8.07 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 123.713 0.633 . . . . 0.0 109.432 176.377 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 23' ' ' GLN . 12.1 mm-40 -51.31 -50.35 59.53 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 124.746 1.279 . . . . 0.0 110.736 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.407 ' HB1' ' HA ' ' A' ' 93' ' ' ALA . . . -55.82 -49.73 72.47 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.596 1.159 . . . . 0.0 112.153 -179.359 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.53 -29.83 70.52 Favored 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 176.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 26' ' ' GLU . 53.2 t -72.45 -36.65 55.17 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -179.54 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.445 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 14.1 mm-40 -71.37 -31.43 67.3 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.466 1.106 . . . . 0.0 110.801 177.549 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.77 -23.23 60.79 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.749 0.819 . . . . 0.0 111.616 175.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.13 23.21 27.86 Favored Glycine 0 C--N 1.348 1.2 0 N-CA-C 114.953 0.741 . . . . 0.0 114.953 166.003 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.576 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -118.29 178.03 4.59 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.294 0.638 . . . . 0.0 110.889 169.821 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.567 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 43.0 tt0 -74.51 147.47 41.83 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.432 178.124 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.479 HG21 ' HA ' ' A' ' 26' ' ' GLU . 15.0 p -127.12 139.33 52.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 122.756 0.422 . . . . 0.0 110.176 178.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.2 tptt -145.96 110.04 4.94 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 173.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.527 HG12 ' HB1' ' A' ' 7' ' ' ALA . 47.3 mt -115.07 111.33 35.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 C-N-CA 122.734 0.413 . . . . 0.0 111.338 -176.68 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.42 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 32.7 tt0 -73.51 145.66 45.44 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.448 0.699 . . . . 0.0 109.195 169.415 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.408 HG22 ' HB2' ' A' ' 9' ' ' CYS . 13.3 p -129.69 113.96 15.41 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 123.699 0.799 . . . . 0.0 108.877 -179.839 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.417 HE22 ' HB2' ' A' ' 70' ' ' GLU . 45.2 mt-30 -105.21 143.64 33.11 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.264 0.626 . . . . 0.0 110.223 179.441 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . 0.403 ' HA2' ' O ' ' A' ' 11' ' ' CYS . . . -162.17 163.05 34.7 Favored Glycine 0 C--N 1.336 0.544 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.928 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.51 -23.61 67.47 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.186 0.595 . . . . 0.0 110.924 173.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -73.52 -35.06 65.53 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 124.431 1.092 . . . . 0.0 111.278 175.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 160.4 -174.46 37.12 Favored Glycine 0 C--N 1.347 1.174 0 CA-C-N 116.135 -0.484 . . . . 0.0 112.332 -178.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 76.7 mt -123.36 134.9 64.95 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 123.439 0.696 . . . . 0.0 109.153 174.471 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -127.77 149.99 50.01 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.313 1.045 . . . . 0.0 109.675 -178.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 6.8 t30 61.7 40.13 13.5 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 124.504 1.122 . . . . 0.0 110.58 173.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 16.1 tpp180 -47.81 122.59 5.11 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 125.576 1.55 . . . . 0.0 112.603 -176.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.42 ' HG ' ' HB2' ' A' ' 39' ' ' GLU . 42.4 mt -69.39 133.6 47.99 Favored 'General case' 0 C--O 1.241 0.657 0 C-N-CA 124.419 1.088 . . . . 0.0 111.032 174.712 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 44.8 p -91.7 163.37 14.11 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 115.113 -0.948 . . . . 0.0 109.085 175.006 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.33 -26.46 66.59 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 122.527 0.331 . . . . 0.0 110.895 173.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.409 HE21 ' HG3' ' A' ' 57' ' ' GLU . 23.2 tp60 -70.0 -43.34 71.59 Favored 'General case' 0 C--N 1.355 0.834 0 C-N-CA 123.788 0.835 . . . . 0.0 110.634 177.039 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 45.0 m-20 -58.18 -43.21 87.39 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 122.807 0.443 . . . . 0.0 110.677 176.24 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 22.9 mt -70.24 -27.76 33.2 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 O-C-N 123.986 0.804 . . . . 0.0 110.614 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.47 -40.51 42.85 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.916 0.886 . . . . 0.0 111.817 179.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.409 ' HG3' HE21 ' A' ' 53' ' ' GLN . 46.6 mt-10 -74.4 -32.0 62.54 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.903 0.881 . . . . 0.0 111.117 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -52.75 99.37 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.658 0 O-C-N 124.747 1.279 . . . . 0.0 113.099 -171.177 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 26.1 m -62.42 -34.5 76.87 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 123.551 0.741 . . . . 0.0 109.163 167.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.476 HG22 HG23 ' A' ' 99' ' ' ILE . 76.7 mt -132.33 140.54 47.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.397 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.413 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 21.8 mt -130.38 139.06 52.3 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 172.072 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -126.81 128.95 71.38 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 173.631 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 13.5 m170 -103.54 86.97 2.73 Favored 'General case' 0 N--CA 1.489 1.49 0 CA-C-N 118.853 0.751 . . . . 0.0 109.486 169.457 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.542 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 19.6 m -82.86 82.4 8.17 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 124.653 1.181 . . . . 0.0 109.631 175.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 26.9 m -127.8 163.88 30.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-O 121.643 0.735 . . . . 0.0 111.719 -169.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -117.73 -14.9 10.15 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 114.322 -1.308 . . . . 0.0 109.594 174.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 15.2 m -132.07 177.99 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 125.283 1.433 . . . . 0.0 109.359 178.356 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 81.1 m -72.76 114.89 34.5 Favored Pre-proline 0 CA--C 1.545 0.767 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 167.235 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.616 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 33.3 Cg_endo -68.94 146.65 65.99 Favored 'Trans proline' 0 C--N 1.374 1.908 0 C-N-CA 121.788 1.659 . . . . 0.0 110.574 174.747 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.417 ' HB2' HE22 ' A' ' 41' ' ' GLN . 20.1 mm-40 -65.13 -33.7 76.65 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-O 121.387 0.613 . . . . 0.0 111.142 -172.668 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -96.85 9.8 40.81 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.778 -174.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.616 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 8.5 t30 -55.28 -34.98 64.57 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 124.112 0.965 . . . . 0.0 112.016 179.016 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -59.55 -22.91 62.37 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 124.993 1.317 . . . . 0.0 113.444 177.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 29.3 mtp180 -87.13 -18.71 29.82 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.877 0.871 . . . . 0.0 111.103 -178.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.427 ' HB3' HG21 ' A' ' 80' ' ' VAL . 70.6 m-85 -102.56 7.71 39.99 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 124.191 0.996 . . . . 0.0 110.745 178.31 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.8 tp10 -57.48 -51.01 71.17 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 124.696 1.198 . . . . 0.0 112.453 -172.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 56.6 p -86.94 -10.55 52.99 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.226 0.61 . . . . 0.0 112.145 -177.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 26.6 mmt180 -89.72 157.3 18.03 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.59 0.756 . . . . 0.0 110.998 -177.109 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -78.28 95.73 5.09 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.491 0.716 . . . . 0.0 110.946 -174.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.427 HG21 ' HB3' ' A' ' 75' ' ' PHE . 44.6 t -110.85 140.91 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 123.398 0.679 . . . . 0.0 110.784 -177.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -109.53 91.3 3.59 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 124.511 1.124 . . . . 0.0 108.95 176.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -76.78 133.0 39.55 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.128 -177.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.409 HG13 ' HA ' ' A' ' 64' ' ' SER . 31.5 pt -145.06 -173.25 0.46 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.838 0 C-N-CA 125.371 1.468 . . . . 0.0 108.438 176.168 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 35.5 p -86.78 153.54 21.6 Favored 'General case' 0 C--O 1.24 0.591 0 CA-C-O 121.211 0.529 . . . . 0.0 110.274 169.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.74 HD12 ' SG ' ' A' ' 11' ' ' CYS . 6.0 tt -66.27 -29.75 70.04 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.702 176.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -59.31 -45.93 89.97 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 123.884 0.874 . . . . 0.0 110.957 172.23 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -62.35 -33.35 74.55 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 123.894 0.746 . . . . 0.0 110.981 -179.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.476 ' HB2' ' HB3' ' A' ' 64' ' ' SER . . . -63.54 -31.51 72.7 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.79 0.836 . . . . 0.0 112.557 179.594 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 74.1 mt -79.21 -57.05 5.72 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.218 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.72 -47.43 53.95 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 115.865 -0.607 . . . . 0.0 112.167 -173.68 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -105.16 22.91 14.51 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.156 0.983 . . . . 0.0 110.962 -170.483 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . 0.53 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -39.42 -61.98 0.73 Allowed 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 124.796 1.238 . . . . 0.0 113.985 -174.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.407 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . . . -68.65 -30.82 69.61 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 114.564 -1.198 . . . . 0.0 111.345 -178.242 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.54 -45.24 95.2 Favored Glycine 0 C--N 1.35 1.342 0 O-C-N 123.942 0.776 . . . . 0.0 111.939 179.251 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 13.5 mt -60.79 -56.05 20.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.338 1.055 . . . . 0.0 110.471 -179.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.7 mp -56.23 -49.76 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 O-C-N 123.781 0.675 . . . . 0.0 111.011 -178.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.62 -27.69 66.25 Favored 'General case' 0 N--CA 1.485 1.318 0 O-C-N 123.294 0.371 . . . . 0.0 111.342 -176.77 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -62.33 -42.03 99.05 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.418 0.687 . . . . 0.0 109.856 175.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . 0.476 HG23 HG22 ' A' ' 60' ' ' ILE . 25.9 mt -76.83 -36.46 26.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 -176.01 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -61.77 -44.14 97.47 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-N 114.539 -1.209 . . . . 0.0 111.794 176.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -76.4 -29.52 57.13 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 123.123 0.264 . . . . 0.0 110.904 -176.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 69.0 mtm -69.0 -54.12 16.92 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 122.749 0.42 . . . . 0.0 110.313 176.051 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 62.5 mt -60.36 -45.92 95.8 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 123.165 0.586 . . . . 0.0 110.263 178.529 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.486 ' O ' ' HG2' ' A' ' 108' ' ' GLN . . . -56.08 -48.5 75.97 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 122.869 0.467 . . . . 0.0 110.811 179.375 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 22.9 t -63.73 -43.01 97.8 Favored 'General case' 0 N--CA 1.48 1.038 0 O-C-N 123.785 0.678 . . . . 0.0 111.614 -171.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -74.54 -23.84 58.86 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.887 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -87.51 -19.05 28.48 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.655 0.382 . . . . 0.0 111.093 175.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' A' ' 104' ' ' ALA . 86.0 mm-40 . . . . . 0 C--O 1.253 1.264 0 C-N-CA 123.369 0.668 . . . . 0.0 109.236 173.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.555 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 5.8 pttt . . . . . 0 N--CA 1.48 1.063 0 CA-C-O 120.859 0.361 . . . . 0.0 110.178 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.567 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.6 tmtp? -145.14 144.08 30.7 Favored 'General case' 0 CA--C 1.556 1.208 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 -178.319 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.45 ' N ' ' HD3' ' A' ' 4' ' ' LYS . 9.1 tt -130.04 136.56 49.51 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.03 1.332 . . . . 0.0 107.583 174.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.459 HG13 HG21 ' A' ' 61' ' ' ILE . 21.4 pt -126.76 159.67 36.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 170.658 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.558 ' HB2' HG12 ' A' ' 38' ' ' ILE . . . -149.23 166.33 29.21 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 123.001 0.52 . . . . 0.0 110.107 177.052 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.551 HD23 ' HG3' ' A' ' 41' ' ' GLN . 3.1 tt -139.3 112.16 7.91 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 -178.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.555 ' HA ' ' O ' ' A' ' 64' ' ' SER . 62.9 m -99.94 114.31 27.48 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.9 0.88 . . . . 0.0 109.39 175.151 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.447 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -131.04 122.82 27.44 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 122.768 0.427 . . . . 0.0 111.208 -179.165 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.752 ' SG ' HD12 ' A' ' 85' ' ' LEU . 1.2 m -134.88 148.15 65.84 Favored Pre-proline 0 N--CA 1.478 0.945 0 C-N-CA 123.844 0.858 . . . . 0.0 110.619 178.495 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -79.57 -12.49 13.8 Favored 'Trans proline' 0 C--N 1.373 1.856 0 C-N-CA 122.74 2.294 . . . . 0.0 111.243 173.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 45.7 mtt -65.51 -42.59 91.88 Favored 'General case' 0 C--N 1.352 0.68 0 C-N-CA 125.086 1.354 . . . . 0.0 109.746 177.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 141.94 -177.94 21.04 Favored Glycine 0 C--N 1.348 1.233 0 CA-C-N 115.483 -0.781 . . . . 0.0 111.962 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 29.9 mt -73.36 -25.04 60.43 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -177.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.66 -41.99 91.84 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-O 121.091 0.472 . . . . 0.0 111.049 179.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.527 ' ND1' HD21 ' A' ' 85' ' ' LEU . 12.9 t-80 -67.77 -42.64 81.41 Favored 'General case' 0 C--O 1.251 1.133 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.282 179.305 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.411 ' HA ' HD11 ' A' ' 85' ' ' LEU . 43.5 p -66.5 -30.4 70.72 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 115.085 -0.961 . . . . 0.0 111.214 -179.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 18.8 m-30 -71.12 -32.66 69.28 Favored 'General case' 0 C--N 1.351 0.639 0 C-N-CA 123.317 0.647 . . . . 0.0 110.967 179.027 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 47.6 mtm -65.65 -39.3 91.25 Favored 'General case' 0 N--CA 1.486 1.335 0 CA-C-O 120.74 0.305 . . . . 0.0 110.713 176.126 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.22 -37.65 72.02 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.417 174.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.54 -38.55 91.4 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.717 0.807 . . . . 0.0 110.816 179.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 7.6 tp-100 -68.98 -45.65 70.08 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.027 0.531 . . . . 0.0 110.173 179.042 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.43 ' HB1' ' HB1' ' A' ' 92' ' ' ALA . . . -59.93 -57.21 13.86 Favored 'General case' 0 C--O 1.242 0.675 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.298 -177.785 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.424 HD13 ' OG ' ' A' ' 64' ' ' SER . 94.7 mt -64.2 -32.0 73.41 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.005 0.522 . . . . 0.0 111.852 -178.58 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.501 ' HA ' HG21 ' A' ' 36' ' ' VAL . 32.4 tt0 -61.64 -56.39 20.35 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 110.121 -0.326 . . . . 0.0 110.121 -179.283 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.453 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 44.5 mm-40 -54.02 -49.07 69.73 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 124.584 1.177 . . . . 0.0 111.502 179.229 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.44 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -65.48 -36.19 83.14 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.438 0.695 . . . . 0.0 112.099 -176.603 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.93 -24.13 58.45 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.06 0.544 . . . . 0.0 111.896 177.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.489 HG21 ' O ' ' A' ' 26' ' ' GLU . 54.5 t -68.68 -41.34 82.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 174.34 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 10.0 mm-40 -70.33 -25.9 63.51 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 114.027 -1.442 . . . . 0.0 111.185 179.363 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -82.77 -2.17 53.68 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 123.474 0.71 . . . . 0.0 112.407 178.229 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 87.84 17.72 57.57 Favored Glycine 0 C--N 1.35 1.346 0 N-CA-C 115.675 1.03 . . . . 0.0 115.675 164.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.555 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -130.16 175.37 8.97 Favored 'General case' 0 N--CA 1.484 1.263 0 CA-C-N 117.908 0.854 . . . . 0.0 112.639 175.579 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.567 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 37.0 tt0 -72.21 149.29 44.75 Favored 'General case' 0 C--N 1.353 0.737 0 CA-C-N 114.675 -1.148 . . . . 0.0 108.95 175.435 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.501 HG21 ' HA ' ' A' ' 26' ' ' GLU . 8.1 p -133.16 135.52 56.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 122.65 0.38 . . . . 0.0 110.2 -179.553 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 49.6 tptt -142.4 113.9 7.86 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 175.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.558 HG12 ' HB2' ' A' ' 7' ' ' ALA . 43.1 mt -116.78 110.35 31.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 122.838 0.455 . . . . 0.0 111.699 -176.325 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -74.0 144.97 44.94 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.421 0.688 . . . . 0.0 109.192 172.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 10.6 p -128.9 113.89 15.8 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.772 0.829 . . . . 0.0 109.46 -177.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.551 ' HG3' HD23 ' A' ' 8' ' ' LEU . 8.1 mt-30 -109.82 141.42 42.52 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 177.611 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -165.35 -177.22 37.58 Favored Glycine 0 C--O 1.241 0.593 0 N-CA-C 111.836 -0.506 . . . . 0.0 111.836 179.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.02 -31.9 70.38 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.366 0.666 . . . . 0.0 111.271 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -66.33 -40.38 89.85 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.447 0.699 . . . . 0.0 110.951 177.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 150.27 -158.6 27.75 Favored Glycine 0 C--N 1.344 1.023 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.989 -176.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 66.1 mt -116.14 137.48 49.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 C-N-CA 123.578 0.751 . . . . 0.0 109.556 179.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -136.83 151.11 48.77 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.111 0.964 . . . . 0.0 109.308 -176.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 17.2 t30 60.61 36.27 19.77 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 124.105 0.962 . . . . 0.0 110.242 177.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 14.5 tpp180 -43.59 125.63 4.1 Favored 'General case' 0 C--N 1.362 1.109 0 C-N-CA 126.292 1.837 . . . . 0.0 113.269 -174.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 50.1 mt -77.61 128.46 34.16 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.724 171.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 45.2 p -96.15 165.51 12.19 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.313 -0.858 . . . . 0.0 108.843 176.057 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.95 -29.94 67.51 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 122.697 0.399 . . . . 0.0 111.463 178.081 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.411 HE21 ' HG3' ' A' ' 57' ' ' GLU . 26.5 tp60 -62.65 -41.47 99.06 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.839 0.856 . . . . 0.0 111.508 176.632 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.406 ' HB3' HG23 ' A' ' 6' ' ' ILE . 56.5 m-20 -63.81 -45.09 91.23 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 122.98 0.512 . . . . 0.0 110.545 176.835 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 10.5 mt -69.11 -28.54 39.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 O-C-N 123.836 0.71 . . . . 0.0 110.847 -178.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.68 -44.97 61.12 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.721 0.808 . . . . 0.0 111.216 -179.114 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.411 ' HG3' HE21 ' A' ' 53' ' ' GLN . 40.9 mt-10 -84.24 -11.19 56.89 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.303 0.641 . . . . 0.0 111.643 -179.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.44 100.67 0.19 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.107 0.563 . . . . 0.0 111.83 -177.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 32.5 m -61.9 -40.94 97.17 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.218 168.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.498 HG23 HG23 ' A' ' 99' ' ' ILE . 68.4 mt -128.47 140.19 49.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.239 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.459 HG21 HG13 ' A' ' 6' ' ' ILE . 20.4 mt -131.21 133.8 62.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 171.75 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.4 mp -120.7 136.05 58.96 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 173.374 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . 0.484 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 8.5 m170 -107.76 86.37 2.29 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 167.544 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.555 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 33.9 m -79.22 79.91 5.62 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 114.529 -1.214 . . . . 0.0 109.208 175.598 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 36.0 m -127.54 161.09 35.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 121.553 0.692 . . . . 0.0 112.034 -169.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -118.34 -17.19 9.53 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.33 1.452 . . . . 0.0 108.751 174.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 11.8 m -133.93 160.1 42.07 Favored 'Isoleucine or valine' 0 C--N 1.35 0.621 0 C-N-CA 125.399 1.48 . . . . 0.0 109.096 175.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 41.6 m -69.78 109.98 5.69 Favored Pre-proline 0 CA--C 1.554 1.115 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 174.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -67.13 149.36 82.02 Favored 'Trans proline' 0 C--N 1.379 2.14 0 C-N-CA 122.381 2.054 . . . . 0.0 111.455 -177.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -61.64 -31.64 71.75 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.223 0.609 . . . . 0.0 111.938 -171.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -104.14 21.24 16.85 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.482 0.713 . . . . 0.0 111.707 -175.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -60.66 -28.92 68.95 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.15 0.58 . . . . 0.0 111.841 -176.497 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -58.14 -32.59 68.32 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.164 0.985 . . . . 0.0 113.264 -179.103 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 74.4 mtt-85 -61.24 -38.53 87.01 Favored 'General case' 0 N--CA 1.483 1.224 0 CA-C-O 121.944 0.878 . . . . 0.0 110.52 177.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.418 ' HB3' HG21 ' A' ' 80' ' ' VAL . 41.0 m-85 -94.97 -19.83 19.89 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 113.794 -1.548 . . . . 0.0 111.001 -172.419 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -62.18 -30.08 70.81 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.171 0.988 . . . . 0.0 111.322 -176.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 22.6 t -81.53 -7.22 59.56 Favored 'General case' 0 CA--C 1.554 1.109 0 C-N-CA 123.824 0.849 . . . . 0.0 111.675 178.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 14.5 mmt85 -116.95 169.74 9.16 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.292 1.037 . . . . 0.0 110.24 -171.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -78.53 96.44 5.44 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.257 0.623 . . . . 0.0 110.801 -178.19 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.418 HG21 ' HB3' ' A' ' 75' ' ' PHE . 43.0 t -119.22 142.13 35.89 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 123.837 0.855 . . . . 0.0 110.674 -177.07 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 -108.8 94.01 4.82 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 177.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.484 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 38.8 mt-10 -83.06 114.17 21.11 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 115.267 -0.878 . . . . 0.0 110.956 -173.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.455 HD13 ' HG ' ' A' ' 64' ' ' SER . 45.6 pt -125.14 -173.84 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 124.74 1.216 . . . . 0.0 109.792 -179.017 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 20.3 p -83.55 149.14 26.78 Favored 'General case' 0 C--N 1.345 0.38 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.17 168.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.752 HD12 ' SG ' ' A' ' 11' ' ' CYS . 7.2 tt -63.68 -32.49 73.99 Favored 'General case' 0 N--CA 1.486 1.352 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.247 178.391 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.425 ' HG2' ' HE3' ' A' ' 90' ' ' LYS . 29.8 tt0 -61.22 -43.35 99.01 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.932 175.576 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -60.55 -31.31 70.42 Favored 'General case' 0 C--N 1.359 1.017 0 O-C-N 123.857 0.723 . . . . 0.0 110.825 179.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.49 -40.79 89.47 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.494 0.718 . . . . 0.0 111.908 177.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 63.0 mt -69.65 -42.01 80.33 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.899 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.57 -176.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.425 ' HE3' ' HG2' ' A' ' 86' ' ' GLN . 18.2 ptpt -87.56 -46.69 9.34 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 122.823 0.449 . . . . 0.0 112.191 -176.085 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -108.48 27.17 9.64 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 124.012 0.925 . . . . 0.0 110.946 -167.194 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . 0.43 ' HB1' ' HB1' ' A' ' 24' ' ' ALA . . . -43.23 -57.96 2.73 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 124.383 1.073 . . . . 0.0 113.066 -177.448 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.37 -42.93 99.8 Favored 'General case' 0 C--N 1.344 0.357 0 CA-C-N 114.696 -1.138 . . . . 0.0 110.878 178.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -59.11 -47.6 89.99 Favored Glycine 0 C--N 1.352 1.462 0 O-C-N 124.269 0.98 . . . . 0.0 113.153 -176.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.402 ' O ' HG13 ' A' ' 99' ' ' ILE . 14.4 mt -62.84 -55.75 21.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 123.946 0.898 . . . . 0.0 109.647 -177.375 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.44 HD13 ' HB1' ' A' ' 28' ' ' ALA . 69.2 mt -58.92 -46.62 91.25 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 CA-C-N 114.139 -1.391 . . . . 0.0 111.357 -175.165 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.54 -31.49 69.74 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 122.63 0.372 . . . . 0.0 110.645 -178.481 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -58.48 -44.02 89.18 Favored 'General case' 0 C--N 1.366 1.303 0 C-N-CA 123.369 0.668 . . . . 0.0 109.542 173.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . 0.498 HG23 HG23 ' A' ' 60' ' ' ILE . 34.2 mt -76.41 -30.64 19.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.558 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 -174.598 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -62.5 -47.27 84.7 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.252 1.021 . . . . 0.0 111.772 175.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -74.35 -36.49 63.62 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 123.454 0.471 . . . . 0.0 110.624 -177.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 6.4 mtp -66.58 -52.83 41.12 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.179 0.991 . . . . 0.0 111.136 178.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.435 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 31.0 mt -66.33 -35.35 74.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.898 177.432 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.527 ' O ' ' HG2' ' A' ' 108' ' ' GLN . . . -58.61 -45.03 90.03 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 118.072 0.396 . . . . 0.0 110.377 174.662 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 22.7 t -67.56 -35.12 78.42 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.54 0.736 . . . . 0.0 111.312 -172.275 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.435 ' HG2' ' HA ' ' A' ' 103' ' ' ILE . 9.5 pt-20 -79.1 -28.45 43.01 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 116.763 -0.199 . . . . 0.0 111.307 177.171 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.416 ' HG2' ' O ' ' A' ' 103' ' ' ILE . 13.7 mm-40 -79.34 -11.35 59.93 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 122.541 0.336 . . . . 0.0 110.957 176.477 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.527 ' HG2' ' O ' ' A' ' 104' ' ' ALA . 80.4 mm-40 . . . . . 0 C--O 1.258 1.518 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 170.227 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 40.6 pttt . . . . . 0 CA--C 1.551 1.006 0 CA-C-O 120.614 0.245 . . . . 0.0 111.53 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.549 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.6 tmtp? -144.06 131.82 21.34 Favored 'General case' 0 N--CA 1.486 1.338 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 -172.095 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.468 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 10.4 tt -126.09 138.47 53.7 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 178.498 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 20.4 pt -128.68 164.16 31.49 Favored 'Isoleucine or valine' 0 C--O 1.241 0.644 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 171.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.525 ' HB2' HG12 ' A' ' 38' ' ' ILE . . . -152.02 168.35 25.49 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.037 178.129 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.8 tt -141.15 114.93 9.03 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 107.058 -1.46 . . . . 0.0 107.058 -177.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.532 ' HA ' ' O ' ' A' ' 64' ' ' SER . 61.4 m -106.72 113.06 26.34 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 176.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.411 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -127.41 127.49 44.23 Favored 'General case' 0 N--CA 1.497 1.922 0 C-N-CA 122.482 0.313 . . . . 0.0 111.836 -175.696 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.778 ' SG ' HD11 ' A' ' 85' ' ' LEU . 50.1 m -125.21 144.78 48.47 Favored Pre-proline 0 N--CA 1.478 0.935 0 C-N-CA 124.48 1.112 . . . . 0.0 110.609 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -75.82 -14.65 19.35 Favored 'Trans proline' 0 C--N 1.37 1.695 0 C-N-CA 122.379 2.053 . . . . 0.0 112.244 173.055 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 54.8 tpp -83.46 -71.76 0.49 Allowed 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.277 0.631 . . . . 0.0 110.531 178.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -171.43 -175.37 39.77 Favored Glycine 0 C--N 1.347 1.178 0 C-N-CA 121.807 -0.235 . . . . 0.0 113.351 -176.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 60.7 mt -82.37 -17.68 44.74 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -173.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.0 -43.6 91.51 Favored 'General case' 0 N--CA 1.487 1.418 0 CA-C-N 119.074 0.852 . . . . 0.0 111.253 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.502 ' HA ' ' HE1' ' A' ' 20' ' ' MET . 18.2 t-160 -66.43 -43.04 86.75 Favored 'General case' 0 C--O 1.246 0.882 0 CA-C-N 115.015 -0.993 . . . . 0.0 110.199 178.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 31.8 p -66.42 -30.34 70.68 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 115.072 -0.967 . . . . 0.0 111.13 -178.22 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.1 m-30 -73.55 -32.11 64.01 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.328 0.651 . . . . 0.0 111.631 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' MET . . . . . 0.502 ' HE1' ' HA ' ' A' ' 17' ' ' HIS . 64.4 mtm -66.41 -38.98 88.68 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-O 120.788 0.328 . . . . 0.0 110.508 173.497 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.0 -40.58 82.99 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.89 174.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.36 -31.07 68.18 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.831 0.853 . . . . 0.0 110.963 -178.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 24.1 tp60 -67.8 -49.16 63.83 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.298 0.639 . . . . 0.0 109.404 177.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.475 ' HB3' ' HB1' ' A' ' 92' ' ' ALA . . . -66.3 -50.23 64.37 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-N 114.992 -1.004 . . . . 0.0 111.675 -174.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.408 HD11 ' OG ' ' A' ' 64' ' ' SER . 93.1 mt -64.46 -33.0 74.87 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.129 0.572 . . . . 0.0 111.643 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.422 ' O ' HG21 ' A' ' 30' ' ' VAL . 39.1 tt0 -58.3 -58.9 6.43 Favored 'General case' 0 C--N 1.353 0.747 0 O-C-N 123.838 0.711 . . . . 0.0 109.946 175.734 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -54.16 -47.37 72.03 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 124.602 1.189 . . . . 0.0 110.847 -177.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.13 -49.15 78.98 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.372 1.069 . . . . 0.0 111.991 -177.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.42 -21.4 61.99 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 113.329 0.862 . . . . 0.0 113.329 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.422 HG21 ' O ' ' A' ' 26' ' ' GLU . 54.1 t -77.6 -43.65 29.73 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.332 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 177.698 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -64.69 -32.44 74.12 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 114.902 -1.044 . . . . 0.0 110.36 174.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.24 -38.85 82.27 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.352 1.061 . . . . 0.0 111.344 175.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 109.32 22.17 6.93 Favored Glycine 0 C--N 1.342 0.908 0 CA-C-N 115.289 -0.869 . . . . 0.0 114.092 173.163 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.424 ' OH ' ' HG2' ' A' ' 100' ' ' GLU . 1.8 m-85 -95.63 162.95 13.4 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 117.974 0.887 . . . . 0.0 109.84 171.833 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.549 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 40.5 tt0 -75.98 122.82 24.76 Favored 'General case' 0 C--O 1.222 -0.361 0 N-CA-C 106.581 -1.637 . . . . 0.0 106.581 158.499 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.468 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 13.6 p -110.68 136.27 47.21 Favored 'Isoleucine or valine' 0 C--O 1.241 0.617 0 CA-C-N 118.173 0.442 . . . . 0.0 110.195 -173.16 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.1 tptt -143.77 113.84 7.3 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 178.003 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.525 HG12 ' HB2' ' A' ' 7' ' ' ALA . 38.1 mt -117.78 111.7 35.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 122.727 0.411 . . . . 0.0 111.488 -175.433 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -75.53 140.48 42.78 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.648 0.779 . . . . 0.0 109.193 169.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.8 p -123.38 121.94 37.05 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 123.642 0.777 . . . . 0.0 108.945 -179.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.441 HE22 ' HB2' ' A' ' 70' ' ' GLU . 41.1 mt-30 -116.18 151.96 34.66 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.396 0.679 . . . . 0.0 110.365 -178.565 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 179.74 178.33 48.39 Favored Glycine 0 C--N 1.336 0.547 0 CA-C-N 116.106 -0.497 . . . . 0.0 112.897 177.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.47 -25.87 68.46 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.53 0.732 . . . . 0.0 111.067 176.373 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -70.89 -36.08 72.59 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.821 0.848 . . . . 0.0 110.838 175.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 150.21 -162.47 29.24 Favored Glycine 0 C--N 1.349 1.26 0 CA-C-N 116.109 -0.496 . . . . 0.0 112.604 179.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 68.4 mt -120.87 136.86 56.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 124.009 0.924 . . . . 0.0 109.299 174.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -134.94 148.33 50.01 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.075 0.95 . . . . 0.0 109.244 -177.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 9.5 t30 61.92 42.75 9.9 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.501 1.12 . . . . 0.0 110.526 175.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -45.69 128.73 8.75 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 125.794 1.638 . . . . 0.0 113.686 -175.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 44.1 mt -80.47 136.86 36.4 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.583 1.153 . . . . 0.0 110.778 172.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 64.7 p -100.75 172.38 7.11 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.805 0.842 . . . . 0.0 110.375 179.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.75 -35.11 72.21 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.017 0.527 . . . . 0.0 111.201 174.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -58.94 -51.73 68.81 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.841 0.857 . . . . 0.0 111.112 175.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.447 ' O ' ' HB1' ' A' ' 58' ' ' ALA . 75.8 m-20 -59.9 -41.54 91.88 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.237 -175.499 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.433 HG21 ' HG3' ' A' ' 78' ' ' ARG . 50.6 mt -73.58 -42.96 55.52 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.243 0 C-N-CA 123.409 0.683 . . . . 0.0 111.676 -177.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.4 -39.4 71.18 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.215 0.606 . . . . 0.0 111.88 -173.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -93.02 -1.56 56.5 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.18 0.592 . . . . 0.0 111.549 -177.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.447 ' HB1' ' O ' ' A' ' 54' ' ' ASP . . . -64.45 110.11 2.17 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.056 0.542 . . . . 0.0 111.486 177.587 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 26.4 m -60.75 -37.77 82.91 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.083 0.953 . . . . 0.0 109.76 168.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.402 HD11 HD11 ' A' ' 5' ' ' LEU . 59.3 mt -134.47 144.65 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 C-N-CA 123.323 0.649 . . . . 0.0 110.857 177.208 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 21.6 mt -131.37 131.42 63.14 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 C-N-CA 124.07 0.948 . . . . 0.0 109.043 169.168 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -120.1 123.44 70.72 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 174.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . 0.52 ' HB2' ' HG3' ' A' ' 82' ' ' GLU . 18.1 m170 -97.62 84.06 3.33 Favored 'General case' 0 N--CA 1.488 1.457 0 CA-C-N 119.153 0.888 . . . . 0.0 109.736 170.75 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.532 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 28.4 m -79.25 82.83 5.36 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 114.649 -1.159 . . . . 0.0 109.535 175.15 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 32.1 m -127.43 158.1 38.87 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-O 121.379 0.609 . . . . 0.0 111.892 -170.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -103.86 -29.33 11.05 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.351 1.061 . . . . 0.0 109.037 174.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 13.6 m -131.62 169.11 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 125.066 1.346 . . . . 0.0 108.697 176.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 31.9 m -61.34 119.7 48.62 Favored Pre-proline 0 CA--C 1.551 1.014 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 174.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -68.23 151.53 76.65 Favored 'Trans proline' 0 C--N 1.373 1.829 0 C-N-CA 122.342 2.028 . . . . 0.0 110.643 173.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.441 ' HB2' HE22 ' A' ' 41' ' ' GLN . 10.2 mm-40 -63.46 -42.87 98.63 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-O 121.734 0.778 . . . . 0.0 109.84 -176.7 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.402 ' HB3' ' HG3' ' A' ' 74' ' ' ARG . 4.5 m-20 -91.01 21.97 3.94 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 114.809 -1.087 . . . . 0.0 112.402 -173.528 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.4 ' HA ' ' HE1' ' A' ' 63' ' ' HIS . 7.1 p30 -56.01 -33.22 64.67 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.037 0.935 . . . . 0.0 112.613 -177.166 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.96 -18.32 50.7 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.944 0.898 . . . . 0.0 112.64 -174.836 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.402 ' HG3' ' HB3' ' A' ' 71' ' ' ASP . 3.7 mtp85 -67.01 -28.99 68.7 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-O 121.419 0.628 . . . . 0.0 110.705 176.422 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 47.1 m-85 -97.99 -5.51 33.95 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.235 1.014 . . . . 0.0 111.488 -174.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -60.12 -33.68 72.47 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.937 0.895 . . . . 0.0 111.898 -175.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 34.5 p -70.96 -13.37 61.99 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.82 0.848 . . . . 0.0 112.621 179.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.433 ' HG3' HG21 ' A' ' 55' ' ' ILE . 31.5 mmt180 -117.61 177.99 4.55 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 124.074 0.95 . . . . 0.0 111.185 -174.392 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -89.16 100.95 13.63 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.918 0.887 . . . . 0.0 110.402 -177.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 38.4 t -106.97 149.78 10.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.054 -179.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -125.09 90.75 3.29 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 124.133 0.973 . . . . 0.0 108.46 178.082 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.52 ' HG3' ' HB2' ' A' ' 63' ' ' HIS . 1.8 mp0 -78.0 131.88 37.57 Favored 'General case' 0 C--N 1.355 0.847 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.651 -178.131 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.518 HD13 ' HB3' ' A' ' 87' ' ' ASP . 37.3 pt -141.45 -172.5 0.59 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.765 0 C-N-CA 125.58 1.552 . . . . 0.0 107.786 179.315 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 32.0 p -83.03 152.54 25.35 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 121.129 0.49 . . . . 0.0 110.077 168.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.778 HD11 ' SG ' ' A' ' 11' ' ' CYS . 6.7 tt -65.91 -29.37 69.78 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.192 177.281 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.424 ' O ' ' HG2' ' A' ' 90' ' ' LYS . 29.7 tt0 -64.79 -39.45 93.62 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.049 0.54 . . . . 0.0 110.581 174.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.518 ' HB3' HD13 ' A' ' 83' ' ' ILE . 7.5 t70 -59.47 -32.85 70.63 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 124.106 0.962 . . . . 0.0 110.797 178.729 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.427 ' HB1' ' HB3' ' A' ' 64' ' ' SER . . . -66.03 -39.36 90.14 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.417 0.687 . . . . 0.0 112.106 177.194 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 75.3 mt -70.7 -43.07 77.73 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.84 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.724 -177.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.424 ' HG2' ' O ' ' A' ' 86' ' ' GLN . 0.2 OUTLIER -91.68 -44.21 9.15 Favored 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -173.169 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -106.52 22.8 15.24 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.845 0.858 . . . . 0.0 110.829 -169.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . 0.475 ' HB1' ' HB3' ' A' ' 24' ' ' ALA . . . -42.3 -60.93 1.31 Allowed 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 124.071 0.948 . . . . 0.0 112.991 -175.81 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.63 -38.32 84.38 Favored 'General case' 0 C--N 1.348 0.506 0 CA-C-N 115.201 -0.909 . . . . 0.0 111.005 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -61.84 -50.2 68.29 Favored Glycine 0 C--N 1.353 1.482 0 O-C-N 124.415 1.072 . . . . 0.0 112.803 -177.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 17.2 mt -54.4 -58.01 4.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 124.228 1.011 . . . . 0.0 110.415 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.462 ' O ' ' HG3' ' A' ' 100' ' ' GLU . 2.1 mp -57.36 -54.68 27.61 Favored 'Isoleucine or valine' 0 C--N 1.36 1.028 0 O-C-N 124.391 1.057 . . . . 0.0 110.81 -175.813 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.28 -29.86 70.72 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -175.203 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -67.41 -39.0 85.49 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.402 0.681 . . . . 0.0 110.355 177.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . 0.4 HG21 HG22 ' A' ' 60' ' ' ILE . 28.1 mt -75.71 -35.96 32.38 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.462 ' HG3' ' O ' ' A' ' 96' ' ' ILE . 28.4 mt-10 -60.31 -46.3 90.38 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.867 178.327 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -72.31 -31.02 65.33 Favored 'General case' 0 N--CA 1.48 1.03 0 O-C-N 123.594 0.559 . . . . 0.0 111.299 -177.039 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 71.0 mtm -64.4 -48.17 76.42 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-O 120.786 0.327 . . . . 0.0 110.584 173.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 63.9 mt -63.5 -46.17 95.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.038 176.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.24 -20.28 64.8 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.22 0.608 . . . . 0.0 111.627 -177.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 38.2 t -76.73 -41.33 45.49 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 122.65 0.38 . . . . 0.0 110.2 177.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -81.83 -21.59 37.53 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 122.925 0.49 . . . . 0.0 112.267 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 22.9 mm-40 -81.67 -47.66 12.7 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.311 0.644 . . . . 0.0 110.013 176.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 71.6 mm-40 . . . . . 0 C--O 1.251 1.16 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.988 -174.92 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 41.9 pttt . . . . . 0 N--CA 1.481 1.081 0 CA-C-O 120.987 0.422 . . . . 0.0 111.298 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.587 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.1 tmtp? -147.52 135.13 20.93 Favored 'General case' 0 CA--C 1.557 1.212 0 CA-C-O 121.291 0.567 . . . . 0.0 109.625 -173.647 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.457 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 10.1 tt -128.56 138.72 52.37 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.551 1.14 . . . . 0.0 108.339 178.007 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.509 HD11 HD13 ' A' ' 50' ' ' LEU . 20.2 pt -128.78 167.8 23.33 Favored 'Isoleucine or valine' 0 C--O 1.241 0.641 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 172.163 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.587 ' HB2' HG12 ' A' ' 38' ' ' ILE . . . -154.55 169.14 24.53 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.156 177.317 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.6 tt -140.23 116.45 10.55 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 177.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.518 ' HA ' ' O ' ' A' ' 64' ' ' SER . 77.9 m -106.18 115.08 29.6 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 177.347 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.421 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -129.65 116.77 19.33 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 122.819 0.448 . . . . 0.0 111.542 -175.652 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.704 ' SG ' HD13 ' A' ' 85' ' ' LEU . 1.7 m -124.84 143.14 42.89 Favored Pre-proline 0 N--CA 1.479 1.017 0 C-N-CA 124.495 1.118 . . . . 0.0 109.471 175.479 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -77.2 -7.08 16.99 Favored 'Trans proline' 0 C--N 1.375 1.947 0 C-N-CA 122.561 2.174 . . . . 0.0 112.486 -178.479 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 58.3 mtt -79.78 -49.19 12.37 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.353 1.061 . . . . 0.0 110.038 -178.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 162.03 -168.63 37.15 Favored Glycine 0 C--N 1.343 0.93 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.679 -178.038 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 60.4 mt -82.96 -17.72 42.53 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 113.364 0.876 . . . . 0.0 113.364 -176.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.28 -45.09 95.93 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-O 121.482 0.658 . . . . 0.0 111.205 -178.654 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.518 ' HA ' ' HE2' ' A' ' 20' ' ' MET . 1.9 t-80 -65.55 -40.87 93.33 Favored 'General case' 0 C--O 1.247 0.939 0 CA-C-N 114.646 -1.161 . . . . 0.0 110.214 -179.127 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 52.6 p -72.18 -31.79 66.25 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 114.402 -1.272 . . . . 0.0 111.027 -176.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 15.6 m-30 -68.92 -31.95 71.22 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.127 0.571 . . . . 0.0 111.043 178.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' MET . . . . . 0.518 ' HE2' ' HA ' ' A' ' 17' ' ' HIS . 54.5 mtm -67.76 -40.92 84.03 Favored 'General case' 0 N--CA 1.486 1.341 0 O-C-N 123.378 0.424 . . . . 0.0 110.883 174.872 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.97 -37.84 84.98 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.933 174.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.51 -38.98 81.41 Favored 'General case' 0 C--O 1.217 -0.653 0 C-N-CA 123.923 0.889 . . . . 0.0 110.797 179.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -63.69 -43.35 96.9 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.685 0.794 . . . . 0.0 110.158 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.606 ' HB1' ' HB3' ' A' ' 92' ' ' ALA . . . -61.05 -58.32 8.89 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 114.727 -1.124 . . . . 0.0 111.601 179.531 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 95.8 mt -66.92 -30.9 71.17 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.143 0.577 . . . . 0.0 112.164 -176.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.485 ' O ' HG22 ' A' ' 30' ' ' VAL . 36.7 tt0 -62.01 -61.29 2.59 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.062 0.545 . . . . 0.0 109.751 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.532 ' O ' ' HG3' ' A' ' 31' ' ' GLU . 16.5 mm-40 -51.01 -51.94 47.91 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 124.71 1.256 . . . . 0.0 111.661 179.754 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -62.85 -40.18 96.65 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.775 0.83 . . . . 0.0 112.572 -174.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.17 -27.91 61.05 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 122.895 0.478 . . . . 0.0 112.202 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.485 HG22 ' O ' ' A' ' 26' ' ' GLU . 77.7 t -64.1 -44.69 97.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 175.563 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.532 ' HG3' ' O ' ' A' ' 27' ' ' GLU . 18.9 mt-10 -70.23 -32.37 70.21 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 114.755 -1.111 . . . . 0.0 110.4 -179.555 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.78 -17.89 61.54 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.688 0.795 . . . . 0.0 111.636 176.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.81 22.17 11.34 Favored Glycine 0 C--N 1.346 1.114 0 N-CA-C 115.157 0.823 . . . . 0.0 115.157 165.018 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.418 ' CE2' HD12 ' A' ' 60' ' ' ILE . 0.0 OUTLIER -104.04 173.09 6.45 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-N 118.189 0.995 . . . . 0.0 110.522 172.159 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.587 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 43.2 tt0 -83.2 123.65 29.77 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 106.83 -1.544 . . . . 0.0 106.83 157.745 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.457 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 9.5 p -109.12 135.78 46.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 122.931 0.492 . . . . 0.0 110.247 -174.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 47.9 tptt -145.46 116.21 7.72 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 179.124 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.587 HG12 ' HB2' ' A' ' 7' ' ' ALA . 42.5 mt -120.19 110.92 30.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 122.896 0.478 . . . . 0.0 111.846 -172.587 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -79.38 118.89 21.69 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.401 0.68 . . . . 0.0 109.819 175.619 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 34.8 p -96.78 133.11 41.77 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.035 177.315 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.474 ' HG2' HG12 ' A' ' 46' ' ' ILE . 42.6 mt-30 -126.88 141.3 51.85 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.098 0.959 . . . . 0.0 109.537 178.307 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -173.33 177.97 45.49 Favored Glycine 0 C--N 1.335 0.524 0 CA-C-N 116.769 -0.196 . . . . 0.0 113.031 179.525 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.18 -25.94 67.37 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.899 0.88 . . . . 0.0 111.885 178.04 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -75.18 -33.54 61.47 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.74 0.816 . . . . 0.0 111.298 178.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 156.39 -160.52 30.25 Favored Glycine 0 C--N 1.348 1.207 0 O-C-N 123.371 0.42 . . . . 0.0 112.481 179.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.474 HG12 ' HG2' ' A' ' 41' ' ' GLN . 73.1 mt -127.12 135.27 64.04 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.244 0 C-N-CA 123.82 0.848 . . . . 0.0 108.885 172.178 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -136.95 155.0 50.29 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.205 0.602 . . . . 0.0 110.474 -175.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 20.4 t30 60.93 36.76 18.7 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.704 1.202 . . . . 0.0 110.15 177.144 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.45 ' NH1' HG22 ' A' ' 46' ' ' ILE . 19.1 tpp180 -48.66 123.23 6.5 Favored 'General case' 0 C--N 1.361 1.106 0 C-N-CA 125.157 1.383 . . . . 0.0 112.103 -174.747 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.509 HD13 HD11 ' A' ' 6' ' ' ILE . 39.8 mt -70.32 140.37 52.23 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 114.786 -1.097 . . . . 0.0 110.544 173.316 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.448 ' O ' HG13 ' A' ' 55' ' ' ILE . 52.9 p -94.84 161.04 14.33 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 172.557 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.11 -25.21 66.82 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 122.449 0.3 . . . . 0.0 110.813 174.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 25.3 tp60 -65.88 -45.61 81.42 Favored 'General case' 0 C--N 1.354 0.791 0 O-C-N 124.035 0.834 . . . . 0.0 110.485 173.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 -57.86 -44.55 86.65 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.181 0.592 . . . . 0.0 110.943 176.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.554 HD11 HH21 ' A' ' 74' ' ' ARG . 12.5 mt -71.91 -29.78 34.65 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 O-C-N 124.106 0.879 . . . . 0.0 110.738 -176.049 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.78 -46.24 46.78 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.345 0.658 . . . . 0.0 110.828 177.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -67.26 -27.67 67.4 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.855 0.862 . . . . 0.0 111.553 178.186 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -56.19 99.04 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.514 0 O-C-N 124.476 1.11 . . . . 0.0 112.255 -175.074 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 29.1 m -60.99 -37.94 84.26 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 114.553 -1.203 . . . . 0.0 109.237 168.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.418 HD12 ' CE2' ' A' ' 34' ' ' TYR . 83.9 mt -134.22 140.18 46.61 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 C-N-CA 123.854 0.862 . . . . 0.0 110.262 179.805 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.421 HG23 HG13 ' A' ' 6' ' ' ILE . 24.9 mt -129.02 137.18 57.86 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 175.512 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.8 mp -128.4 113.09 28.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 CA-C-N 118.567 0.621 . . . . 0.0 110.104 175.362 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 6.1 m170 -88.24 86.08 7.02 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 121.388 0.614 . . . . 0.0 109.781 173.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.518 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 19.0 m -78.71 79.48 5.13 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 114.67 -1.15 . . . . 0.0 109.52 175.824 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.421 ' O ' ' HA ' ' A' ' 84' ' ' THR . 35.9 m -124.98 157.07 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 CA-C-O 121.869 0.842 . . . . 0.0 111.858 -170.265 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -112.59 -16.42 12.84 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 114.318 -1.31 . . . . 0.0 109.053 173.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 19.2 m -130.4 168.55 23.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 125.604 1.561 . . . . 0.0 109.234 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 64.9 m -78.61 112.95 30.53 Favored Pre-proline 0 CA--C 1.546 0.824 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 170.327 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.442 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 37.6 Cg_endo -63.76 150.26 88.86 Favored 'Trans proline' 0 C--N 1.376 2.009 0 C-N-CA 122.757 2.305 . . . . 0.0 112.367 -177.657 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -67.11 -23.98 65.88 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.176 0.59 . . . . 0.0 110.858 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -102.58 15.6 28.79 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.268 -0.878 . . . . 0.0 112.202 -177.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.442 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 25.6 t30 -53.35 -38.7 63.51 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.742 0.817 . . . . 0.0 111.777 179.482 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.55 -30.29 71.2 Favored 'General case' 0 N--CA 1.482 1.156 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 -176.595 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.554 HH21 HD11 ' A' ' 55' ' ' ILE . 43.5 mtp180 -62.55 -39.36 93.38 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-O 121.385 0.612 . . . . 0.0 111.842 174.555 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -97.37 -8.46 29.49 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.392 -175.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -64.63 -33.32 75.67 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.257 1.023 . . . . 0.0 111.115 -177.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 64.2 p -75.15 -17.13 60.46 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.656 0.782 . . . . 0.0 111.847 177.079 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.429 ' HG3' HG21 ' A' ' 55' ' ' ILE . 25.2 mmt180 -104.03 160.17 15.06 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.092 0.957 . . . . 0.0 111.091 -170.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -77.01 101.41 6.01 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.137 0.575 . . . . 0.0 110.145 174.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 80.9 t -111.9 138.7 39.65 Favored 'Isoleucine or valine' 0 C--O 1.238 0.493 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.395 -179.405 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -98.98 89.46 4.29 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 172.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -82.3 128.09 33.87 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.221 -176.363 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.528 HD12 ' HB3' ' A' ' 87' ' ' ASP . 47.2 pt -133.13 -171.78 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 C-N-CA 124.674 1.19 . . . . 0.0 108.953 178.773 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.421 ' HA ' ' O ' ' A' ' 65' ' ' VAL . 18.0 p -86.55 151.43 23.48 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 122.638 0.375 . . . . 0.0 110.262 168.554 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.704 HD13 ' SG ' ' A' ' 11' ' ' CYS . 6.4 tt -63.59 -30.76 71.83 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.59 178.617 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.456 ' HG2' ' HE2' ' A' ' 90' ' ' LYS . 9.4 tt0 -63.44 -41.61 98.67 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.49 175.531 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.528 ' HB3' HD12 ' A' ' 83' ' ' ILE . 8.8 t70 -61.53 -31.43 71.45 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.713 0.805 . . . . 0.0 111.097 -178.874 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.2 -45.43 88.34 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.262 0.625 . . . . 0.0 111.259 175.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 74.1 mt -67.05 -43.09 89.12 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.959 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.936 -176.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.456 ' HE2' ' HG2' ' A' ' 86' ' ' GLN . 0.2 OUTLIER -86.55 -38.25 17.36 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -174.981 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -119.62 30.89 6.83 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 122.943 0.497 . . . . 0.0 110.856 -166.277 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . 0.606 ' HB3' ' HB1' ' A' ' 24' ' ' ALA . . . -45.68 -61.22 1.8 Allowed 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 123.817 0.847 . . . . 0.0 113.015 -176.352 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -58.03 -46.36 85.45 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.464 175.199 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . 0.441 ' O ' ' HG2' ' A' ' 98' ' ' GLU . . . -54.97 -45.27 81.83 Favored Glycine 0 C--N 1.356 1.639 0 O-C-N 124.662 1.226 . . . . 0.0 113.931 -174.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 14.1 mt -62.61 -57.42 12.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 123.813 0.845 . . . . 0.0 109.378 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 96.5 mt -59.95 -44.85 95.43 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 CA-C-N 114.031 -1.44 . . . . 0.0 111.415 -172.759 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.69 -31.56 71.61 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.058 0.543 . . . . 0.0 111.936 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.441 ' HG2' ' O ' ' A' ' 94' ' ' GLY . 51.4 mm-40 -63.85 -36.78 85.03 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 123.471 0.482 . . . . 0.0 110.2 176.138 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 16.0 mt -81.07 -32.39 12.42 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 -178.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -57.63 -50.89 71.65 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.448 1.099 . . . . 0.0 111.151 173.466 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -72.71 -35.09 67.52 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 123.647 0.592 . . . . 0.0 111.028 -176.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 64.4 mtm -63.47 -46.0 88.2 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 122.544 0.338 . . . . 0.0 110.43 177.549 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.44 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 19.7 mt -67.17 -40.85 86.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 O-C-N 123.631 0.582 . . . . 0.0 110.199 177.048 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.91 -24.72 67.61 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 122.933 0.493 . . . . 0.0 111.785 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 22.3 t -91.11 -33.43 15.46 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.087 0.555 . . . . 0.0 110.784 -176.111 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . 0.44 ' HG2' ' HA ' ' A' ' 103' ' ' ILE . 13.2 pt-20 -81.42 -28.78 34.11 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 122.775 0.43 . . . . 0.0 110.876 -179.489 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 87.0 mm-40 -79.76 -36.46 37.17 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.031 0.533 . . . . 0.0 110.157 175.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 65.7 mm-40 . . . . . 0 CA--C 1.552 1.045 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 178.42 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.252 1.209 0 CA-C-O 121.424 0.63 . . . . 0.0 110.423 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.548 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.1 tmtp? -145.51 137.29 25.34 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 -178.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.408 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.4 tt -122.88 135.2 54.43 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.651 1.18 . . . . 0.0 108.064 175.139 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.484 HG23 ' HB3' ' A' ' 54' ' ' ASP . 18.9 pt -125.92 160.96 32.08 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 170.283 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.566 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -149.68 164.47 35.13 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.934 176.681 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.5 tt -138.0 110.35 7.42 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 107.439 -1.319 . . . . 0.0 107.439 -177.335 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.516 ' HA ' ' O ' ' A' ' 64' ' ' SER . 60.2 m -99.18 107.5 19.86 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.065 0.946 . . . . 0.0 109.568 176.227 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -121.78 124.43 44.18 Favored 'General case' 0 N--CA 1.492 1.657 0 C-N-CA 122.566 0.346 . . . . 0.0 111.455 -177.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.777 ' SG ' HD12 ' A' ' 85' ' ' LEU . 36.9 m -127.76 146.27 58.17 Favored Pre-proline 0 N--CA 1.48 1.033 0 C-N-CA 123.847 0.859 . . . . 0.0 111.172 177.222 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -86.92 -13.78 4.49 Favored 'Trans proline' 0 C--N 1.369 1.629 0 C-N-CA 122.971 2.447 . . . . 0.0 111.984 168.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 23.0 mmt -79.54 -58.41 3.21 Favored 'General case' 0 C--N 1.355 0.813 0 C-N-CA 124.11 0.964 . . . . 0.0 110.298 -175.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -179.12 162.35 29.17 Favored Glycine 0 C--N 1.347 1.194 0 CA-C-N 115.564 -0.744 . . . . 0.0 112.77 -178.228 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 37.2 mt -70.81 -18.35 62.74 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.81 0.844 . . . . 0.0 111.714 178.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.42 -43.89 79.83 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-O 121.036 0.446 . . . . 0.0 110.903 174.375 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.469 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 3.9 t-160 -67.87 -41.7 82.45 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.234 -178.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.406 ' HA ' HD11 ' A' ' 85' ' ' LEU . 42.7 p -67.1 -36.33 81.72 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.429 -177.854 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.3 m-30 -72.45 -35.02 68.17 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.091 0.556 . . . . 0.0 111.394 -177.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' MET . . . . . 0.457 ' HE1' ' HA ' ' A' ' 17' ' ' HIS . 60.3 mtm -67.96 -35.82 79.03 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-O 120.592 0.234 . . . . 0.0 110.601 176.265 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -69.82 -41.56 74.82 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.386 0.674 . . . . 0.0 111.198 173.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.35 -39.76 89.38 Favored 'General case' 0 C--O 1.218 -0.571 0 C-N-CA 123.81 0.844 . . . . 0.0 110.899 -177.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.3 tp60 -70.55 -41.49 72.41 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 123.624 0.578 . . . . 0.0 109.903 -179.369 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.481 ' HB1' ' HB3' ' A' ' 92' ' ' ALA . . . -62.89 -52.24 63.84 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.434 -178.919 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 82.9 mt -65.1 -33.42 75.98 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.319 0.647 . . . . 0.0 111.501 178.283 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.449 ' O ' HG23 ' A' ' 30' ' ' VAL . 40.1 tt0 -60.42 -58.39 8.72 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 123.973 0.796 . . . . 0.0 110.587 179.55 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.518 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 29.8 mm-40 -53.65 -48.38 69.45 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 124.387 1.055 . . . . 0.0 111.119 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -57.68 -46.6 84.06 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 124.043 0.839 . . . . 0.0 111.789 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.56 -28.56 67.06 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 123.721 0.808 . . . . 0.0 113.08 178.051 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 26' ' ' GLU . 42.9 t -70.2 -40.15 77.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.83 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.518 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 8.0 mm-40 -70.85 -24.59 62.55 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 114.635 -1.166 . . . . 0.0 111.297 178.816 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -77.77 -7.33 56.41 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.36 0.664 . . . . 0.0 111.964 177.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 83.69 24.69 49.0 Favored Glycine 0 C--N 1.351 1.389 0 N-CA-C 114.668 0.627 . . . . 0.0 114.668 165.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -128.96 178.76 6.16 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-N 117.328 0.564 . . . . 0.0 111.311 173.107 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.548 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 41.2 tt0 -78.5 140.36 38.59 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.325 178.746 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.408 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 13.9 p -120.33 143.63 31.61 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 122.88 0.472 . . . . 0.0 110.204 178.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 49.3 tptt -149.3 115.86 5.87 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 173.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.566 HG12 ' HB3' ' A' ' 7' ' ' ALA . 51.0 mt -121.03 114.57 43.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -176.832 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -75.71 143.22 42.21 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.089 0.956 . . . . 0.0 109.167 171.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.472 HG21 ' HB2' ' A' ' 9' ' ' CYS . 1.9 p -127.93 103.54 7.31 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.087 0.555 . . . . 0.0 110.2 -179.132 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -94.56 137.56 33.53 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 122.852 0.461 . . . . 0.0 110.373 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -156.2 169.13 33.69 Favored Glycine 0 C--N 1.337 0.592 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.467 176.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.03 -29.36 69.67 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.545 0.738 . . . . 0.0 111.614 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -71.91 -39.35 69.58 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.036 0.935 . . . . 0.0 110.535 177.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 161.28 -177.55 37.57 Favored Glycine 0 C--N 1.345 1.066 0 CA-C-N 115.949 -0.569 . . . . 0.0 112.643 -178.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 73.6 mt -111.52 122.44 65.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 123.783 0.833 . . . . 0.0 110.08 179.175 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.45 ' HB3' ' OG1' ' A' ' 40' ' ' THR . 6.5 tp-100 -105.47 147.01 28.77 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.476 1.11 . . . . 0.0 110.688 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 17.8 t30 79.06 -51.92 0.44 Allowed 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 126.734 2.014 . . . . 0.0 111.582 172.455 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 21.6 tpp180 63.57 121.63 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.686 1.594 . . . . 0.0 113.549 173.088 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 45.1 mt -82.25 127.96 33.71 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.458 172.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.4 ' O ' HG13 ' A' ' 55' ' ' ILE . 43.8 p -90.2 160.74 16.06 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.039 176.475 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.24 -27.03 66.88 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 122.848 0.459 . . . . 0.0 111.481 177.088 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -69.29 -40.15 77.89 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.73 0.812 . . . . 0.0 111.113 175.16 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.484 ' HB3' HG23 ' A' ' 6' ' ' ILE . 53.7 m-20 -58.32 -47.75 82.72 Favored 'General case' 0 N--CA 1.483 1.212 0 O-C-N 123.35 0.406 . . . . 0.0 110.249 174.421 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.507 HG22 ' HG3' ' A' ' 78' ' ' ARG . 24.8 mt -68.47 -29.64 44.76 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.069 0 O-C-N 124.618 1.199 . . . . 0.0 111.024 -177.684 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.41 ' HA ' HH21 ' A' ' 78' ' ' ARG . . . -71.68 -49.05 43.2 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.68 0.792 . . . . 0.0 111.552 179.458 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -84.82 -12.54 53.37 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.421 0.688 . . . . 0.0 112.157 -175.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.9 99.0 0.11 Allowed 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.546 0.739 . . . . 0.0 111.834 -178.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 25.2 m -61.59 -34.86 76.35 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 124.268 1.027 . . . . 0.0 109.797 170.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.503 HG21 HG21 ' A' ' 99' ' ' ILE . 81.5 mt -130.45 138.14 54.51 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 C-N-CA 124.416 1.087 . . . . 0.0 109.61 179.55 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.8 mt -133.06 132.27 58.81 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.358 0 C-N-CA 123.721 0.809 . . . . 0.0 108.821 174.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -121.14 117.01 51.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 174.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 9.9 m170 -90.84 84.52 5.83 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-N 118.879 0.763 . . . . 0.0 108.972 170.01 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.516 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 20.7 p -83.22 81.83 8.53 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 114.674 -1.148 . . . . 0.0 108.763 176.905 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 34.8 m -128.57 158.31 40.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 CA-C-O 121.699 0.762 . . . . 0.0 111.957 -168.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -111.71 -11.9 13.93 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.013 1.325 . . . . 0.0 109.363 172.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 11.5 m -135.47 151.73 30.59 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 125.397 1.479 . . . . 0.0 108.909 178.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 25.6 m -65.3 110.79 4.77 Favored Pre-proline 0 CA--C 1.55 0.976 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 173.087 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.404 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 28.1 Cg_endo -62.66 153.3 72.91 Favored 'Trans proline' 0 C--N 1.379 2.137 0 C-N-CA 122.342 2.028 . . . . 0.0 112.912 -174.005 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -76.58 -25.4 53.93 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.444 0.698 . . . . 0.0 111.001 -177.236 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -96.02 10.43 37.48 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.813 0.845 . . . . 0.0 111.252 179.127 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.404 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 0.3 OUTLIER -58.5 -32.95 69.29 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 124.074 0.95 . . . . 0.0 111.354 -174.984 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.407 ' HA ' ' HB2' ' A' ' 76' ' ' GLU . 0.4 OUTLIER -65.66 -24.87 67.12 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.154 0.581 . . . . 0.0 112.359 178.777 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 77.3 mtt180 -70.5 -23.37 62.65 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.254 0.622 . . . . 0.0 111.646 173.194 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.403 ' HB3' HG23 ' A' ' 80' ' ' VAL . 56.8 m-85 -105.37 2.43 28.77 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.148 0.979 . . . . 0.0 111.301 -179.501 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.407 ' HB2' ' HA ' ' A' ' 73' ' ' GLU . 29.2 tt0 -61.61 -50.39 72.77 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.876 0.87 . . . . 0.0 111.909 -172.446 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 69.7 p -82.71 0.26 44.22 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.054 0.541 . . . . 0.0 111.841 -178.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.507 ' HG3' HG22 ' A' ' 55' ' ' ILE . 15.8 mmt180 -102.4 149.32 24.48 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.634 0.774 . . . . 0.0 110.71 176.343 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -79.37 92.28 5.17 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.712 0.805 . . . . 0.0 110.624 -178.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.403 HG23 ' HB3' ' A' ' 75' ' ' PHE . 45.1 t -98.49 144.79 10.98 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.788 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.096 -179.728 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 -102.45 92.2 4.58 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.82 1.248 . . . . 0.0 107.858 174.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -83.16 121.62 27.31 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.579 0.752 . . . . 0.0 110.708 -175.306 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.481 HG13 ' HA ' ' A' ' 64' ' ' SER . 43.9 pt -130.55 -177.59 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 124.675 1.19 . . . . 0.0 109.25 177.391 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 18.5 p -83.79 149.28 26.53 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 167.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.777 HD12 ' SG ' ' A' ' 11' ' ' CYS . 7.7 tt -63.09 -29.22 70.63 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.358 0.663 . . . . 0.0 111.816 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.541 ' HG2' ' HE3' ' A' ' 90' ' ' LYS . 29.4 tt0 -60.22 -41.78 93.79 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.445 0.698 . . . . 0.0 110.755 175.072 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.446 ' HB3' HD12 ' A' ' 83' ' ' ILE . 24.1 t70 -63.18 -32.46 73.86 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.674 0.79 . . . . 0.0 110.728 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.74 -29.9 71.06 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.749 0.82 . . . . 0.0 112.697 179.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 65.8 mt -83.54 -54.0 10.08 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 C-N-CA 123.603 0.761 . . . . 0.0 110.062 -178.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.541 ' HE3' ' HG2' ' A' ' 86' ' ' GLN . 18.5 ptpt -72.8 -45.4 58.68 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.117 0.567 . . . . 0.0 112.33 -175.256 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -108.61 24.07 13.6 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.185 0.994 . . . . 0.0 110.594 -169.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . 0.481 ' HB3' ' HB1' ' A' ' 24' ' ' ALA . . . -41.73 -62.2 0.94 Allowed 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.286 1.034 . . . . 0.0 113.672 -175.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.35 -36.29 83.2 Favored 'General case' 0 C--N 1.34 0.179 0 CA-C-N 114.922 -1.036 . . . . 0.0 110.806 179.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -61.07 -48.06 88.0 Favored Glycine 0 C--N 1.354 1.546 0 O-C-N 124.703 1.252 . . . . 0.0 112.526 -178.3 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 35.9 mt -56.99 -57.89 8.03 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 C-N-CA 124.597 1.159 . . . . 0.0 110.31 -179.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.9 mp -56.31 -51.65 61.15 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.912 0 O-C-N 124.257 0.973 . . . . 0.0 111.296 -177.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.31 -31.16 72.15 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 -176.758 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -67.19 -36.96 82.84 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 122.877 0.471 . . . . 0.0 110.217 177.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . 0.503 HG21 HG21 ' A' ' 60' ' ' ILE . 56.4 mt -76.47 -37.49 30.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -177.847 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -57.55 -52.66 64.51 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 114.191 -1.368 . . . . 0.0 111.257 176.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -69.96 -33.51 72.19 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 123.632 0.582 . . . . 0.0 111.534 -177.794 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 67.7 mtm -65.0 -56.9 10.44 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 122.386 0.274 . . . . 0.0 110.817 178.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 48.2 mt -64.35 -39.72 86.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 O-C-N 123.677 0.61 . . . . 0.0 111.037 -179.231 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.429 ' HA ' ' HG2' ' A' ' 107' ' ' GLN . . . -67.55 -37.4 82.64 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.659 0.384 . . . . 0.0 111.433 179.729 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 33.9 t -68.48 -39.1 81.49 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 122.351 0.26 . . . . 0.0 110.848 -175.365 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -79.98 -29.67 39.57 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 116.106 -0.497 . . . . 0.0 112.173 -178.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.429 ' HG2' ' HA ' ' A' ' 104' ' ' ALA . 3.0 pt20 -85.08 -28.78 25.39 Favored 'General case' 0 N--CA 1.487 1.418 0 CA-C-N 117.991 0.359 . . . . 0.0 111.203 -178.78 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 . . . . . 0 C--O 1.249 1.034 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 179.037 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.8 pttm . . . . . 0 C--O 1.242 0.693 0 CA-C-O 121.189 0.519 . . . . 0.0 110.617 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.599 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.4 tmtp? -144.37 140.24 28.94 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 -169.736 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.516 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.9 tt -132.26 136.68 47.13 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 178.431 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.499 HD12 HD12 ' A' ' 50' ' ' LEU . 15.8 pt -128.15 161.14 37.1 Favored 'Isoleucine or valine' 0 C--O 1.244 0.769 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 173.715 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.542 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -147.21 168.16 22.39 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.99 177.854 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.0 tt -142.07 113.62 7.8 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 -178.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.51 ' HA ' ' O ' ' A' ' 64' ' ' SER . 56.0 m -103.28 111.42 23.81 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.696 0.798 . . . . 0.0 108.851 177.16 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.452 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -123.31 127.29 48.33 Favored 'General case' 0 N--CA 1.497 1.919 0 C-N-CA 122.521 0.328 . . . . 0.0 111.44 -177.663 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.756 ' SG ' HD11 ' A' ' 85' ' ' LEU . 56.0 m -130.79 145.45 57.74 Favored Pre-proline 0 N--CA 1.481 1.087 0 C-N-CA 123.866 0.866 . . . . 0.0 111.768 -178.915 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -79.37 -28.16 3.82 Favored 'Trans proline' 0 C--N 1.375 1.929 0 C-N-CA 122.866 2.377 . . . . 0.0 111.466 167.513 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 12.2 tpt -69.74 -50.77 40.27 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.012 0.925 . . . . 0.0 110.744 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 155.68 -176.79 33.11 Favored Glycine 0 C--N 1.345 1.053 0 N-CA-C 114.178 0.431 . . . . 0.0 114.178 175.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 71.0 mt -73.62 -20.18 60.66 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.974 0.909 . . . . 0.0 113.393 -172.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.82 -42.66 89.74 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-N 118.574 0.625 . . . . 0.0 110.619 176.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.485 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 7.2 t-160 -67.1 -43.27 82.93 Favored 'General case' 0 C--O 1.246 0.919 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.866 178.28 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 34.7 p -65.8 -31.26 72.13 Favored 'General case' 0 C--N 1.353 0.76 0 CA-C-N 115.509 -0.769 . . . . 0.0 111.558 -177.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -74.15 -33.42 63.5 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 119.028 -0.51 . . . . 0.0 111.192 -178.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 64.6 mtm -65.05 -35.82 82.37 Favored 'General case' 0 N--CA 1.492 1.66 0 CA-C-O 120.961 0.41 . . . . 0.0 110.87 173.275 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.48 -48.67 54.66 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.999 177.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.68 -36.13 82.82 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 124.32 1.048 . . . . 0.0 110.946 -177.301 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.4 ' O ' ' HG3' ' A' ' 27' ' ' GLU . 11.4 pt20 -71.04 -41.11 71.24 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 -176.533 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -72.97 -38.95 66.5 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.919 -178.166 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 76.5 mt -71.68 -33.41 68.81 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.079 0.552 . . . . 0.0 110.784 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.423 ' O ' HG21 ' A' ' 30' ' ' VAL . 37.4 tt0 -61.29 -55.86 27.11 Favored 'General case' 0 C--N 1.35 0.599 0 O-C-N 124.019 0.824 . . . . 0.0 109.209 177.721 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.419 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 44.8 mt-10 -56.22 -48.25 76.82 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 124.36 1.037 . . . . 0.0 110.717 -178.414 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.47 -47.46 79.15 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.119 0.968 . . . . 0.0 111.548 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.03 -22.18 62.18 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.186 0.994 . . . . 0.0 113.537 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.423 HG21 ' O ' ' A' ' 26' ' ' GLU . 37.6 t -79.93 -41.55 21.55 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 -179.425 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 6.9 mm-40 -72.21 -21.72 61.37 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 114.465 -1.243 . . . . 0.0 110.102 175.422 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.61 -31.25 59.83 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 114.726 -1.125 . . . . 0.0 111.436 173.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 98.77 22.79 12.93 Favored Glycine 0 C--N 1.344 1.019 0 CA-C-N 115.833 -0.621 . . . . 0.0 114.095 171.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -99.75 163.51 12.44 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 171.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.599 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 35.1 tt0 -74.33 130.42 39.65 Favored 'General case' 0 C--O 1.217 -0.646 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 159.636 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.516 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 9.3 p -119.28 134.46 62.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 CA-C-N 119.133 0.879 . . . . 0.0 110.9 -173.648 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 45.2 tptt -141.0 120.45 13.16 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.542 HG12 ' HB3' ' A' ' 7' ' ' ALA . 43.1 mt -122.28 122.94 67.64 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 C-N-CA 122.712 0.405 . . . . 0.0 112.08 -175.325 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 76.9 tt0 -88.53 116.0 26.46 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.493 1.117 . . . . 0.0 109.904 175.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.625 ' HG1' ' HB3' ' A' ' 47' ' ' GLN . 24.3 p -100.85 104.96 16.2 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 122.521 0.328 . . . . 0.0 110.366 177.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.452 ' O ' ' HA ' ' A' ' 10' ' ' ALA . 13.9 mt-30 -96.66 144.0 27.1 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.237 0.615 . . . . 0.0 109.45 175.802 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -167.98 177.47 42.19 Favored Glycine 0 C--N 1.335 0.49 0 C-N-CA 121.716 -0.278 . . . . 0.0 112.568 179.419 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.79 -29.27 69.34 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.535 0.734 . . . . 0.0 111.958 179.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -67.53 -42.32 82.93 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.407 0.683 . . . . 0.0 110.205 174.037 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 153.77 -173.01 32.51 Favored Glycine 0 C--N 1.341 0.811 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.93 -176.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 72.6 mt -101.59 135.57 37.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 176.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.625 ' HB3' ' HG1' ' A' ' 40' ' ' THR . 9.1 tp-100 -132.16 144.78 50.91 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.386 0.674 . . . . 0.0 110.383 -172.786 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 42.2 t30 74.39 -64.87 0.37 Allowed 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 126.43 1.892 . . . . 0.0 108.855 -177.618 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 22.6 ttt-85 63.73 129.19 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 127.048 2.139 . . . . 0.0 113.947 172.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.499 HD12 HD12 ' A' ' 6' ' ' ILE . 26.9 mt -77.76 148.63 34.74 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 113.837 -1.529 . . . . 0.0 110.272 175.884 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 58.5 p -113.72 170.14 8.47 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.505 176.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -57.19 -33.41 67.46 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.382 0.673 . . . . 0.0 111.222 -179.211 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.402 ' O ' ' HG3' ' A' ' 57' ' ' GLU . 16.6 tt0 -61.17 -54.95 37.95 Favored 'General case' 0 C--N 1.35 0.608 0 O-C-N 124.256 0.972 . . . . 0.0 109.667 175.31 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 53.1 m-20 -54.56 -41.82 70.26 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 123.966 0.906 . . . . 0.0 112.239 -176.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.642 HD11 HH21 ' A' ' 74' ' ' ARG . 40.4 mt -71.11 -33.47 51.39 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 O-C-N 123.874 0.734 . . . . 0.0 110.604 -176.39 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.23 -39.63 65.34 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.475 0.71 . . . . 0.0 111.299 176.203 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.402 ' HG3' ' O ' ' A' ' 53' ' ' GLN . 52.6 mt-10 -69.25 -32.28 71.37 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.881 0.872 . . . . 0.0 110.95 179.425 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -56.57 101.88 0.07 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.884 1.274 . . . . 0.0 113.216 -172.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 27.4 m -61.11 -39.59 90.55 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.759 0.824 . . . . 0.0 109.12 165.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.49 HG21 HG21 ' A' ' 99' ' ' ILE . 53.0 mt -127.22 144.37 37.51 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 C-N-CA 123.746 0.818 . . . . 0.0 110.581 179.149 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 28.1 mt -134.42 120.28 32.75 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 C-N-CA 124.014 0.926 . . . . 0.0 108.839 172.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.6 mp -109.46 119.77 59.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 175.167 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . 0.424 ' HB2' ' HG3' ' A' ' 82' ' ' GLU . 12.6 m170 -92.44 83.92 5.05 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-O 121.747 0.784 . . . . 0.0 108.944 168.61 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.51 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 24.8 p -80.45 83.58 6.24 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 114.236 -1.347 . . . . 0.0 109.072 175.551 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 33.7 m -128.29 156.58 40.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 CA-C-O 121.872 0.844 . . . . 0.0 112.29 -169.126 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -109.3 -21.44 12.54 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 113.633 -1.622 . . . . 0.0 109.002 173.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 6.2 m -137.13 148.48 26.29 Favored 'Isoleucine or valine' 0 C--N 1.35 0.613 0 C-N-CA 125.519 1.528 . . . . 0.0 108.015 175.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 67.6 m -59.27 116.18 15.1 Favored Pre-proline 0 CA--C 1.548 0.899 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 176.075 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.402 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 39.9 Cg_endo -64.29 151.46 85.32 Favored 'Trans proline' 0 C--N 1.381 2.241 0 C-N-CA 122.86 2.373 . . . . 0.0 111.475 -176.514 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -64.62 -36.72 85.15 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-O 121.619 0.723 . . . . 0.0 110.408 -178.34 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.51 ' HB3' ' HD3' ' A' ' 74' ' ' ARG . 2.2 m-20 -91.49 13.21 18.33 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.486 1.115 . . . . 0.0 111.919 -173.764 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.402 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 4.8 p30 -56.15 -30.3 61.98 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 124.372 1.069 . . . . 0.0 112.154 -177.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -61.08 -33.61 73.62 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.67 1.188 . . . . 0.0 112.457 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.642 HH21 HD11 ' A' ' 55' ' ' ILE . 27.3 mtp180 -65.11 -29.34 70.2 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.436 1.094 . . . . 0.0 112.007 177.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -100.24 -11.74 20.12 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 114.913 -1.04 . . . . 0.0 111.84 -175.213 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -56.86 -35.27 68.68 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.373 1.069 . . . . 0.0 111.92 -177.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 34.7 t -73.53 -19.01 61.02 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.852 0.861 . . . . 0.0 112.507 -178.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.564 ' HG3' HG22 ' A' ' 55' ' ' ILE . 32.3 mmt180 -111.44 173.59 6.27 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.531 0.733 . . . . 0.0 111.781 -171.209 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -84.33 97.68 9.59 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.758 0.823 . . . . 0.0 110.387 -177.289 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 39.3 t -105.87 153.14 7.39 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 CA-C-N 114.966 -1.016 . . . . 0.0 110.255 -179.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 -124.36 91.39 3.44 Favored 'General case' 0 C--O 1.243 0.72 0 C-N-CA 124.815 1.246 . . . . 0.0 107.895 179.197 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.424 ' HG3' ' HB2' ' A' ' 63' ' ' HIS . 2.2 mp0 -77.08 126.86 31.65 Favored 'General case' 0 C--N 1.353 0.746 0 C-N-CA 122.916 0.486 . . . . 0.0 110.714 -177.613 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.429 HG13 ' HA ' ' A' ' 64' ' ' SER . 43.4 pt -136.46 -178.58 2.43 Favored 'Isoleucine or valine' 0 C--O 1.246 0.911 0 C-N-CA 125.327 1.451 . . . . 0.0 108.317 177.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 23.5 p -83.39 147.44 27.89 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.102 0.477 . . . . 0.0 109.825 169.118 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.756 HD11 ' SG ' ' A' ' 11' ' ' CYS . 8.1 tt -65.85 -28.29 68.86 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.929 179.404 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.424 ' O ' ' HG2' ' A' ' 90' ' ' LYS . 28.6 tt0 -62.6 -44.96 95.01 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.555 0.742 . . . . 0.0 110.428 174.107 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -60.82 -30.95 70.4 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.758 0.823 . . . . 0.0 110.609 179.253 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.7 -21.57 63.48 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.956 0.902 . . . . 0.0 113.318 178.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 65.5 mt -89.27 -41.82 14.1 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 C-N-CA 123.622 0.769 . . . . 0.0 110.36 -179.163 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.424 ' HG2' ' O ' ' A' ' 86' ' ' GLN . 16.2 ptpt -92.68 -47.44 7.09 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.016 0.526 . . . . 0.0 112.172 -174.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -99.48 18.55 17.58 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 123.746 0.818 . . . . 0.0 111.477 -173.296 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . 0.461 ' HA ' HD11 ' A' ' 95' ' ' ILE . . . -45.66 -57.98 3.8 Favored 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 124.158 0.983 . . . . 0.0 113.527 -171.522 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.48 -38.77 81.68 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.39 0.676 . . . . 0.0 111.014 179.041 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -61.77 -46.48 94.09 Favored Glycine 0 C--N 1.352 1.454 0 O-C-N 124.462 1.101 . . . . 0.0 112.696 -179.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.461 HD11 ' HA ' ' A' ' 92' ' ' ALA . 16.8 mt -57.72 -57.95 8.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 124.137 0.975 . . . . 0.0 110.22 -179.752 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.468 ' O ' ' HG3' ' A' ' 100' ' ' GLU . 2.2 mp -57.52 -51.98 62.9 Favored 'Isoleucine or valine' 0 C--N 1.357 0.926 0 O-C-N 124.131 0.894 . . . . 0.0 110.647 -176.51 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -32.14 71.98 Favored 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -175.412 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -65.01 -37.52 87.93 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 123.806 0.691 . . . . 0.0 110.137 176.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . 0.49 HG21 HG21 ' A' ' 60' ' ' ILE . 25.8 mt -79.93 -31.94 13.79 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.834 -178.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.468 ' HG3' ' O ' ' A' ' 96' ' ' ILE . 36.2 mt-10 -59.71 -50.59 73.26 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.396 0.678 . . . . 0.0 110.621 177.319 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -68.99 -36.99 78.47 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 123.835 0.71 . . . . 0.0 111.083 -177.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 71.4 mtm -60.43 -54.04 50.34 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 122.421 0.289 . . . . 0.0 110.323 176.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.47 HD12 HG12 ' A' ' 60' ' ' ILE . 39.7 mt -67.3 -35.71 74.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 123.288 0.635 . . . . 0.0 111.523 -178.358 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.73 -36.72 83.12 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.041 0.537 . . . . 0.0 110.47 178.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 70.0 m -79.49 -27.08 41.5 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 122.918 0.487 . . . . 0.0 111.383 -174.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -85.79 -33.44 21.38 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 122.377 0.271 . . . . 0.0 111.639 177.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.462 ' HG3' HE21 ' A' ' 108' ' ' GLN . 4.4 pt20 -80.47 -30.16 37.44 Favored 'General case' 0 N--CA 1.487 1.416 0 CA-C-N 118.086 0.403 . . . . 0.0 111.186 -179.273 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.462 HE21 ' HG3' ' A' ' 107' ' ' GLN . 23.5 mm-40 . . . . . 0 C--O 1.248 1.015 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 175.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.407 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 3.3 pttt . . . . . 0 C--O 1.251 1.139 0 CA-C-O 121.376 0.608 . . . . 0.0 110.348 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.547 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.2 tmtp? -143.69 140.38 30.01 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.615 -0.721 . . . . 0.0 109.163 -175.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.482 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 8.8 tt -126.25 137.19 53.5 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 176.718 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.429 HD11 HD11 ' A' ' 50' ' ' LEU . 16.4 pt -128.88 161.75 37.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 172.447 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.565 ' HB2' HG12 ' A' ' 38' ' ' ILE . . . -147.63 168.06 22.99 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.111 0.481 . . . . 0.0 109.86 176.427 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.6 tt -138.65 114.34 9.86 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.508 ' HA ' ' O ' ' A' ' 64' ' ' SER . 80.5 m -106.4 107.65 18.77 Favored 'General case' 0 C--O 1.218 -0.583 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 177.957 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.424 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -125.97 122.95 37.39 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.025 0.53 . . . . 0.0 110.939 -177.346 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.794 ' SG ' HD11 ' A' ' 85' ' ' LEU . 2.9 m -140.42 146.78 46.8 Favored Pre-proline 0 N--CA 1.477 0.901 0 C-N-CA 123.682 0.793 . . . . 0.0 111.113 178.194 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -85.49 0.78 8.5 Favored 'Trans proline' 0 C--N 1.377 2.069 0 C-N-CA 123.596 2.864 . . . . 0.0 112.19 -179.469 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.411 ' HE1' ' HA ' ' A' ' 13' ' ' MET . 27.0 mmt -88.38 -26.01 22.41 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.24 1.016 . . . . 0.0 110.644 179.819 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 135.93 177.04 14.69 Favored Glycine 0 C--N 1.344 0.992 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.809 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 47.0 mt -75.53 -13.88 60.38 Favored 'General case' 0 C--N 1.352 0.678 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -179.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.23 -46.49 89.57 Favored 'General case' 0 C--O 1.249 1.053 0 CA-C-O 121.168 0.509 . . . . 0.0 110.877 177.2 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.462 ' HA ' ' HE2' ' A' ' 20' ' ' MET . 12.3 t-160 -65.38 -43.53 90.45 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.742 179.591 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 31.2 p -65.71 -36.0 82.36 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.471 -176.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.0 m-30 -70.41 -32.56 70.23 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.381 0.672 . . . . 0.0 111.342 -179.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' MET . . . . . 0.462 ' HE2' ' HA ' ' A' ' 17' ' ' HIS . 65.2 mtm -67.15 -37.96 84.69 Favored 'General case' 0 N--CA 1.484 1.275 0 CA-C-O 120.888 0.375 . . . . 0.0 110.762 175.333 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.38 -39.32 81.77 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.989 173.58 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.06 -40.57 91.02 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.668 0.787 . . . . 0.0 110.662 -178.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -61.4 -51.36 69.06 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.604 0.762 . . . . 0.0 109.616 177.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.52 -48.44 75.09 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 114.765 -1.107 . . . . 0.0 112.502 -174.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 91.4 mt -66.12 -33.0 74.79 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.421 0.689 . . . . 0.0 111.69 179.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.468 ' HA ' HG21 ' A' ' 36' ' ' VAL . 32.4 tt0 -64.03 -52.21 60.52 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 123.584 0.552 . . . . 0.0 110.02 178.816 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -54.42 -48.63 71.42 Favored 'General case' 0 N--CA 1.481 1.079 0 O-C-N 124.213 0.945 . . . . 0.0 110.572 179.322 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.407 ' HB1' ' HA ' ' A' ' 93' ' ' ALA . . . -59.9 -47.37 86.03 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.603 1.161 . . . . 0.0 111.955 -178.035 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.42 -28.29 67.78 Favored 'General case' 0 N--CA 1.476 0.866 0 CA-C-N 115.068 -0.969 . . . . 0.0 112.842 178.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.409 HG22 ' O ' ' A' ' 26' ' ' GLU . 41.1 t -72.0 -38.11 62.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 178.296 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -67.88 -25.21 65.4 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.578 1.151 . . . . 0.0 111.317 176.394 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -80.88 -9.39 59.83 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 123.847 0.859 . . . . 0.0 112.075 177.298 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.62 2.81 67.09 Favored Glycine 0 C--N 1.347 1.167 0 N-CA-C 115.442 0.937 . . . . 0.0 115.442 166.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.407 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.1 OUTLIER -113.92 178.66 4.2 Favored 'General case' 0 N--CA 1.49 1.527 0 CA-C-N 117.746 0.773 . . . . 0.0 111.751 179.849 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.547 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 38.9 tt0 -76.47 153.73 35.33 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 123.926 0.766 . . . . 0.0 109.366 178.154 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.482 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 7.2 p -136.49 138.83 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 123.073 0.549 . . . . 0.0 110.284 178.493 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 43.7 tptt -146.8 122.1 10.25 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 175.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.565 HG12 ' HB2' ' A' ' 7' ' ' ALA . 45.7 mt -122.69 113.0 36.46 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 123.098 0.559 . . . . 0.0 111.788 -173.433 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 68.8 tt0 -81.25 107.46 14.06 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.669 0.788 . . . . 0.0 109.667 174.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.437 HG22 ' HB2' ' A' ' 9' ' ' CYS . 22.3 p -88.72 109.31 20.04 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.233 0.613 . . . . 0.0 110.15 175.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.428 HE22 ' HB2' ' A' ' 70' ' ' GLU . 42.0 mt-30 -103.6 155.42 18.56 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.685 0.755 . . . . 0.0 111.542 178.182 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 178.52 167.95 37.08 Favored Glycine 0 C--O 1.24 0.474 0 CA-C-N 114.529 -1.214 . . . . 0.0 110.406 172.285 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.12 -19.49 65.63 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-N 116.944 0.372 . . . . 0.0 110.2 173.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -64.63 -40.74 96.01 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 124.548 1.139 . . . . 0.0 110.856 171.178 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 162.47 -176.68 38.8 Favored Glycine 0 C--N 1.344 1.003 0 CA-C-N 115.43 -0.805 . . . . 0.0 112.176 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.514 HD11 ' NH2' ' A' ' 49' ' ' ARG . 85.0 mt -129.25 134.24 64.22 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 C-N-CA 123.972 0.909 . . . . 0.0 108.789 176.123 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 9.7 tp-100 -140.8 149.65 42.31 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.013 0.925 . . . . 0.0 110.398 -172.141 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.453 ' HB3' ' O ' ' A' ' 38' ' ' ILE . 33.8 t30 57.22 34.42 24.77 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 125.275 1.43 . . . . 0.0 110.392 177.377 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.514 ' NH2' HD11 ' A' ' 46' ' ' ILE . 20.4 ttm180 -57.39 131.51 50.31 Favored 'General case' 0 C--N 1.351 0.664 0 C-N-CA 124.695 1.198 . . . . 0.0 112.737 -171.209 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.576 ' HB2' HH22 ' A' ' 74' ' ' ARG . 27.8 mt -72.95 149.04 43.7 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 113.871 -1.513 . . . . 0.0 110.961 177.246 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.433 ' O ' HG13 ' A' ' 55' ' ' ILE . 42.7 p -103.38 174.3 5.93 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.287 173.409 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.72 -31.42 71.58 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 122.716 0.406 . . . . 0.0 110.631 173.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -66.23 -42.36 88.79 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.883 0.873 . . . . 0.0 110.686 178.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -57.19 -48.92 77.55 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.423 0.689 . . . . 0.0 111.035 175.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.653 HD13 HH21 ' A' ' 74' ' ' ARG . 23.1 mt -69.21 -36.39 72.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 O-C-N 124.143 0.902 . . . . 0.0 111.24 -175.292 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.75 -46.16 69.58 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.831 0.853 . . . . 0.0 111.451 -178.156 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -84.96 -10.73 56.75 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.248 0.619 . . . . 0.0 111.557 -178.061 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.95 106.93 1.12 Allowed 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.339 0.656 . . . . 0.0 110.761 178.165 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 13.7 m -63.35 -36.0 82.26 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.27 1.028 . . . . 0.0 109.831 169.495 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.479 HG21 HG22 ' A' ' 99' ' ' ILE . 75.8 mt -132.07 140.83 46.98 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 124.193 0.997 . . . . 0.0 110.082 -177.716 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 32.4 mt -135.96 125.43 39.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 C-N-CA 123.746 0.818 . . . . 0.0 108.964 174.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.3 mp -112.28 127.96 69.18 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 175.394 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 5.7 m170 -99.82 86.15 3.24 Favored 'General case' 0 N--CA 1.486 1.353 0 CA-C-O 121.773 0.797 . . . . 0.0 109.111 169.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.532 ' HG ' HD11 ' A' ' 83' ' ' ILE . 19.7 m -81.09 81.63 7.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 114.254 -1.339 . . . . 0.0 109.173 175.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.413 ' O ' ' HA ' ' A' ' 84' ' ' THR . 34.9 m -128.5 159.68 39.74 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.413 0 CA-C-O 121.741 0.782 . . . . 0.0 111.608 -171.208 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -110.43 -25.4 10.08 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 114.494 -1.23 . . . . 0.0 108.994 172.411 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 14.6 m -135.96 164.39 32.18 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 C-N-CA 125.523 1.529 . . . . 0.0 108.868 -178.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 96.2 m -68.53 114.1 19.89 Favored Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 122.999 0.52 . . . . 0.0 110.272 -179.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.575 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 46.1 Cg_endo -68.45 152.97 74.87 Favored 'Trans proline' 0 C--N 1.382 2.323 0 C-N-CA 122.445 2.097 . . . . 0.0 112.489 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.428 ' HB2' HE22 ' A' ' 41' ' ' GLN . 40.1 mm-40 -67.29 -29.31 68.88 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.368 0.667 . . . . 0.0 111.637 -175.581 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.493 ' HB3' ' HD3' ' A' ' 74' ' ' ARG . 2.1 m-20 -104.32 18.69 21.64 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.607 -175.251 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.575 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 41.7 t30 -57.62 -35.46 70.5 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.166 0.986 . . . . 0.0 112.341 -177.654 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.53 -31.37 72.51 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 123.385 0.674 . . . . 0.0 112.632 -179.745 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . 0.653 HH21 HD13 ' A' ' 55' ' ' ILE . 35.5 mtp180 -59.26 -33.79 71.47 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.87 0.868 . . . . 0.0 112.416 175.821 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -98.95 -16.49 18.74 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 115.083 -0.962 . . . . 0.0 111.448 -175.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -54.97 -33.43 62.44 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 124.14 0.976 . . . . 0.0 112.39 -176.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 40.4 p -78.75 -6.39 55.76 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.793 0.837 . . . . 0.0 112.909 -177.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.55 ' HG3' HG23 ' A' ' 55' ' ' ILE . 25.2 mmt180 -120.24 171.13 8.72 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.909 0.884 . . . . 0.0 111.343 -172.58 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -78.37 92.69 4.59 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.361 0.665 . . . . 0.0 110.014 -177.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 43.6 t -109.05 139.48 31.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 123.169 0.588 . . . . 0.0 110.946 -177.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -108.11 91.01 3.47 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.981 1.312 . . . . 0.0 107.92 -179.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -78.41 128.89 34.27 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.526 -177.016 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.532 HD11 ' HG ' ' A' ' 64' ' ' SER . 40.9 pt -141.87 -174.85 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 C-N-CA 125.433 1.493 . . . . 0.0 108.819 -179.408 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' THR . . . . . 0.413 ' HA ' ' O ' ' A' ' 65' ' ' VAL . 25.5 p -83.34 148.83 27.11 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.033 0.444 . . . . 0.0 109.956 167.523 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.794 HD11 ' SG ' ' A' ' 11' ' ' CYS . 7.8 tt -63.68 -29.91 71.08 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.285 177.098 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.514 ' HG2' ' HE3' ' A' ' 90' ' ' LYS . 27.6 tt0 -70.15 -36.27 74.63 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.954 178.323 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -60.64 -33.23 72.48 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.703 0.801 . . . . 0.0 110.367 173.491 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.1 -20.63 64.94 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.827 0.851 . . . . 0.0 113.274 178.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 68.4 mt -87.32 -55.26 6.69 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 123.189 0.595 . . . . 0.0 109.654 178.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.514 ' HE3' ' HG2' ' A' ' 86' ' ' GLN . 18.0 ptpt -77.78 -43.84 29.42 Favored 'General case' 0 N--CA 1.482 1.174 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.626 -173.552 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -105.51 20.46 18.86 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.032 0.933 . . . . 0.0 110.522 -173.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -44.03 -58.99 2.51 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 124.007 0.923 . . . . 0.0 113.052 -175.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.407 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . . . -60.07 -41.15 91.77 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.032 -0.986 . . . . 0.0 110.785 178.317 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -58.21 -46.02 93.34 Favored Glycine 0 C--N 1.352 1.459 0 O-C-N 124.493 1.121 . . . . 0.0 112.539 -179.189 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 26.8 mt -59.74 -57.42 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 124.516 1.127 . . . . 0.0 109.625 -178.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.8 mp -55.31 -50.97 60.87 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.99 0 O-C-N 124.302 1.002 . . . . 0.0 111.027 -177.225 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.95 -29.27 68.28 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 122.897 0.479 . . . . 0.0 112.097 -175.774 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -68.74 -33.72 74.39 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 123.493 0.496 . . . . 0.0 110.16 176.589 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . 0.479 HG22 HG21 ' A' ' 60' ' ' ILE . 66.4 mt -75.82 -41.2 39.81 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 -179.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -58.03 -45.09 87.53 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 114.194 -1.366 . . . . 0.0 111.965 177.403 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -74.45 -30.29 61.82 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 123.208 0.317 . . . . 0.0 111.232 -178.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 69.9 mtm -66.99 -49.93 63.83 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 122.368 0.267 . . . . 0.0 110.404 175.335 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 50.4 mt -62.5 -36.74 76.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 123.364 0.666 . . . . 0.0 110.233 176.182 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.52 -38.95 91.15 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.118 0.567 . . . . 0.0 110.867 176.62 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 26.5 t -68.61 -33.52 74.19 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.43 0.692 . . . . 0.0 111.312 -174.441 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -85.67 -29.3 24.1 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-N 116.096 -0.502 . . . . 0.0 112.255 179.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -86.7 -30.02 22.0 Favored 'General case' 0 N--CA 1.492 1.67 0 CA-C-N 118.333 0.515 . . . . 0.0 111.593 -174.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 . . . . . 0 N--CA 1.48 1.056 0 C-N-CA 123.422 0.689 . . . . 0.0 110.8 179.825 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.64 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 15.0 pttt . . . . . 0 N--CA 1.481 1.117 0 CA-C-O 120.964 0.411 . . . . 0.0 110.195 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.539 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.4 tmtp? -145.22 143.25 30.17 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-O 121.377 0.608 . . . . 0.0 110.501 -174.3 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.436 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 8.4 tt -131.47 138.56 49.07 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.542 1.137 . . . . 0.0 108.075 174.491 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.474 HG21 ' HB3' ' A' ' 54' ' ' ASP . 17.4 pt -129.01 163.91 32.78 Favored 'Isoleucine or valine' 0 C--O 1.24 0.588 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 170.41 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.541 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -152.39 168.47 25.35 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 120.95 0.405 . . . . 0.0 110.074 178.683 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.7 tt -141.12 120.8 13.37 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 107.513 -1.291 . . . . 0.0 107.513 -177.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.536 ' HA ' ' O ' ' A' ' 64' ' ' SER . 60.0 m -110.73 113.78 26.65 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.664 0.786 . . . . 0.0 108.913 175.285 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -125.64 112.61 16.35 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 122.78 0.432 . . . . 0.0 110.925 -175.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.548 ' SG ' ' HB2' ' A' ' 13' ' ' MET . 44.0 t -121.27 136.61 25.92 Favored Pre-proline 0 N--CA 1.47 0.537 0 C-N-CA 123.928 0.891 . . . . 0.0 110.183 -179.589 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -69.58 -23.26 31.8 Favored 'Trans proline' 0 C--N 1.37 1.682 0 C-N-CA 122.781 2.321 . . . . 0.0 112.477 175.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.548 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 0.3 OUTLIER -71.65 -43.15 66.58 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.596 0.758 . . . . 0.0 111.209 -178.097 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 156.8 -172.06 34.39 Favored Glycine 0 C--N 1.345 1.055 0 CA-C-N 116.381 -0.372 . . . . 0.0 113.265 179.343 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 65.4 mt -82.6 -18.94 39.44 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 -175.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.85 -42.33 99.71 Favored 'General case' 0 N--CA 1.485 1.295 0 CA-C-N 118.818 0.736 . . . . 0.0 111.234 -177.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.438 ' CD2' HD22 ' A' ' 85' ' ' LEU . 16.4 t60 -65.76 -42.22 91.15 Favored 'General case' 0 C--O 1.247 0.966 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.124 177.417 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.45 HG23 HD13 ' A' ' 85' ' ' LEU . 35.3 p -67.38 -32.61 73.65 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.238 -178.517 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -74.47 -31.37 62.2 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.357 0.663 . . . . 0.0 111.738 -178.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 56.3 mtm -64.8 -41.27 95.94 Favored 'General case' 0 N--CA 1.485 1.316 0 CA-C-O 120.921 0.391 . . . . 0.0 110.234 172.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.35 -38.4 84.76 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.324 174.541 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.84 -32.79 72.73 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.401 0.68 . . . . 0.0 111.059 -179.334 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 25.2 tp60 -74.22 -42.77 59.22 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 122.944 0.498 . . . . 0.0 109.832 177.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.37 -51.01 61.5 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.489 -176.469 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.407 HD11 ' OG ' ' A' ' 64' ' ' SER . 94.3 mt -63.55 -34.26 77.41 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.502 0.721 . . . . 0.0 111.374 177.799 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.531 ' HA ' HG21 ' A' ' 36' ' ' VAL . 31.0 tt0 -56.38 -56.83 16.21 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 123.916 0.76 . . . . 0.0 110.455 174.686 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.455 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 44.8 mt-10 -52.79 -48.81 66.62 Favored 'General case' 0 N--CA 1.478 0.966 0 O-C-N 124.535 1.147 . . . . 0.0 111.238 -179.785 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.94 -49.14 78.96 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.303 1.041 . . . . 0.0 112.199 -177.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.26 -26.3 67.28 Favored 'General case' 0 CA--C 1.546 0.81 0 CA-C-N 115.372 -0.831 . . . . 0.0 112.863 178.519 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.456 HG23 ' O ' ' A' ' 26' ' ' GLU . 55.4 t -72.31 -38.3 61.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 178.21 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 8.4 mm-40 -71.54 -22.64 61.74 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 114.836 -1.074 . . . . 0.0 111.051 178.313 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -82.43 -20.19 37.5 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.318 0.647 . . . . 0.0 111.105 174.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 113.48 -37.56 3.55 Favored Glycine 0 C--N 1.348 1.225 0 N-CA-C 113.951 0.34 . . . . 0.0 113.951 167.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.64 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -76.0 174.39 10.05 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 -175.07 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.539 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 12.4 tp10 -72.56 151.65 42.29 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 113.935 -1.484 . . . . 0.0 109.507 178.515 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.531 HG21 ' HA ' ' A' ' 26' ' ' GLU . 9.6 p -136.05 128.71 46.26 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 C-N-CA 123.045 0.538 . . . . 0.0 110.753 -179.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 48.5 tptt -138.03 114.97 10.78 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.654 0.782 . . . . 0.0 109.071 176.276 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.541 HG12 ' HB3' ' A' ' 7' ' ' ALA . 43.2 mt -118.69 111.01 31.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -174.098 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -72.9 148.11 44.67 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 171.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.8 p -133.69 122.21 23.07 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.863 0.865 . . . . 0.0 109.182 -177.577 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -114.52 134.27 55.15 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -162.25 179.74 37.38 Favored Glycine 0 C--N 1.341 0.807 0 N-CA-C 112.699 -0.16 . . . . 0.0 112.699 -176.459 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.35 -24.19 67.21 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.943 0.897 . . . . 0.0 112.123 179.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -75.61 -36.3 60.3 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.598 0.759 . . . . 0.0 110.548 176.511 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 147.36 -156.52 27.02 Favored Glycine 0 C--N 1.346 1.099 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.417 -177.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 77.5 mt -113.12 141.5 28.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 174.198 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -135.54 150.25 49.68 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.258 1.023 . . . . 0.0 109.145 179.17 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 8.8 t30 64.3 39.29 7.37 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.533 1.133 . . . . 0.0 110.085 174.366 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 22.8 tpp180 -42.03 125.69 3.04 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 125.961 1.704 . . . . 0.0 113.31 -178.176 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 42.7 mt -82.48 126.95 32.82 Favored 'General case' 0 C--O 1.242 0.663 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.221 174.074 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.418 ' O ' HG13 ' A' ' 55' ' ' ILE . 60.2 p -96.64 164.35 12.63 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.932 -178.062 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.87 -29.92 63.37 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.462 0.705 . . . . 0.0 111.247 177.299 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.418 ' O ' ' HG3' ' A' ' 57' ' ' GLU . 47.7 tt0 -57.54 -61.14 2.72 Favored 'General case' 0 C--N 1.354 0.763 0 C-N-CA 123.783 0.833 . . . . 0.0 110.104 170.807 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.474 ' HB3' HG21 ' A' ' 6' ' ' ILE . 38.9 m-20 -52.02 -44.11 64.03 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 124.134 0.973 . . . . 0.0 112.343 -176.555 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ILE . . . . . 0.51 HG23 ' HG3' ' A' ' 78' ' ' ARG . 29.4 mt -67.4 -38.11 80.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 O-C-N 124.285 0.991 . . . . 0.0 111.742 -175.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -79.88 -28.69 39.9 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.218 179.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.418 ' HG3' ' O ' ' A' ' 53' ' ' GLN . 53.0 mt-10 -71.07 -35.97 72.09 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.534 0.734 . . . . 0.0 110.274 173.751 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -58.53 108.01 0.58 Allowed 'General case' 0 C--N 1.348 0.521 0 CA-C-N 114.643 -1.162 . . . . 0.0 111.997 -171.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 37.3 m -62.68 -40.43 97.06 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 115.046 -0.979 . . . . 0.0 109.041 165.01 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 80.4 mt -129.27 140.26 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.317 -178.194 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.464 HG23 HG13 ' A' ' 6' ' ' ILE . 20.2 mt -130.31 135.0 61.63 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 171.595 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -119.42 133.98 64.47 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 173.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . 0.43 ' HB2' ' HG3' ' A' ' 82' ' ' GLU . 13.2 m170 -107.46 84.35 1.95 Allowed 'General case' 0 N--CA 1.484 1.232 0 CA-C-O 121.481 0.658 . . . . 0.0 109.648 170.421 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.536 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 20.4 m -78.54 80.59 4.92 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 124.659 1.184 . . . . 0.0 110.344 177.014 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 34.7 m -125.37 160.0 31.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 CA-C-O 121.665 0.745 . . . . 0.0 112.175 -169.567 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -110.59 -23.13 11.27 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 114.589 -1.187 . . . . 0.0 109.071 173.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 17.0 m -130.86 165.87 30.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 C-N-CA 125.545 1.538 . . . . 0.0 108.638 178.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 88.8 m -62.29 117.17 27.75 Favored Pre-proline 0 CA--C 1.547 0.848 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 175.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.616 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 38.5 Cg_endo -63.92 142.91 83.89 Favored 'Trans proline' 0 C--N 1.376 2.002 0 C-N-CA 122.06 1.84 . . . . 0.0 111.544 177.907 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -68.61 -37.49 79.82 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.45 0.7 . . . . 0.0 110.715 -174.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -97.6 25.06 6.07 Favored 'General case' 0 C--O 1.219 -0.503 0 CA-C-N 115.21 -0.905 . . . . 0.0 110.683 -177.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.616 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 38.6 t30 -55.11 -37.35 66.77 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.148 0.579 . . . . 0.0 111.407 177.285 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.65 -22.1 66.89 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.613 0.765 . . . . 0.0 112.778 -179.181 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.6 mmp_? -66.71 -33.09 74.86 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.146 0.578 . . . . 0.0 111.455 174.097 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -107.62 -29.48 9.14 Favored 'General case' 0 N--CA 1.485 1.298 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -168.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -54.94 -27.43 43.4 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 -165.403 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 20.9 t -84.8 7.19 21.6 Favored 'General case' 0 CA--C 1.56 1.352 0 C-N-CA 123.638 0.775 . . . . 0.0 112.204 -179.412 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.51 ' HG3' HG23 ' A' ' 55' ' ' ILE . 34.9 mmt180 -121.28 -177.03 3.42 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 124.595 1.158 . . . . 0.0 110.036 179.511 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -79.5 86.79 5.14 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.062 0.545 . . . . 0.0 110.893 178.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 22.5 t -108.68 146.64 14.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 123.75 0.82 . . . . 0.0 109.877 179.184 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -125.73 96.04 4.64 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.819 0.848 . . . . 0.0 109.737 177.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.43 ' HG3' ' HB2' ' A' ' 63' ' ' HIS . 1.8 mp0 -72.3 129.1 37.62 Favored 'General case' 0 C--N 1.352 0.696 0 CA-C-O 121.233 0.54 . . . . 0.0 110.404 178.261 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.479 HG13 ' HA ' ' A' ' 64' ' ' SER . 45.8 pt -138.45 -176.48 1.35 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.83 0 C-N-CA 125.231 1.412 . . . . 0.0 108.386 177.271 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 13.1 p -83.63 147.44 27.71 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 122.63 0.372 . . . . 0.0 110.158 170.42 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.509 HD11 ' HB2' ' A' ' 11' ' ' CYS . 4.8 tt -63.26 -30.23 71.41 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.341 0.656 . . . . 0.0 111.153 178.074 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -61.38 -43.76 98.32 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.39 0.676 . . . . 0.0 110.946 173.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.42 ' HB3' HD12 ' A' ' 83' ' ' ILE . 9.6 t70 -59.77 -32.99 71.11 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.628 0.771 . . . . 0.0 110.901 179.427 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . 0.499 ' HB2' ' HB3' ' A' ' 64' ' ' SER . . . -65.46 -23.59 66.96 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.837 0.855 . . . . 0.0 113.244 179.112 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 34.9 mt -93.89 -51.12 11.51 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 123.091 0.556 . . . . 0.0 109.895 -179.187 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 58.1 pttt -75.62 -29.73 59.28 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.329 0.652 . . . . 0.0 112.297 -174.759 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -126.45 18.75 7.5 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 122.989 0.516 . . . . 0.0 110.886 -168.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -44.98 -57.35 3.88 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -174.671 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.27 -36.07 79.01 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.024 -0.989 . . . . 0.0 111.491 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -62.48 -56.55 20.97 Favored Glycine 0 C--N 1.351 1.365 0 O-C-N 124.152 0.908 . . . . 0.0 111.554 179.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.414 ' O ' HG13 ' A' ' 99' ' ' ILE . 33.7 mt -47.05 -57.76 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 125.039 1.336 . . . . 0.0 111.09 -179.383 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.9 mp -57.48 -53.49 43.48 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 O-C-N 124.244 0.965 . . . . 0.0 111.212 -176.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -27.26 67.64 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -176.567 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 24.3 mm-40 -69.33 -36.4 76.89 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.762 0.825 . . . . 0.0 109.744 178.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 95' ' ' ILE . 30.3 mt -77.99 -38.94 25.01 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -55.71 -47.84 76.17 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 114.22 -1.355 . . . . 0.0 111.489 176.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -74.56 -33.76 62.77 Favored 'General case' 0 C--N 1.349 0.557 0 O-C-N 123.566 0.541 . . . . 0.0 111.278 -177.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 70.3 mtm -60.46 -51.41 69.6 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 176.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 60.2 mt -65.76 -45.27 92.2 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.916 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.562 178.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.73 -31.53 72.24 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -175.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 66.1 m -84.2 -24.74 29.97 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -176.004 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -84.46 -31.8 24.38 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 122.002 0.121 . . . . 0.0 110.973 174.131 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -84.08 -33.32 24.41 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 122.847 0.459 . . . . 0.0 111.248 -178.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 27.3 mm-40 . . . . . 0 C--O 1.251 1.183 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 177.293 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.6 mmt . . . . . 0 N--CA 1.484 1.268 0 N-CA-C 110.479 -0.193 . . . . 0.0 110.479 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 54.2 m -68.27 100.14 1.01 Allowed 'General case' 0 C--N 1.353 0.731 0 C-N-CA 123.328 0.651 . . . . 0.0 110.406 178.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.61 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 17.1 pttt -74.07 178.83 4.75 Favored 'General case' 0 N--CA 1.48 1.038 0 CA-C-O 121.302 0.573 . . . . 0.0 110.847 174.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.54 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.0 tmtp? -146.34 143.61 29.22 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -170.374 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.493 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.2 tt -132.29 141.9 49.17 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 175.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.517 HD12 ' HA ' ' A' ' 55' ' ' ILE . 21.0 pt -132.57 169.79 21.26 Favored 'Isoleucine or valine' 0 C--O 1.241 0.653 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 170.501 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.55 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -153.64 169.74 22.53 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.354 175.636 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.1 tt -143.03 113.5 7.38 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 178.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.454 ' HA ' ' O ' ' A' ' 64' ' ' SER . 56.3 m -101.05 113.53 26.63 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 175.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.475 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -126.8 119.0 25.79 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 122.626 0.37 . . . . 0.0 110.405 -178.035 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.523 ' SG ' ' HB2' ' A' ' 13' ' ' MET . 51.7 t -125.26 138.53 31.86 Favored Pre-proline 0 N--CA 1.472 0.64 0 C-N-CA 123.339 0.656 . . . . 0.0 111.185 -172.635 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.406 ' HD2' ' HG ' ' A' ' 11' ' ' CYS . 57.4 Cg_endo -68.38 -20.42 42.27 Favored 'Trans proline' 0 C--N 1.378 2.109 0 C-N-CA 123.096 2.531 . . . . 0.0 112.606 172.319 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.523 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 60.5 mtt -75.91 -46.36 30.38 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.635 0.774 . . . . 0.0 110.01 178.674 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 141.92 -161.49 27.13 Favored Glycine 0 C--N 1.346 1.138 0 CA-C-N 116.038 -0.528 . . . . 0.0 113.307 176.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 52.9 mt -74.2 -26.61 60.37 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 -170.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.73 -43.34 94.25 Favored 'General case' 0 N--CA 1.485 1.32 0 CA-C-O 121.498 0.666 . . . . 0.0 110.971 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 8.6 t-160 -71.56 -38.1 71.0 Favored 'General case' 0 C--O 1.247 0.935 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.385 -178.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 51.6 p -66.45 -32.02 73.14 Favored 'General case' 0 C--N 1.35 0.604 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.869 178.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 18.6 m-30 -72.14 -30.35 64.95 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.049 0.54 . . . . 0.0 111.694 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 41.0 mtm -67.28 -40.19 86.09 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 120.758 0.313 . . . . 0.0 110.456 173.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.46 -36.6 74.01 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.363 176.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.56 -50.38 58.78 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.828 0.851 . . . . 0.0 110.301 -178.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.476 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 8.7 tp-100 -58.32 -43.94 88.4 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.737 0.815 . . . . 0.0 110.44 179.098 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.411 ' HB1' ' HB3' ' A' ' 92' ' ' ALA . . . -62.73 -54.39 39.88 Favored 'General case' 0 CA--C 1.55 0.96 0 CA-C-N 115.66 -0.7 . . . . 0.0 112.052 -178.204 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 92.1 mt -64.69 -29.61 70.61 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.196 0.598 . . . . 0.0 111.536 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.476 ' O ' HG22 ' A' ' 30' ' ' VAL . 32.9 tt0 -65.91 -55.27 17.78 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.812 0.695 . . . . 0.0 110.012 -179.385 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.496 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 27.5 mm-40 -52.44 -47.5 66.37 Favored 'General case' 0 N--CA 1.484 1.261 0 O-C-N 124.359 1.037 . . . . 0.0 110.432 178.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.427 ' HB1' ' HA ' ' A' ' 93' ' ' ALA . . . -56.49 -51.68 67.59 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.502 1.121 . . . . 0.0 111.925 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.55 -23.39 65.42 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 115.332 -0.849 . . . . 0.0 113.184 178.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.476 HG22 ' O ' ' A' ' 26' ' ' GLU . 53.9 t -74.88 -37.6 42.13 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 178.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.496 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 17.4 mm-40 -72.75 -21.48 61.01 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.745 177.393 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -80.64 -13.76 58.76 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.532 0.733 . . . . 0.0 111.76 174.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 105.0 -37.79 3.62 Favored Glycine 0 C--N 1.347 1.191 0 N-CA-C 114.278 0.471 . . . . 0.0 114.278 167.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.61 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -76.75 -179.4 5.35 Favored 'General case' 0 N--CA 1.483 1.207 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -175.897 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.54 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 8.8 tp10 -73.05 153.06 41.01 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 114.453 -1.248 . . . . 0.0 110.31 176.496 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.493 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 6.7 p -142.46 128.06 17.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 123.273 0.629 . . . . 0.0 110.595 176.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 49.7 tptt -136.39 114.51 11.48 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 177.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.55 HG12 ' HB3' ' A' ' 7' ' ' ALA . 59.2 mt -117.39 111.31 34.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.925 0 C-N-CA 122.6 0.36 . . . . 0.0 111.877 -174.327 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -77.99 141.79 38.7 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.614 0.766 . . . . 0.0 109.099 171.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.411 HG23 ' HB2' ' A' ' 9' ' ' CYS . 17.4 p -124.64 117.51 24.44 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.53 0.732 . . . . 0.0 109.294 -177.666 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.475 ' O ' ' HA ' ' A' ' 10' ' ' ALA . 42.1 mt-30 -109.81 135.79 50.16 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.578 0.751 . . . . 0.0 110.146 178.44 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -161.68 179.59 36.97 Favored Glycine 0 C--N 1.336 0.57 0 N-CA-C 111.929 -0.468 . . . . 0.0 111.929 178.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.24 -14.51 63.0 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.127 0.571 . . . . 0.0 111.998 -179.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -84.78 -27.37 26.91 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.468 0.707 . . . . 0.0 111.347 176.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 147.19 -157.67 27.48 Favored Glycine 0 C--N 1.344 0.986 0 CA-C-N 116.413 -0.358 . . . . 0.0 112.545 -179.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.435 HG12 ' HG2' ' A' ' 41' ' ' GLN . 70.2 mt -127.48 132.35 69.39 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 C-N-CA 123.711 0.804 . . . . 0.0 109.995 178.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.411 ' HB3' ' OG1' ' A' ' 40' ' ' THR . 8.2 tp-100 -126.91 150.25 49.4 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.198 0.999 . . . . 0.0 110.586 -178.143 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 19.7 t30 61.43 41.5 12.69 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 124.966 1.306 . . . . 0.0 110.219 174.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 22.6 tpp180 -48.35 122.34 5.27 Favored 'General case' 0 C--N 1.356 0.873 0 C-N-CA 125.277 1.431 . . . . 0.0 112.544 -176.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 36.9 mt -66.73 148.99 51.18 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 114.605 -1.179 . . . . 0.0 110.621 170.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 34.4 p -104.45 167.81 9.5 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 172.24 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.61 -34.49 71.19 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-O 121.019 0.438 . . . . 0.0 110.461 175.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -63.76 -48.64 76.12 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.847 175.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -54.18 -42.35 69.57 Favored 'General case' 0 N--CA 1.496 1.873 0 C-N-CA 123.321 0.648 . . . . 0.0 111.791 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.592 HG23 ' HG3' ' A' ' 78' ' ' ARG . 43.2 mt -75.28 -27.96 19.97 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.939 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.041 -176.205 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -75.51 -45.9 35.49 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.485 0.714 . . . . 0.0 111.117 176.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -61.38 -35.3 77.1 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.342 1.057 . . . . 0.0 110.77 178.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -53.15 100.49 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.579 0 O-C-N 125.001 1.438 . . . . 0.0 112.582 -174.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 30.2 m -63.94 -36.45 84.0 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 114.673 -1.149 . . . . 0.0 109.067 167.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.467 HG22 HG22 ' A' ' 99' ' ' ILE . 80.0 mt -129.05 140.45 49.2 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 CA-C-N 114.769 -1.105 . . . . 0.0 109.794 178.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.53 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 35.1 mt -129.89 141.37 46.6 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 171.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.6 mp -127.02 112.55 29.22 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 CA-C-N 118.344 0.52 . . . . 0.0 109.632 172.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 8.6 m170 -89.17 83.95 6.52 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-O 121.745 0.783 . . . . 0.0 109.322 170.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.454 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 20.6 p -80.32 79.86 6.85 Favored 'General case' 0 C--O 1.24 0.567 0 CA-C-N 114.361 -1.29 . . . . 0.0 109.312 176.509 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 27.6 m -126.21 161.52 31.79 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 CA-C-O 121.685 0.755 . . . . 0.0 111.943 -170.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -123.08 -17.24 6.75 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 114.491 -1.231 . . . . 0.0 109.592 175.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 6.7 m -131.92 159.22 43.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 124.699 1.2 . . . . 0.0 108.401 173.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 79.0 m -64.45 111.83 6.46 Favored Pre-proline 0 CA--C 1.544 0.714 0 O-C-N 123.8 0.688 . . . . 0.0 109.663 177.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.503 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 55.8 Cg_endo -68.14 142.23 55.17 Favored 'Trans proline' 0 C--N 1.376 2.01 0 C-N-CA 122.175 1.916 . . . . 0.0 110.651 -179.157 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -65.36 -21.87 66.74 Favored 'General case' 0 N--CA 1.482 1.141 0 CA-C-O 121.327 0.584 . . . . 0.0 111.63 -173.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.809 ' HB3' HH11 ' A' ' 74' ' ' ARG . 4.0 m-20 -104.46 12.61 33.1 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.201 1.0 . . . . 0.0 112.737 -174.511 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.503 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 5.6 p30 -60.06 -24.95 64.98 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.558 0.743 . . . . 0.0 112.384 -176.044 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -60.89 -32.4 71.86 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.887 1.275 . . . . 0.0 113.08 -179.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.809 HH11 ' HB3' ' A' ' 71' ' ' ASP . 40.1 mtp180 -68.36 -25.32 65.02 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 124.338 1.055 . . . . 0.0 111.569 -179.418 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.407 ' HB3' HG23 ' A' ' 80' ' ' VAL . 33.0 m-85 -103.07 -2.21 27.87 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 114.139 -1.392 . . . . 0.0 111.277 -175.511 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -54.79 -42.76 72.16 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 124.639 1.176 . . . . 0.0 111.933 -179.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 58.5 p -82.86 -13.69 55.68 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.642 0.777 . . . . 0.0 112.358 -177.087 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.592 ' HG3' HG23 ' A' ' 55' ' ' ILE . 33.3 mmt180 -103.64 164.54 11.6 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.706 0.802 . . . . 0.0 111.63 -169.01 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -83.38 99.35 10.0 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 123.748 0.819 . . . . 0.0 110.146 -177.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.53 ' HA ' ' HB ' ' A' ' 61' ' ' ILE . 51.4 t -112.28 135.68 50.87 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 C-N-CA 123.643 0.777 . . . . 0.0 110.514 -174.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 73.6 m-85 -104.26 88.58 3.02 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 107.367 -1.345 . . . . 0.0 107.367 175.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -86.92 116.13 24.79 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 114.619 -1.173 . . . . 0.0 109.676 -172.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.437 HG13 ' HA ' ' A' ' 64' ' ' SER . 43.6 pt -126.24 -172.58 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 124.693 1.197 . . . . 0.0 110.106 -179.459 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 15.9 p -82.79 147.34 28.45 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.728 169.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.463 HD12 ' HB2' ' A' ' 11' ' ' CYS . 6.5 tt -62.85 -27.69 69.51 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.381 176.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.659 ' HG2' ' HE2' ' A' ' 90' ' ' LYS . 10.1 tt0 -71.11 -40.52 71.42 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 122.725 0.41 . . . . 0.0 111.113 177.016 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.408 ' HB3' HD12 ' A' ' 83' ' ' ILE . 24.5 t70 -59.86 -33.54 71.94 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.101 0.561 . . . . 0.0 110.195 176.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.54 -28.44 69.86 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.881 0.872 . . . . 0.0 112.739 177.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 63.9 mt -88.03 -49.04 14.77 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.992 0 C-N-CA 123.287 0.635 . . . . 0.0 110.273 -179.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.659 ' HE2' ' HG2' ' A' ' 86' ' ' GLN . 0.1 OUTLIER -79.46 -30.69 42.24 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 -173.599 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -123.31 16.8 9.81 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.148 0.579 . . . . 0.0 110.851 -170.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.411 ' HB3' ' HB1' ' A' ' 24' ' ' ALA . . . -40.22 -59.01 1.36 Allowed 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 124.304 1.042 . . . . 0.0 113.584 -173.111 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.427 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . . . -63.56 -39.5 94.55 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 114.919 -1.037 . . . . 0.0 111.165 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -60.6 -46.78 93.76 Favored Glycine 0 C--N 1.354 1.553 0 O-C-N 124.304 1.003 . . . . 0.0 112.055 -178.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.437 ' O ' HG13 ' A' ' 99' ' ' ILE . 34.1 mt -53.53 -62.21 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 124.893 1.277 . . . . 0.0 110.219 177.478 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.7 mp -55.04 -53.8 30.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 O-C-N 124.178 0.924 . . . . 0.0 111.227 -174.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.16 -28.93 69.15 Favored 'General case' 0 N--CA 1.485 1.302 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -175.072 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 50.5 mm-40 -71.93 -36.76 70.02 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 122.572 0.349 . . . . 0.0 110.418 176.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . 0.467 HG22 HG22 ' A' ' 60' ' ' ILE . 55.3 mt -71.82 -35.59 55.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 179.403 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -59.05 -49.46 77.8 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-N 114.337 -1.301 . . . . 0.0 111.13 177.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -79.5 -25.96 41.69 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -175.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 65.2 mtm -69.04 -53.68 19.17 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 122.575 0.35 . . . . 0.0 110.393 174.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 26.6 mt -61.44 -49.22 85.36 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.281 177.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.522 ' O ' ' HG2' ' A' ' 108' ' ' GLN . . . -56.02 -39.97 72.73 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 122.961 0.505 . . . . 0.0 111.55 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 30.6 t -62.28 -45.84 91.46 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 123.981 0.8 . . . . 0.0 110.652 -177.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -78.82 -19.8 51.22 Favored 'General case' 0 N--CA 1.483 1.193 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 179.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 20.3 mm-40 -85.25 -12.62 52.06 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 122.84 0.456 . . . . 0.0 111.841 178.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.522 ' HG2' ' O ' ' A' ' 104' ' ' ALA . 76.8 mm-40 . . . . . 0 CA--C 1.556 1.21 0 CA-C-O 119.214 -0.422 . . . . 0.0 110.129 175.057 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.2 mtp . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 120.711 0.291 . . . . 0.0 110.317 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.7 m -67.29 99.69 0.73 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.566 0.746 . . . . 0.0 110.769 178.052 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.456 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 3.2 pttt -80.44 179.4 7.73 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.97 0.908 . . . . 0.0 110.229 177.201 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.435 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 3.6 tmtp? -143.86 139.56 29.31 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 -172.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.476 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 8.6 tt -128.86 140.15 51.82 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 176.45 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 23.1 pt -128.87 158.4 41.44 Favored 'Isoleucine or valine' 0 C--O 1.24 0.594 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 170.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.58 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -147.19 169.53 19.14 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 177.386 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.425 HD22 ' OE1' ' A' ' 41' ' ' GLN . 5.4 tt -143.68 117.9 9.56 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 -179.144 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.501 ' HA ' ' O ' ' A' ' 64' ' ' SER . 61.5 m -108.39 108.41 19.36 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.88 0.872 . . . . 0.0 109.364 176.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -123.3 124.11 42.25 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 122.783 0.433 . . . . 0.0 110.697 -179.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.764 ' SG ' HD11 ' A' ' 85' ' ' LEU . 1.3 m -142.67 144.61 30.74 Favored Pre-proline 0 N--CA 1.483 1.209 0 C-N-CA 123.218 0.607 . . . . 0.0 111.766 -179.493 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -83.65 -14.57 7.74 Favored 'Trans proline' 0 C--N 1.373 1.868 0 C-N-CA 123.496 2.797 . . . . 0.0 112.447 174.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 23.1 ttt -60.38 -53.23 60.14 Favored 'General case' 0 C--N 1.357 0.908 0 C-N-CA 123.411 0.684 . . . . 0.0 109.671 174.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 157.48 175.26 28.21 Favored Glycine 0 C--O 1.246 0.87 0 CA-C-N 115.136 -0.938 . . . . 0.0 112.047 -179.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 29.9 mt -67.37 -20.61 65.59 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 122.925 0.49 . . . . 0.0 111.877 177.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.9 -45.53 82.54 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-O 121.008 0.433 . . . . 0.0 110.792 174.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.435 ' ND1' ' SG ' ' A' ' 11' ' ' CYS . 12.1 t-160 -68.48 -44.8 73.97 Favored 'General case' 0 C--O 1.242 0.666 0 CA-C-N 115.366 -0.833 . . . . 0.0 109.86 -179.174 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.474 ' HA ' HD13 ' A' ' 85' ' ' LEU . 47.5 p -64.7 -37.99 89.48 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.413 -176.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.481 ' HZ ' ' HG2' ' A' ' 47' ' ' GLN . 13.2 m-85 -74.25 -28.2 61.11 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.191 0.596 . . . . 0.0 112.0 -178.044 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 67.5 mtm -69.63 -36.7 76.36 Favored 'General case' 0 N--CA 1.483 1.222 0 CA-C-N 118.024 0.375 . . . . 0.0 110.483 173.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.02 -40.2 71.92 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.95 174.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.32 -42.75 83.11 Favored 'General case' 0 C--O 1.217 -0.613 0 C-N-CA 123.715 0.806 . . . . 0.0 110.334 -178.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.471 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 8.9 tp-100 -61.7 -47.23 86.23 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.463 0.705 . . . . 0.0 109.503 178.556 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.494 ' HB1' ' HB3' ' A' ' 92' ' ' ALA . . . -62.03 -52.8 62.51 Favored 'General case' 0 CA--C 1.552 1.038 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.698 -177.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 75.6 mt -64.54 -32.63 74.35 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.535 0.734 . . . . 0.0 111.635 -179.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.538 ' HA ' HG21 ' A' ' 36' ' ' VAL . 30.6 tt0 -65.89 -55.7 15.6 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 123.688 0.617 . . . . 0.0 110.141 -179.129 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.543 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 19.9 mm-40 -55.82 -44.36 77.8 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 124.456 1.097 . . . . 0.0 110.255 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -57.01 -50.44 72.72 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.162 0.985 . . . . 0.0 111.66 177.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.62 -22.88 65.32 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 123.671 0.788 . . . . 0.0 113.096 178.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.451 HG21 ' O ' ' A' ' 26' ' ' GLU . 55.1 t -75.97 -40.16 37.81 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.543 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 7.1 mm-40 -72.67 -18.53 61.55 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.513 177.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -80.93 -12.28 59.43 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.112 0.965 . . . . 0.0 111.302 173.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 82.77 23.43 55.88 Favored Glycine 0 C--N 1.349 1.298 0 N-CA-C 114.764 0.666 . . . . 0.0 114.764 167.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.456 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.1 OUTLIER -129.55 176.96 7.57 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.283 0.633 . . . . 0.0 111.089 173.138 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.435 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 11.7 tp10 -72.86 153.39 41.06 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.131 178.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.538 HG21 ' HA ' ' A' ' 26' ' ' GLU . 6.4 p -141.5 128.96 21.36 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 C-N-CA 123.426 0.69 . . . . 0.0 110.637 179.603 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 47.7 tptt -135.78 111.13 9.08 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.521 0.728 . . . . 0.0 109.568 179.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.58 HG12 ' HB3' ' A' ' 7' ' ' ALA . 48.4 mt -116.15 113.45 43.23 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.235 0 N-CA-C 112.767 0.654 . . . . 0.0 112.767 -172.604 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -79.22 117.65 20.43 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 123.933 0.893 . . . . 0.0 110.047 176.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.44 ' OG1' ' HB3' ' A' ' 47' ' ' GLN . 3.3 p -103.51 103.93 13.95 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.237 0.615 . . . . 0.0 110.623 -179.612 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.425 ' OE1' HD22 ' A' ' 8' ' ' LEU . 31.3 mt-30 -98.62 132.17 44.23 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 -179.576 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -148.29 179.85 24.82 Favored Glycine 0 C--O 1.241 0.588 0 N-CA-C 111.483 -0.647 . . . . 0.0 111.483 177.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.78 -23.75 67.49 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.46 0.704 . . . . 0.0 111.348 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -67.76 -44.47 77.44 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.819 1.247 . . . . 0.0 110.173 174.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 150.61 -175.79 29.47 Favored Glycine 0 C--N 1.336 0.54 0 CA-C-N 114.822 -1.081 . . . . 0.0 111.482 -175.292 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.46 HG23 ' NH1' ' A' ' 49' ' ' ARG . 67.6 mt -98.86 111.66 29.03 Favored 'Isoleucine or valine' 0 C--O 1.24 0.587 0 C-N-CA 123.685 0.794 . . . . 0.0 109.78 -179.412 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.481 ' HG2' ' HZ ' ' A' ' 19' ' ' PHE . 8.5 tp-100 -96.33 148.48 22.71 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.104 0.962 . . . . 0.0 110.084 177.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 25.8 t30 79.82 -54.21 0.39 Allowed 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 126.264 1.826 . . . . 0.0 111.571 173.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.46 ' NH1' HG23 ' A' ' 46' ' ' ILE . 17.7 tpp180 65.32 144.63 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.238 0 C-N-CA 125.347 1.459 . . . . 0.0 112.918 176.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 37.8 mt -112.29 129.9 56.12 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.391 1.077 . . . . 0.0 109.86 173.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 39.7 p -95.92 165.34 12.32 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.931 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.53 -30.46 63.08 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.479 0.712 . . . . 0.0 111.317 177.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -67.79 -47.34 69.4 Favored 'General case' 0 C--N 1.353 0.731 0 C-N-CA 123.699 0.8 . . . . 0.0 110.959 176.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -56.33 -44.42 79.98 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.386 0.674 . . . . 0.0 110.902 178.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.494 HG22 ' HG3' ' A' ' 78' ' ' ARG . 33.1 mt -72.39 -36.85 56.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 O-C-N 124.483 1.115 . . . . 0.0 111.277 -175.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.42 -44.01 68.79 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.385 0.674 . . . . 0.0 111.124 -178.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -86.31 -8.1 57.97 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.305 0.642 . . . . 0.0 111.998 -177.006 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.69 108.45 1.72 Allowed 'General case' 0 N--CA 1.473 0.71 0 O-C-N 123.709 0.63 . . . . 0.0 111.053 178.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 17.3 m -62.1 -37.22 84.28 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.429 167.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.517 HG21 HG22 ' A' ' 99' ' ' ILE . 76.5 mt -132.25 141.89 44.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 C-N-CA 124.363 1.065 . . . . 0.0 110.346 -176.543 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 27.2 mt -131.85 132.2 61.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 C-N-CA 123.916 0.887 . . . . 0.0 108.812 172.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.4 mp -119.23 133.25 66.67 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 172.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . 0.508 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 11.7 m170 -109.58 84.96 2.01 Favored 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 167.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.504 ' HA ' HG13 ' A' ' 83' ' ' ILE . 28.0 p -81.31 85.39 6.41 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 114.514 -1.221 . . . . 0.0 108.995 174.095 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 35.9 m -126.85 160.59 35.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-O 121.783 0.802 . . . . 0.0 111.982 -171.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -118.2 -19.01 9.18 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 114.007 -1.452 . . . . 0.0 109.116 176.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 5.8 m -132.19 160.49 42.45 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 C-N-CA 125.533 1.533 . . . . 0.0 108.037 176.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 63.8 m -59.47 116.78 17.77 Favored Pre-proline 0 C--O 1.244 0.766 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 174.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.512 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 37.9 Cg_endo -63.27 140.15 75.7 Favored 'Trans proline' 0 C--N 1.372 1.792 0 C-N-CA 121.949 1.766 . . . . 0.0 110.702 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -59.34 -38.11 79.51 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 123.92 0.762 . . . . 0.0 110.551 -174.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.428 ' HB3' ' HG3' ' A' ' 74' ' ' ARG . 4.4 m-20 -104.12 30.45 5.21 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 114.51 -1.223 . . . . 0.0 111.385 -174.13 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.512 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 7.2 p30 -59.89 -27.82 67.03 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.413 0.685 . . . . 0.0 110.858 177.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -60.04 -32.83 71.27 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.258 1.423 . . . . 0.0 112.262 176.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.428 ' HG3' ' HB3' ' A' ' 71' ' ' ASP . 12.1 mmp_? -66.26 -30.82 71.33 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 124.202 1.001 . . . . 0.0 111.715 -176.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -108.29 -2.06 19.56 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.962 -169.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -62.3 -35.27 78.52 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.265 0.626 . . . . 0.0 112.204 -172.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 69.8 p -75.74 -15.43 60.28 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.412 0.685 . . . . 0.0 112.014 -179.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.494 ' HG3' HG22 ' A' ' 55' ' ' ILE . 38.0 mmt180 -109.32 163.22 13.59 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.751 0.82 . . . . 0.0 111.153 -173.872 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 33.2 m-20 -76.42 109.25 9.98 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.463 0.705 . . . . 0.0 110.357 177.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 44.3 t -113.69 137.58 46.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 123.437 0.695 . . . . 0.0 109.918 179.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 79.7 m-85 -101.75 89.82 3.81 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 176.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.508 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 42.5 mt-10 -83.19 125.54 31.66 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.725 -174.631 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.504 HG13 ' HA ' ' A' ' 64' ' ' SER . 42.1 pt -136.09 -174.35 1.08 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 C-N-CA 124.928 1.291 . . . . 0.0 108.84 -179.558 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 22.0 p -87.45 152.3 22.34 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 120.911 0.386 . . . . 0.0 110.02 169.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.764 HD11 ' SG ' ' A' ' 11' ' ' CYS . 8.0 tt -66.26 -27.34 67.87 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.905 178.843 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.585 ' HG2' ' HE3' ' A' ' 90' ' ' LYS . 35.6 tt0 -63.76 -43.45 96.39 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.461 0.705 . . . . 0.0 110.719 173.782 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -61.61 -31.64 71.72 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.577 0.751 . . . . 0.0 110.818 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.02 -33.17 75.4 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.664 0.785 . . . . 0.0 112.433 177.159 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 86.0 mt -79.03 -46.79 23.44 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.846 0 C-N-CA 123.634 0.773 . . . . 0.0 110.524 -177.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.585 ' HE3' ' HG2' ' A' ' 86' ' ' GLN . 18.6 ptpt -81.9 -43.04 18.69 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.114 0.566 . . . . 0.0 111.994 -174.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 62.9 t30 -113.77 28.49 8.72 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.762 0.825 . . . . 0.0 110.907 -169.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.494 ' HB3' ' HB1' ' A' ' 24' ' ' ALA . . . -45.02 -62.1 1.37 Allowed 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -175.562 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.56 -36.51 82.9 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.056 -0.974 . . . . 0.0 110.913 -179.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -61.1 -48.54 85.45 Favored Glycine 0 C--N 1.354 1.569 0 O-C-N 124.616 1.198 . . . . 0.0 112.752 -178.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 22.5 mt -55.74 -56.77 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.169 0.988 . . . . 0.0 110.245 178.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.415 HG21 ' OH ' ' A' ' 34' ' ' TYR . 1.7 mp -55.75 -50.91 64.85 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.048 0 O-C-N 124.247 0.967 . . . . 0.0 111.71 -177.342 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -32.19 73.14 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 112.041 0.386 . . . . 0.0 112.041 -176.577 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -64.81 -39.02 92.9 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 123.7 0.625 . . . . 0.0 109.734 178.234 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . 0.517 HG22 HG21 ' A' ' 60' ' ' ILE . 53.2 mt -73.14 -39.07 56.32 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.983 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -56.7 -48.99 76.47 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.973 0.909 . . . . 0.0 111.243 178.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -74.66 -32.35 62.21 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 123.631 0.582 . . . . 0.0 111.483 -175.282 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 69.3 mtm -66.02 -47.75 73.39 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 122.582 0.353 . . . . 0.0 110.688 175.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 30.5 mt -68.02 -39.18 81.09 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.411 179.103 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.15 -28.65 69.56 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.045 0.538 . . . . 0.0 111.083 177.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 18.2 t -74.15 -43.27 58.05 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 123.155 0.582 . . . . 0.0 110.949 -178.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -76.63 -34.88 58.32 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 122.93 0.492 . . . . 0.0 111.513 -179.144 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -75.85 -24.1 55.76 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 122.966 0.507 . . . . 0.0 111.574 -178.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 32.3 mm-40 . . . . . 0 N--CA 1.478 0.964 0 CA-C-O 118.458 -0.782 . . . . 0.0 109.789 177.608 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.1 mtt . . . . . 0 N--CA 1.482 1.133 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.1 t -70.63 86.42 0.65 Allowed 'General case' 0 CA--C 1.544 0.715 0 CA-C-O 121.322 0.582 . . . . 0.0 109.922 178.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 43.9 pttt -72.92 162.09 29.91 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.607 175.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.589 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.1 tmtp? -141.25 137.37 32.49 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 -170.187 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.482 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 10.2 tt -130.01 130.32 44.84 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 178.381 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.5 HD13 HD12 ' A' ' 50' ' ' LEU . 14.2 pt -121.34 165.61 16.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 172.589 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.549 ' HB1' HG12 ' A' ' 38' ' ' ILE . . . -152.09 169.15 23.11 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.641 176.51 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.9 tt -141.45 115.46 9.25 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.516 ' HA ' ' O ' ' A' ' 64' ' ' SER . 62.1 m -107.24 111.61 24.09 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 177.68 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.448 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -125.69 112.66 16.37 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 122.474 0.31 . . . . 0.0 111.106 -175.181 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.501 ' HB2' HD11 ' A' ' 85' ' ' LEU . 36.0 t -127.43 136.2 28.58 Favored Pre-proline 0 N--CA 1.473 0.693 0 C-N-CA 123.791 0.836 . . . . 0.0 110.442 -179.261 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -76.07 -19.48 15.65 Favored 'Trans proline' 0 C--N 1.365 1.447 0 C-N-CA 122.972 2.448 . . . . 0.0 112.791 177.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.451 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 21.7 mmt -71.89 -31.94 66.93 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.513 0.725 . . . . 0.0 110.663 -178.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 149.24 175.67 21.82 Favored Glycine 0 C--N 1.348 1.216 0 CA-C-N 115.789 -0.642 . . . . 0.0 112.675 177.198 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.6 mt -73.67 -19.57 60.79 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.582 0.753 . . . . 0.0 112.509 -179.395 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.04 -44.09 87.2 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-O 121.189 0.518 . . . . 0.0 111.325 177.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 11.9 t-160 -66.69 -41.51 87.93 Favored 'General case' 0 C--O 1.247 0.923 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.275 179.075 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 34.2 p -66.77 -32.78 74.29 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.99 -178.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.6 m-30 -69.49 -31.63 70.01 Favored 'General case' 0 C--N 1.354 0.772 0 C-N-CA 123.246 0.618 . . . . 0.0 111.25 178.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 64.5 mtm -67.01 -41.15 87.14 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-O 120.639 0.257 . . . . 0.0 110.901 175.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.14 -44.55 83.88 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.065 174.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.13 -41.28 97.27 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.954 0.901 . . . . 0.0 110.895 -177.415 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -57.17 -54.75 43.21 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.981 0.912 . . . . 0.0 109.949 177.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.06 -42.87 93.79 Favored 'General case' 0 CA--C 1.553 1.06 0 CA-C-N 114.953 -1.021 . . . . 0.0 111.99 -174.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.409 HD13 ' OG ' ' A' ' 64' ' ' SER . 89.2 mt -68.11 -35.77 78.68 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 123.13 0.572 . . . . 0.0 111.265 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.521 ' HA ' HG23 ' A' ' 36' ' ' VAL . 35.6 tt0 -62.19 -53.0 61.56 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 123.837 0.71 . . . . 0.0 109.725 -178.455 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.434 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 45.3 mt-10 -54.59 -46.77 73.82 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 114.547 -1.206 . . . . 0.0 110.402 179.442 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.58 -52.12 67.03 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.323 1.049 . . . . 0.0 111.729 -178.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.94 -24.31 67.48 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 178.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 50.5 t -77.09 -42.35 31.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.414 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 19.6 mm-40 -66.67 -28.39 68.42 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 114.604 -1.18 . . . . 0.0 110.344 175.24 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -80.18 -25.08 39.89 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.211 1.005 . . . . 0.0 111.923 176.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.96 32.74 7.74 Favored Glycine 0 C--N 1.344 0.999 0 N-CA-C 114.264 0.466 . . . . 0.0 114.264 170.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -102.4 163.48 12.21 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 117.36 0.58 . . . . 0.0 109.592 168.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.589 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 41.0 tt0 -73.66 124.97 26.99 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 106.502 -1.666 . . . . 0.0 106.502 158.509 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.521 HG23 ' HA ' ' A' ' 26' ' ' GLU . 13.5 p -111.27 137.32 44.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 CA-C-N 118.635 0.652 . . . . 0.0 110.72 -174.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 45.0 tptt -148.21 111.77 5.02 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 178.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.549 HG12 ' HB1' ' A' ' 7' ' ' ALA . 48.9 mt -116.94 110.63 31.98 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 122.602 0.361 . . . . 0.0 111.891 -173.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -77.92 115.25 17.52 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 123.238 0.615 . . . . 0.0 109.658 176.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 7.0 p -95.76 108.09 20.38 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.938 177.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.551 ' HG2' HG12 ' A' ' 46' ' ' ILE . 42.2 mt-30 -100.97 154.02 19.04 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.256 0.623 . . . . 0.0 110.679 176.2 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -171.08 -178.39 41.56 Favored Glycine 0 C--O 1.238 0.379 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.617 178.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.34 -26.05 66.3 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.089 0.556 . . . . 0.0 111.327 178.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -65.8 -39.41 90.91 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.495 0.718 . . . . 0.0 110.117 171.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 142.18 -151.99 23.32 Favored Glycine 0 C--N 1.341 0.852 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.969 -178.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.551 HG12 ' HG2' ' A' ' 41' ' ' GLN . 65.2 mt -113.21 145.25 19.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 123.683 0.793 . . . . 0.0 110.067 -174.112 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -140.01 149.28 43.02 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.865 0.866 . . . . 0.0 110.137 -179.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 44.1 t30 79.1 -49.94 0.43 Allowed 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 126.487 1.915 . . . . 0.0 110.043 178.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 21.7 tpp180 66.86 122.82 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.869 1.667 . . . . 0.0 113.339 169.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.5 HD12 HD13 ' A' ' 6' ' ' ILE . 39.4 mt -92.31 146.41 23.72 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 114.772 -1.104 . . . . 0.0 110.55 172.481 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.418 ' O ' HG13 ' A' ' 55' ' ' ILE . 66.4 p -105.12 166.63 10.26 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.744 0.818 . . . . 0.0 109.693 176.478 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.06 -29.49 69.77 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 122.931 0.492 . . . . 0.0 110.562 176.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -72.27 -41.14 67.06 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.43 177.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -59.5 -43.49 93.34 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 122.836 0.454 . . . . 0.0 110.927 177.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.618 HG22 ' HG3' ' A' ' 78' ' ' ARG . 23.1 mt -74.38 -32.32 30.62 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 O-C-N 123.961 0.788 . . . . 0.0 110.891 -176.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.57 -41.5 62.83 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.434 0.694 . . . . 0.0 111.619 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -91.27 -3.04 57.26 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.554 0.742 . . . . 0.0 111.398 -177.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.55 106.22 1.11 Allowed 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 122.948 0.499 . . . . 0.0 110.437 176.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 27.7 m -60.26 -36.92 78.9 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.846 0.858 . . . . 0.0 109.44 169.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 72.8 mt -137.27 143.35 34.68 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 123.904 0.882 . . . . 0.0 110.315 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.502 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 26.3 mt -127.81 135.64 62.48 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 171.46 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -124.12 111.16 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 CA-C-N 118.405 0.548 . . . . 0.0 109.526 173.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 12.1 m170 -88.24 85.28 6.89 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-O 121.586 0.708 . . . . 0.0 109.524 174.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.516 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 25.0 m -81.01 82.64 6.92 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.542 176.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 29.5 m -125.93 155.78 35.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 CA-C-O 121.965 0.888 . . . . 0.0 112.209 -170.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -107.87 -25.07 11.39 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 113.91 -1.496 . . . . 0.0 109.365 175.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 15.0 m -131.4 171.15 18.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 125.328 1.451 . . . . 0.0 108.664 176.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 22.1 m -64.72 116.87 32.85 Favored Pre-proline 0 CA--C 1.55 0.974 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 171.533 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.43 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 37.0 Cg_endo -66.71 145.56 75.91 Favored 'Trans proline' 0 C--N 1.372 1.773 0 C-N-CA 121.506 1.471 . . . . 0.0 110.388 174.393 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 -64.52 -28.98 70.02 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.241 0.616 . . . . 0.0 111.406 -176.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.577 ' HB3' HH11 ' A' ' 74' ' ' ARG . 0.9 OUTLIER -103.17 18.24 22.19 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.468 1.107 . . . . 0.0 111.616 -173.901 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.43 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 6.7 p30 -56.65 -32.4 65.32 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 124.385 1.074 . . . . 0.0 113.018 -175.274 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.424 ' HA ' ' HB2' ' A' ' 76' ' ' GLU . 2.1 pp20? -76.38 -18.16 59.01 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.704 0.802 . . . . 0.0 112.515 -171.17 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.577 HH11 ' HB3' ' A' ' 71' ' ' ASP . 41.0 mtp180 -67.4 -26.68 66.55 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.018 0.927 . . . . 0.0 111.312 174.063 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -104.01 -4.36 23.43 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 114.463 -1.244 . . . . 0.0 111.017 -176.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.424 ' HB2' ' HA ' ' A' ' 73' ' ' GLU . 37.9 tt0 -61.96 -32.2 72.61 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 124.579 1.152 . . . . 0.0 112.474 -173.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 32.0 t -92.13 3.91 54.29 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.392 0.677 . . . . 0.0 111.836 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.618 ' HG3' HG22 ' A' ' 55' ' ' ILE . 39.8 mmt180 -117.61 166.3 12.56 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.718 0.807 . . . . 0.0 111.446 -177.036 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -79.35 94.24 5.46 Favored 'General case' 0 C--O 1.244 0.789 0 C-N-CA 123.675 0.79 . . . . 0.0 110.673 -177.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.502 ' HA ' ' HB ' ' A' ' 61' ' ' ILE . 60.8 t -104.97 141.35 20.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 124.151 0.98 . . . . 0.0 110.727 -178.369 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -114.52 88.71 2.92 Favored 'General case' 0 C--O 1.24 0.553 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 174.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -84.59 120.97 26.97 Favored 'General case' 0 C--N 1.346 0.442 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.363 -174.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.432 HD12 ' HB3' ' A' ' 87' ' ' ASP . 48.5 pt -125.24 -179.33 2.35 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 124.434 1.094 . . . . 0.0 109.466 177.491 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 24.1 p -76.83 148.22 36.68 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.533 168.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.501 HD11 ' HB2' ' A' ' 11' ' ' CYS . 4.7 tt -62.51 -28.64 69.98 Favored 'General case' 0 N--CA 1.481 1.098 0 O-C-N 124.046 0.841 . . . . 0.0 111.27 179.47 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -64.3 -44.92 90.14 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.285 0.634 . . . . 0.0 111.266 176.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.432 ' HB3' HD12 ' A' ' 83' ' ' ILE . 24.3 t70 -59.98 -31.47 69.94 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.542 0.737 . . . . 0.0 110.649 -177.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.19 -26.61 64.92 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.943 0.897 . . . . 0.0 112.922 179.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 57.0 mt -85.24 -40.1 14.55 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.964 0 C-N-CA 123.111 0.564 . . . . 0.0 110.459 -179.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.41 ' HZ1' ' HB3' ' A' ' 90' ' ' LYS . 0.1 OUTLIER -88.44 -56.1 3.45 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 122.793 0.437 . . . . 0.0 111.795 -176.625 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -95.46 20.53 9.35 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.843 0.857 . . . . 0.0 110.959 -170.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.455 ' HA ' HD12 ' A' ' 95' ' ' ILE . . . -43.22 -62.34 1.08 Allowed 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 124.607 1.163 . . . . 0.0 114.132 -172.575 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.21 -34.59 75.35 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.028 178.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.07 -43.04 99.38 Favored Glycine 0 C--N 1.351 1.407 0 O-C-N 124.495 1.122 . . . . 0.0 112.758 178.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.455 HD12 ' HA ' ' A' ' 92' ' ' ALA . 22.2 mt -62.37 -57.96 9.71 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 C-N-CA 124.185 0.994 . . . . 0.0 109.973 -177.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.403 HG13 HD11 ' A' ' 5' ' ' LEU . 2.0 mp -58.4 -45.71 89.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 O-C-N 124.093 0.87 . . . . 0.0 110.608 -175.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 2.5 pptp? -69.72 -27.62 65.13 Favored 'General case' 0 N--CA 1.48 1.047 0 O-C-N 123.605 0.565 . . . . 0.0 111.556 -177.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 38.9 mm-40 -62.91 -42.55 99.83 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 174.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 13.1 mt -78.43 -33.36 17.22 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.387 -175.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -54.79 -53.69 51.87 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.604 1.162 . . . . 0.0 111.281 171.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -72.16 -33.77 67.97 Favored 'General case' 0 N--CA 1.48 1.064 0 O-C-N 123.594 0.559 . . . . 0.0 111.25 -175.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 71.1 mtm -64.29 -49.3 72.34 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 122.937 0.495 . . . . 0.0 110.592 177.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 36.8 mt -67.05 -42.16 88.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 C-N-CA 123.232 0.613 . . . . 0.0 110.302 177.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.88 -12.56 61.61 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 122.925 0.49 . . . . 0.0 111.843 -179.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 29.9 t -92.4 -39.71 11.28 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 122.609 0.364 . . . . 0.0 110.804 176.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -78.71 -28.18 45.07 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.757 0.423 . . . . 0.0 111.458 -177.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.7 mm-40 -84.35 -41.33 16.87 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.175 0.59 . . . . 0.0 109.876 178.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 76.3 mm-40 . . . . . 0 C--O 1.255 1.35 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.632 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.9 mtt . . . . . 0 N--CA 1.48 1.049 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.7 t -72.13 90.96 1.23 Allowed 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 176.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.622 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 13.4 pttt -65.96 174.25 2.57 Favored 'General case' 0 C--O 1.247 0.962 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.179 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.515 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.2 tmtp? -142.96 142.48 31.66 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 121.102 0.477 . . . . 0.0 109.81 -171.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.476 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.0 tt -131.34 136.17 47.86 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 176.084 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.422 HG23 ' HE2' ' A' ' 4' ' ' LYS . 17.1 pt -126.72 159.1 36.76 Favored 'Isoleucine or valine' 0 C--O 1.239 0.509 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 170.306 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.563 ' HB2' HG12 ' A' ' 38' ' ' ILE . . . -145.28 168.91 19.32 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 176.534 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.417 HD23 ' OE1' ' A' ' 41' ' ' GLN . 4.3 tt -144.88 112.09 6.02 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 -176.915 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.509 ' HA ' ' O ' ' A' ' 64' ' ' SER . 49.9 m -101.25 109.65 21.54 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.068 0.947 . . . . 0.0 109.12 176.385 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -127.47 115.81 19.46 Favored 'General case' 0 N--CA 1.489 1.513 0 CA-C-O 120.839 0.352 . . . . 0.0 110.674 -178.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.535 ' HB2' HD12 ' A' ' 85' ' ' LEU . 44.0 t -123.43 142.93 40.06 Favored Pre-proline 0 N--CA 1.476 0.855 0 C-N-CA 123.926 0.89 . . . . 0.0 110.247 -176.501 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.502 ' HD2' ' HG ' ' A' ' 11' ' ' CYS . 71.8 Cg_endo -72.58 -16.64 26.97 Favored 'Trans proline' 0 C--N 1.37 1.687 0 C-N-CA 122.938 2.425 . . . . 0.0 113.093 174.404 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 82.8 mtp -72.67 -54.91 7.72 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.393 0.677 . . . . 0.0 111.078 -179.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 161.3 -177.76 37.5 Favored Glycine 0 C--N 1.342 0.875 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.845 -175.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 39.9 mt -75.19 -14.44 60.54 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -177.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.41 -49.73 76.42 Favored 'General case' 0 C--O 1.249 1.066 0 CA-C-O 121.337 0.589 . . . . 0.0 111.086 177.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.474 ' HA ' ' HE2' ' A' ' 20' ' ' MET . 5.8 t-160 -64.98 -40.24 94.67 Favored 'General case' 0 C--O 1.248 1.004 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.224 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 32.7 p -67.3 -36.43 81.49 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.307 -178.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.8 m-30 -69.26 -32.84 72.31 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.127 0.571 . . . . 0.0 111.453 -178.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' MET . . . . . 0.474 ' HE2' ' HA ' ' A' ' 17' ' ' HIS . 62.5 mtm -67.93 -38.2 82.58 Favored 'General case' 0 N--CA 1.483 1.175 0 O-C-N 123.175 0.297 . . . . 0.0 110.81 175.76 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -69.7 -40.53 76.26 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.364 174.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.7 -37.1 81.81 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.899 0.88 . . . . 0.0 110.562 -178.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.473 ' O ' ' HG3' ' A' ' 27' ' ' GLU . 32.6 tt0 -62.52 -53.01 61.14 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.846 175.661 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.75 -47.5 77.98 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 115.587 -0.733 . . . . 0.0 112.183 -173.074 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 85.1 mt -64.43 -34.46 78.25 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.07 0.548 . . . . 0.0 111.431 178.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.479 ' O ' HG22 ' A' ' 30' ' ' VAL . 38.3 tt0 -61.92 -54.76 37.5 Favored 'General case' 0 C--N 1.349 0.578 0 O-C-N 123.686 0.616 . . . . 0.0 109.894 177.618 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.554 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 44.9 mt-10 -49.42 -52.12 30.78 Favored 'General case' 0 N--CA 1.48 1.048 0 O-C-N 124.632 1.207 . . . . 0.0 110.73 179.54 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.451 ' HB2' ' HA ' ' A' ' 93' ' ' ALA . . . -56.18 -52.05 65.81 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.807 1.243 . . . . 0.0 112.098 -179.664 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.38 -22.52 66.25 Favored 'General case' 0 CA--C 1.55 0.947 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 179.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.479 HG22 ' O ' ' A' ' 26' ' ' GLU . 55.8 t -76.25 -37.5 32.08 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.256 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 178.597 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.554 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 16.2 mm-40 -76.48 -19.89 57.55 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 114.725 -1.125 . . . . 0.0 110.475 178.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -78.44 -19.0 54.11 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.672 0.789 . . . . 0.0 111.198 172.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 97.01 1.24 59.75 Favored Glycine 0 C--N 1.349 1.263 0 N-CA-C 115.2 0.84 . . . . 0.0 115.2 165.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.622 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -108.24 173.58 6.26 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-N 117.85 0.825 . . . . 0.0 112.089 176.255 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.515 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 34.2 tt0 -71.07 145.91 49.6 Favored 'General case' 0 C--N 1.35 0.612 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.656 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.476 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 7.4 p -135.34 128.64 48.72 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 122.741 0.416 . . . . 0.0 111.165 -179.566 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.5 tptt -135.75 115.55 13.02 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 176.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.563 HG12 ' HB2' ' A' ' 7' ' ' ALA . 49.3 mt -117.09 113.42 42.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 N-CA-C 111.995 0.369 . . . . 0.0 111.995 -176.16 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -75.62 147.81 39.25 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.894 0.878 . . . . 0.0 109.221 171.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.424 HG23 ' HB2' ' A' ' 9' ' ' CYS . 13.6 p -134.57 123.93 24.65 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.156 0.983 . . . . 0.0 109.208 -176.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.455 ' HG2' HG22 ' A' ' 46' ' ' ILE . 23.7 mt-30 -125.62 136.5 53.33 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 -176.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -163.59 -160.42 11.58 Favored Glycine 0 N--CA 1.465 0.605 0 C-N-CA 121.851 -0.214 . . . . 0.0 112.677 -179.1 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.91 -28.77 69.16 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.957 0.903 . . . . 0.0 111.787 177.235 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -86.27 2.35 47.54 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.021 0.928 . . . . 0.0 111.51 -178.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 94.22 -157.48 22.65 Favored Glycine 0 C--N 1.34 0.773 0 N-CA-C 112.134 -0.386 . . . . 0.0 112.134 -176.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.455 HG22 ' HG2' ' A' ' 41' ' ' GLN . 40.8 mt -106.44 144.86 14.94 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 C-N-CA 123.601 0.76 . . . . 0.0 110.306 -172.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -143.02 148.12 36.23 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.005 1.322 . . . . 0.0 108.822 -174.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 10.1 t30 58.86 40.96 22.14 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 124.362 1.065 . . . . 0.0 110.517 175.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 9.5 tpp180 -47.35 133.28 12.62 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.763 1.625 . . . . 0.0 113.069 -172.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 47.5 mt -83.35 126.75 33.03 Favored 'General case' 0 C--O 1.242 0.693 0 C-N-CA 123.879 0.872 . . . . 0.0 110.383 173.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.415 ' O ' HG13 ' A' ' 55' ' ' ILE . 37.0 p -88.79 164.5 15.21 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.664 178.323 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.74 -30.37 67.45 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.148 0.579 . . . . 0.0 110.963 175.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.415 ' O ' ' HG3' ' A' ' 57' ' ' GLU . 29.2 tt0 -66.91 -48.48 68.57 Favored 'General case' 0 C--N 1.355 0.819 0 C-N-CA 122.972 0.509 . . . . 0.0 110.57 175.36 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -50.84 -44.96 59.47 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 123.504 0.721 . . . . 0.0 111.355 177.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 51' ' ' THR . 26.4 mt -72.5 -35.68 51.99 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.051 0 CA-C-N 114.449 -1.25 . . . . 0.0 111.107 -177.152 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.45 -37.17 77.22 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.49 0.716 . . . . 0.0 111.172 179.41 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.415 ' HG3' ' O ' ' A' ' 53' ' ' GLN . 57.6 mt-10 -75.13 -33.46 61.57 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.746 0.818 . . . . 0.0 110.773 177.723 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -54.93 99.81 0.03 OUTLIER 'General case' 0 C--N 1.355 0.81 0 O-C-N 124.699 1.249 . . . . 0.0 112.315 -172.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 23.8 m -63.19 -32.9 74.4 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-N 114.531 -1.213 . . . . 0.0 109.241 168.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.454 HG23 HG22 ' A' ' 99' ' ' ILE . 81.5 mt -133.71 139.04 49.6 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 C-N-CA 124.367 1.067 . . . . 0.0 109.827 -179.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.6 mt -131.39 130.55 62.94 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 173.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.3 mp -116.25 126.09 73.58 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 172.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 14.8 m170 -99.98 86.09 3.19 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 167.271 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.509 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 20.0 p -80.41 81.87 6.57 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 114.633 -1.167 . . . . 0.0 108.94 174.363 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.4 ' O ' ' HA ' ' A' ' 84' ' ' THR . 29.8 m -129.87 165.05 30.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.225 -170.377 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -121.98 -14.83 7.95 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.445 1.098 . . . . 0.0 109.318 170.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 9.4 m -127.97 177.05 6.45 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 125.013 1.325 . . . . 0.0 109.516 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 37.2 m -75.9 118.47 71.34 Favored Pre-proline 0 CA--C 1.545 0.75 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 173.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.527 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 48.4 Cg_endo -65.97 146.81 83.63 Favored 'Trans proline' 0 C--N 1.373 1.82 0 C-N-CA 122.141 1.894 . . . . 0.0 111.18 175.239 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -65.33 -41.06 94.36 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.341 0.657 . . . . 0.0 110.624 -177.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -88.39 15.2 8.14 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 115.349 -0.841 . . . . 0.0 112.146 -175.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.527 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 6.0 p30 -55.69 -28.62 56.56 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 123.859 0.864 . . . . 0.0 112.041 -177.144 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.541 ' HG3' ' HG3' ' A' ' 74' ' ' ARG . 8.9 pt-20 -56.53 -37.22 70.18 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 124.694 1.198 . . . . 0.0 112.343 175.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.541 ' HG3' ' HG3' ' A' ' 73' ' ' GLU . 81.4 mtt85 -80.11 -17.05 53.61 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.815 1.246 . . . . 0.0 112.079 -176.713 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.472 ' HB3' HG23 ' A' ' 80' ' ' VAL . 66.6 m-85 -107.4 -2.68 20.31 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.574 0.749 . . . . 0.0 110.999 178.041 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -55.06 -49.04 72.62 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.494 1.118 . . . . 0.0 112.663 -172.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 81.0 p -91.6 0.51 57.49 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.127 0.571 . . . . 0.0 112.379 -176.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -104.62 161.52 14.06 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.276 0.63 . . . . 0.0 111.202 -170.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 -72.67 93.57 1.65 Allowed 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.355 0.662 . . . . 0.0 110.929 -175.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.472 HG23 ' HB3' ' A' ' 75' ' ' PHE . 44.2 t -116.85 133.01 64.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 123.206 0.602 . . . . 0.0 110.86 -175.077 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 66.1 m-85 -105.84 91.3 3.69 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.776 1.23 . . . . 0.0 108.553 177.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -78.88 110.12 13.78 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.611 0.764 . . . . 0.0 110.87 -175.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.434 HG13 ' HA ' ' A' ' 64' ' ' SER . 42.1 pt -117.31 -173.78 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 124.471 1.109 . . . . 0.0 109.561 176.043 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.4 ' HA ' ' O ' ' A' ' 65' ' ' VAL . 40.4 p -86.8 149.73 24.64 Favored 'General case' 0 C--O 1.239 0.539 0 CA-C-O 121.071 0.462 . . . . 0.0 110.376 170.449 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.535 HD12 ' HB2' ' A' ' 11' ' ' CYS . 7.2 tt -64.52 -30.61 71.64 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.779 177.149 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -64.47 -43.79 93.1 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.879 176.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -63.74 -28.84 70.16 Favored 'General case' 0 N--CA 1.479 1.015 0 O-C-N 123.516 0.51 . . . . 0.0 110.629 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.1 -32.89 74.82 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.739 0.816 . . . . 0.0 112.292 177.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 64.6 mt -79.96 -42.69 22.28 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.835 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.414 -177.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -85.85 -47.34 9.77 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -175.086 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -106.15 25.45 10.98 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 124.081 0.952 . . . . 0.0 110.736 -170.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -41.92 -60.79 1.29 Allowed 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 124.253 1.021 . . . . 0.0 113.372 -175.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.451 ' HA ' ' HB2' ' A' ' 28' ' ' ALA . . . -65.0 -34.1 77.64 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.602 -178.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.69 -45.8 93.6 Favored Glycine 0 C--N 1.346 1.103 0 O-C-N 124.183 0.927 . . . . 0.0 112.253 -178.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 22.6 mt -60.1 -57.09 13.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 124.445 1.098 . . . . 0.0 110.266 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.9 mp -56.42 -50.05 74.24 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 O-C-N 123.945 0.778 . . . . 0.0 110.846 -178.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.87 -27.98 67.14 Favored 'General case' 0 N--CA 1.485 1.298 0 O-C-N 123.389 0.431 . . . . 0.0 111.304 -176.245 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.414 ' O ' ' HG3' ' A' ' 102' ' ' MET . 48.4 mm-40 -65.65 -40.78 92.82 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.316 0.646 . . . . 0.0 109.896 175.365 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . 0.454 HG22 HG23 ' A' ' 60' ' ' ILE . 32.7 mt -75.83 -34.05 27.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 N-CA-C 109.152 -0.685 . . . . 0.0 109.152 -176.815 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -60.54 -50.34 73.92 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 114.419 -1.264 . . . . 0.0 111.147 174.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -72.19 -33.3 67.55 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 122.751 0.42 . . . . 0.0 110.969 -176.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.414 ' HG3' ' O ' ' A' ' 98' ' ' GLU . 69.3 mtm -63.63 -58.2 7.69 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 122.751 0.42 . . . . 0.0 110.148 177.689 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 63.4 mt -62.38 -41.29 91.17 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.929 0 O-C-N 123.893 0.746 . . . . 0.0 110.587 -179.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.22 -32.52 74.24 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 122.541 0.337 . . . . 0.0 111.562 179.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 38.5 t -73.52 -37.43 65.65 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-O 120.887 0.375 . . . . 0.0 110.717 -176.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -85.16 -25.77 27.23 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.808 -177.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -85.6 -40.17 16.53 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 122.811 0.444 . . . . 0.0 111.516 178.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 81.8 mm-40 . . . . . 0 CA--C 1.55 0.978 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 174.943 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.3 ttm . . . . . 0 N--CA 1.479 1.002 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.5 t -80.08 171.04 15.62 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.99 0.916 . . . . 0.0 110.245 174.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -101.08 -178.85 3.87 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.022 0.929 . . . . 0.0 110.782 -174.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.538 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 3.8 tmtp? -144.03 143.67 31.29 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -173.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.488 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.0 tt -134.56 142.18 46.9 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 177.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.44 HD11 ' HA ' ' A' ' 55' ' ' ILE . 21.6 pt -133.39 168.43 24.13 Favored 'Isoleucine or valine' 0 C--O 1.243 0.742 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 170.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.554 ' HB2' HG12 ' A' ' 38' ' ' ILE . . . -152.3 169.99 21.15 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.342 175.384 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.4 tt -140.24 112.19 7.57 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 106.811 -1.551 . . . . 0.0 106.811 178.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.491 ' HB2' HG21 ' A' ' 40' ' ' THR . 68.9 m -102.05 109.35 21.04 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 177.263 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.451 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -128.71 113.79 15.81 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 122.759 0.424 . . . . 0.0 111.273 -176.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.72 ' SG ' HD12 ' A' ' 85' ' ' LEU . 2.2 m -130.98 146.61 62.9 Favored Pre-proline 0 N--CA 1.474 0.727 0 C-N-CA 123.481 0.712 . . . . 0.0 110.111 174.038 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -88.39 15.76 2.01 Favored 'Trans proline' 0 C--N 1.37 1.694 0 C-N-CA 123.331 2.688 . . . . 0.0 111.427 175.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 16.9 tpt -138.27 76.13 1.56 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.455 1.102 . . . . 0.0 109.16 178.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.77 132.31 4.25 Favored Glycine 0 C--N 1.34 0.802 0 CA-C-N 115.123 -0.944 . . . . 0.0 114.186 167.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 22.4 mt -66.39 -22.45 66.24 Favored 'General case' 0 C--O 1.216 -0.707 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 163.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.21 -40.09 73.48 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.316 0.646 . . . . 0.0 110.921 171.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.492 ' ND1' HD23 ' A' ' 85' ' ' LEU . 4.5 t-80 -68.99 -45.13 71.39 Favored 'General case' 0 C--O 1.245 0.865 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 178.39 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 35.5 p -66.19 -30.0 70.38 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.798 -178.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -80.12 -27.21 39.18 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.181 0.593 . . . . 0.0 111.418 -178.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 66.6 mtm -66.7 -38.72 87.32 Favored 'General case' 0 N--CA 1.482 1.142 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 171.098 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -72.55 -40.15 66.92 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.518 176.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.61 -51.58 58.54 Favored 'General case' 0 C--O 1.217 -0.635 0 C-N-CA 123.851 0.86 . . . . 0.0 109.979 -177.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.426 HE21 ' HG2' ' A' ' 27' ' ' GLU . 23.8 tp60 -62.81 -38.89 92.49 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 123.766 0.666 . . . . 0.0 110.52 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.514 ' HB1' ' HB1' ' A' ' 92' ' ' ALA . . . -62.42 -53.43 54.94 Favored 'General case' 0 CA--C 1.551 1.013 0 O-C-N 123.642 0.589 . . . . 0.0 111.419 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 93.4 mt -66.47 -29.86 70.07 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 123.491 0.716 . . . . 0.0 111.295 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.52 ' HA ' HG21 ' A' ' 36' ' ' VAL . 38.4 tt0 -64.84 -54.73 26.51 Favored 'General case' 0 C--N 1.346 0.449 0 C-N-CA 123.581 0.753 . . . . 0.0 109.807 -179.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.475 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 12.7 mm-40 -55.21 -49.09 72.82 Favored 'General case' 0 N--CA 1.479 1.025 0 O-C-N 124.505 1.128 . . . . 0.0 110.355 178.64 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.426 ' HB1' ' HA ' ' A' ' 93' ' ' ALA . . . -56.78 -46.68 81.35 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.656 1.183 . . . . 0.0 111.795 -178.102 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.78 -28.96 68.05 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 115.147 -0.933 . . . . 0.0 112.681 177.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 26' ' ' GLU . 56.1 t -72.86 -37.35 54.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 179.148 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 9.1 mm-40 -72.21 -26.98 62.26 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.641 178.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.45 -32.85 72.05 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.294 0.638 . . . . 0.0 110.902 172.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 104.33 18.8 12.42 Favored Glycine 0 C--N 1.346 1.121 0 N-CA-C 114.606 0.602 . . . . 0.0 114.606 169.359 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -122.19 -179.85 4.3 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.174 0.59 . . . . 0.0 111.334 175.51 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.538 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 12.2 tp10 -73.31 152.53 40.91 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.093 178.448 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.52 HG21 ' HA ' ' A' ' 26' ' ' GLU . 7.3 p -142.45 128.41 17.81 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 C-N-CA 123.296 0.638 . . . . 0.0 110.796 178.897 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.8 tptt -136.87 114.82 11.4 Favored 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 176.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.554 HG12 ' HB2' ' A' ' 7' ' ' ALA . 50.6 mt -119.17 116.39 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 122.746 0.418 . . . . 0.0 111.786 -173.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -87.08 119.81 27.69 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.894 0.877 . . . . 0.0 110.024 175.467 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.491 HG21 ' HB2' ' A' ' 9' ' ' CYS . 26.7 p -99.71 109.21 21.68 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.679 0.792 . . . . 0.0 111.144 178.606 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.451 ' O ' ' HA ' ' A' ' 10' ' ' ALA . 46.4 mt-30 -96.93 139.4 33.02 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.425 0.69 . . . . 0.0 110.095 173.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -164.89 175.73 40.78 Favored Glycine 0 C--N 1.341 0.806 0 N-CA-C 111.882 -0.487 . . . . 0.0 111.882 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.85 -12.33 60.35 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 122.625 0.37 . . . . 0.0 111.504 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -77.71 -28.22 50.85 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.27 0.628 . . . . 0.0 110.147 171.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 143.26 -169.79 25.68 Favored Glycine 0 C--N 1.346 1.137 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.391 -177.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 64.5 mt -113.29 145.5 19.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 123.123 0.569 . . . . 0.0 109.465 176.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -142.86 151.31 40.94 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.349 0.659 . . . . 0.0 110.197 -176.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.432 ' HB3' ' O ' ' A' ' 38' ' ' ILE . 10.4 t30 58.74 45.88 15.05 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 125.017 1.327 . . . . 0.0 110.075 178.173 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.6 tpp180 -52.21 120.77 5.83 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.111 1.364 . . . . 0.0 112.16 -175.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 37.5 mt -64.11 146.12 54.75 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.276 1.03 . . . . 0.0 110.979 172.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 67.2 p -104.29 167.3 9.84 Favored 'General case' 0 C--O 1.244 0.77 0 C-N-CA 123.304 0.642 . . . . 0.0 110.145 175.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.99 -35.27 74.66 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.049 0.54 . . . . 0.0 110.321 174.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 -60.98 -51.84 67.54 Favored 'General case' 0 CA--C 1.546 0.81 0 CA-C-N 114.393 -1.276 . . . . 0.0 110.53 174.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 31.3 m-20 -53.67 -46.28 70.59 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 123.633 0.773 . . . . 0.0 112.261 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.544 HG23 ' HG3' ' A' ' 78' ' ' ARG . 23.0 mt -73.2 -31.01 32.81 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.078 0 O-C-N 123.834 0.708 . . . . 0.0 110.974 -175.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.64 -37.57 70.84 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.229 0.612 . . . . 0.0 111.103 177.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -77.33 -26.42 52.12 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.032 0.933 . . . . 0.0 111.118 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -56.93 99.65 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.063 0.945 . . . . 0.0 112.431 -175.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 27.4 m -63.56 -37.9 89.09 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 115.156 -0.929 . . . . 0.0 108.901 168.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.488 HG23 HG21 ' A' ' 99' ' ' ILE . 80.5 mt -128.45 140.71 48.48 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.767 179.369 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.448 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 33.2 mt -131.3 137.23 56.02 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 173.006 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.2 mp -123.29 112.84 35.2 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 173.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 9.9 m170 -89.91 84.03 6.19 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-O 121.815 0.817 . . . . 0.0 108.972 171.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.449 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 23.4 p -83.27 84.58 7.44 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 114.302 -1.317 . . . . 0.0 108.926 177.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.402 ' O ' ' HA ' ' A' ' 84' ' ' THR . 34.6 m -127.88 163.61 31.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 121.535 0.684 . . . . 0.0 111.988 -170.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -113.67 -28.78 7.34 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.761 1.224 . . . . 0.0 108.98 174.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 12.9 m -124.18 162.67 25.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 125.18 1.392 . . . . 0.0 108.591 176.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 55.4 m -68.67 116.52 41.56 Favored Pre-proline 0 CA--C 1.549 0.912 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 174.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.558 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 31.1 Cg_endo -64.35 150.43 88.29 Favored 'Trans proline' 0 C--N 1.375 1.97 0 C-N-CA 122.466 2.111 . . . . 0.0 112.081 178.346 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -67.45 -30.95 70.81 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.589 0.756 . . . . 0.0 110.261 178.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.51 ' HB3' ' HD3' ' A' ' 74' ' ' ARG . 3.8 m-20 -94.13 12.73 25.51 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 114.42 -1.264 . . . . 0.0 112.162 -174.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.558 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 59.5 t30 -60.22 -35.29 75.1 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.097 0.959 . . . . 0.0 112.471 -174.695 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.96 -17.86 62.04 Favored 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -175.651 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.51 ' HD3' ' HB3' ' A' ' 71' ' ' ASP . 58.3 mtp180 -64.41 -25.96 68.25 Favored 'General case' 0 N--CA 1.485 1.304 0 CA-C-O 121.427 0.632 . . . . 0.0 111.631 174.525 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -100.69 17.85 20.84 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.652 1.181 . . . . 0.0 110.556 -175.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -50.18 -52.09 38.39 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 125.356 1.462 . . . . 0.0 113.105 -174.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 21.6 t -99.41 5.62 46.27 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.409 0.683 . . . . 0.0 112.082 -171.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.544 ' HG3' HG23 ' A' ' 55' ' ' ILE . 34.7 mmt180 -106.18 145.78 31.09 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.473 0.709 . . . . 0.0 111.063 -173.34 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -68.65 99.58 1.02 Allowed 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.718 0.807 . . . . 0.0 110.923 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.448 ' HA ' ' HB ' ' A' ' 61' ' ' ILE . 57.5 t -109.69 128.25 65.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 123.515 0.726 . . . . 0.0 110.322 -178.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 73.3 m-85 -98.25 92.51 5.75 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 124.423 1.089 . . . . 0.0 108.16 174.363 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -85.76 129.86 34.71 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.473 -175.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.439 HG13 ' HA ' ' A' ' 64' ' ' SER . 41.7 pt -137.45 -172.78 0.78 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.844 0 C-N-CA 124.926 1.29 . . . . 0.0 108.86 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.402 ' HA ' ' O ' ' A' ' 65' ' ' VAL . 26.2 p -84.98 149.98 25.23 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.061 0.458 . . . . 0.0 109.969 167.531 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.72 HD12 ' SG ' ' A' ' 11' ' ' CYS . 8.2 tt -65.42 -29.04 69.68 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.578 177.639 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.475 ' HG2' ' HE3' ' A' ' 90' ' ' LYS . 35.7 tt0 -59.99 -46.06 90.71 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.638 173.703 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -62.41 -32.67 73.54 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.327 0.651 . . . . 0.0 110.633 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.37 -32.64 74.12 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.584 0.754 . . . . 0.0 112.365 176.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 94.3 mt -78.21 -50.72 18.93 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 123.491 0.716 . . . . 0.0 110.713 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.475 ' HE3' ' HG2' ' A' ' 86' ' ' GLN . 18.6 ptpt -82.56 -33.36 28.14 Favored 'General case' 0 N--CA 1.484 1.26 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -172.126 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -120.5 22.99 11.06 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.896 0.879 . . . . 0.0 110.442 -168.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.514 ' HB1' ' HB1' ' A' ' 24' ' ' ALA . . . -42.33 -60.28 1.54 Allowed 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 124.353 1.061 . . . . 0.0 113.428 -174.575 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.426 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . . . -63.42 -36.96 85.45 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.072 -179.782 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -62.13 -47.55 89.06 Favored Glycine 0 C--N 1.355 1.618 0 O-C-N 124.479 1.112 . . . . 0.0 112.078 -177.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.412 ' O ' HG13 ' A' ' 99' ' ' ILE . 23.2 mt -55.79 -58.66 4.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 124.598 1.159 . . . . 0.0 110.333 177.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.8 mp -55.25 -51.3 57.14 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 O-C-N 124.246 0.966 . . . . 0.0 111.043 -177.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.74 -29.53 68.78 Favored 'General case' 0 N--CA 1.486 1.357 0 O-C-N 123.417 0.448 . . . . 0.0 112.163 -175.357 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 59.7 mm-40 -71.25 -32.41 68.72 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.153 0.581 . . . . 0.0 110.381 177.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . 0.488 HG21 HG23 ' A' ' 60' ' ' ILE . 48.0 mt -78.22 -36.23 20.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.33 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -57.86 -48.48 79.66 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 114.446 -1.252 . . . . 0.0 111.275 177.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -74.22 -34.93 63.83 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 123.92 0.762 . . . . 0.0 111.44 -178.173 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 64.5 mtm -64.58 -50.82 65.74 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 122.679 0.392 . . . . 0.0 110.615 178.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 39.2 mt -66.41 -42.45 90.47 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.383 178.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.24 -28.23 69.21 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 117.683 0.22 . . . . 0.0 111.049 178.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 36.8 t -75.03 -41.52 59.1 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 122.044 -0.41 . . . . 0.0 110.364 -178.136 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -78.56 -34.77 46.77 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 122.84 0.456 . . . . 0.0 111.469 -177.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 14.3 mm-40 -82.67 -43.37 16.99 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.072 0.549 . . . . 0.0 111.81 -174.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 . . . . . 0 CA--C 1.554 1.112 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 177.546 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.2 mtt . . . . . 0 N--CA 1.484 1.245 0 N-CA-C 109.919 -0.401 . . . . 0.0 109.919 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 55.8 p -78.92 82.55 5.1 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-O 121.616 0.722 . . . . 0.0 110.543 -179.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.525 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 4.7 pttt -66.18 -174.42 0.26 Allowed 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.915 0.886 . . . . 0.0 110.669 172.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.53 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 5.0 tmtp? -143.71 144.2 31.75 Favored 'General case' 0 N--CA 1.481 1.091 0 CA-C-O 121.454 0.645 . . . . 0.0 110.66 -175.099 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.489 ' N ' ' HD3' ' A' ' 4' ' ' LYS . 8.8 tt -130.8 135.67 47.97 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 125.246 1.418 . . . . 0.0 107.902 175.04 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.432 HG13 HG21 ' A' ' 61' ' ' ILE . 20.3 pt -126.1 161.94 30.7 Favored 'Isoleucine or valine' 0 C--O 1.242 0.693 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 171.656 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.571 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -148.94 166.61 28.09 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 122.96 0.504 . . . . 0.0 110.015 175.674 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.449 HD23 ' HG3' ' A' ' 41' ' ' GLN . 4.1 tt -136.58 123.38 21.24 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 178.268 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.546 ' HA ' ' O ' ' A' ' 64' ' ' SER . 78.0 m -112.51 112.63 24.31 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 123.61 0.764 . . . . 0.0 109.244 177.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.427 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -126.27 120.74 30.74 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 122.855 0.462 . . . . 0.0 111.547 -176.51 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.791 ' SG ' HD13 ' A' ' 85' ' ' LEU . 1.4 m -127.31 144.64 51.45 Favored Pre-proline 0 N--CA 1.485 1.323 0 C-N-CA 123.957 0.903 . . . . 0.0 111.45 -178.924 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -74.53 -23.61 14.7 Favored 'Trans proline' 0 C--N 1.379 2.176 0 C-N-CA 122.869 2.379 . . . . 0.0 113.161 177.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 76.9 mtm -76.11 -41.28 50.72 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 173.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 138.08 -156.03 23.65 Favored Glycine 0 C--N 1.347 1.173 0 N-CA-C 114.675 0.63 . . . . 0.0 114.675 172.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.3 mt -75.18 -18.48 60.16 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 114.783 1.401 . . . . 0.0 114.783 -164.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.98 -48.65 80.82 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-O 121.466 0.65 . . . . 0.0 110.761 178.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.523 ' HA ' ' HE1' ' A' ' 20' ' ' MET . 1.5 t-80 -66.18 -39.25 89.57 Favored 'General case' 0 C--O 1.246 0.868 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.264 -179.701 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 40.8 p -67.89 -36.34 80.07 Favored 'General case' 0 C--N 1.349 0.581 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.444 -175.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -72.49 -25.24 61.34 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 123.389 0.43 . . . . 0.0 111.616 178.329 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' MET . . . . . 0.523 ' HE1' ' HA ' ' A' ' 17' ' ' HIS . 56.3 mtm -63.08 -45.44 92.11 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-O 120.87 0.367 . . . . 0.0 110.055 170.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -69.72 -38.07 76.78 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.423 177.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.94 -43.09 84.11 Favored 'General case' 0 C--O 1.216 -0.682 0 C-N-CA 123.599 0.76 . . . . 0.0 110.735 -177.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.402 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 8.4 tp-100 -66.06 -42.2 89.79 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.064 0.546 . . . . 0.0 110.23 -179.558 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.03 -49.61 67.11 Favored 'General case' 0 CA--C 1.556 1.179 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.988 -178.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.425 HD13 ' OG ' ' A' ' 64' ' ' SER . 86.6 mt -66.52 -32.6 74.05 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.184 0.594 . . . . 0.0 111.789 178.595 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.5 ' HA ' HG21 ' A' ' 36' ' ' VAL . 46.0 tt0 -59.89 -53.54 56.72 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 123.907 0.754 . . . . 0.0 109.686 179.069 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.402 ' HG2' ' O ' ' A' ' 23' ' ' GLN . 30.4 mm-40 -54.07 -52.4 61.06 Favored 'General case' 0 N--CA 1.477 0.888 0 O-C-N 124.719 1.262 . . . . 0.0 110.834 178.707 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.401 ' HB1' ' HA ' ' A' ' 93' ' ' ALA . . . -56.15 -45.84 79.5 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.515 1.126 . . . . 0.0 112.109 -177.247 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.21 -29.71 67.73 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 115.364 -0.834 . . . . 0.0 113.063 177.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.438 HG21 ' O ' ' A' ' 26' ' ' GLU . 52.2 t -72.63 -38.55 59.16 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -71.79 -23.35 61.56 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 114.548 -1.205 . . . . 0.0 111.061 178.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.49 -22.31 59.14 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.411 0.684 . . . . 0.0 111.657 176.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 105.06 0.34 41.49 Favored Glycine 0 C--N 1.352 1.423 0 CA-C-O 119.555 -0.581 . . . . 0.0 114.512 171.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.525 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.1 OUTLIER -113.38 -179.87 3.76 Favored 'General case' 0 N--CA 1.485 1.319 0 CA-C-N 117.642 0.721 . . . . 0.0 111.901 177.427 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.53 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 38.2 tt0 -79.06 152.76 30.68 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.053 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.5 HG21 ' HA ' ' A' ' 26' ' ' GLU . 11.0 p -132.18 141.68 44.74 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 123.647 0.779 . . . . 0.0 110.548 177.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 49.1 tptt -147.22 119.52 8.37 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 172.012 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.571 HG12 ' HB3' ' A' ' 7' ' ' ALA . 47.9 mt -120.74 112.45 36.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 C-N-CA 122.938 0.495 . . . . 0.0 111.954 -175.43 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 46.5 tt0 -80.98 117.13 21.33 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.467 0.707 . . . . 0.0 109.423 174.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 21.7 p -98.87 115.74 29.53 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.814 0.845 . . . . 0.0 110.177 178.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.449 ' HG3' HD23 ' A' ' 8' ' ' LEU . 11.0 mt-30 -108.64 151.43 26.15 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.414 0.686 . . . . 0.0 109.917 175.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -172.81 -177.14 41.93 Favored Glycine 0 C--N 1.337 0.596 0 CA-C-N 116.73 -0.214 . . . . 0.0 112.872 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.69 -19.23 65.14 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.637 0.775 . . . . 0.0 112.527 -179.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -79.61 -31.74 41.71 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.623 0.769 . . . . 0.0 110.775 174.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 143.18 -158.71 27.31 Favored Glycine 0 C--N 1.339 0.738 0 N-CA-C 111.184 -0.766 . . . . 0.0 111.184 -176.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.407 HG23 ' HG2' ' A' ' 41' ' ' GLN . 30.0 mt -117.62 154.99 19.47 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 123.031 0.532 . . . . 0.0 109.963 179.541 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -149.8 152.62 35.49 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.198 0.999 . . . . 0.0 109.937 -179.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 18.8 t30 60.99 42.02 13.26 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 124.72 1.208 . . . . 0.0 109.89 176.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 10.1 tpt180 -54.68 121.59 8.83 Favored 'General case' 0 C--N 1.356 0.853 0 C-N-CA 125.098 1.359 . . . . 0.0 112.157 -169.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 44.4 mt -67.31 144.27 55.96 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.805 0.842 . . . . 0.0 110.118 172.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.432 ' O ' HG13 ' A' ' 55' ' ' ILE . 31.6 p -111.53 172.46 6.88 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.822 0.849 . . . . 0.0 109.392 177.053 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.44 -30.07 68.23 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 122.862 0.465 . . . . 0.0 111.381 176.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -64.33 -47.54 79.01 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.827 0.851 . . . . 0.0 110.814 176.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -59.74 -45.04 93.44 Favored 'General case' 0 N--CA 1.48 1.041 0 O-C-N 123.858 0.724 . . . . 0.0 111.028 179.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.536 HG21 ' HG3' ' A' ' 78' ' ' ARG . 26.7 mt -73.23 -28.87 26.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 C-N-CA 123.671 0.788 . . . . 0.0 111.017 -176.125 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -74.74 -49.04 22.47 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.249 0.62 . . . . 0.0 111.13 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -81.16 -9.34 59.82 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.407 0.683 . . . . 0.0 111.753 -176.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.59 101.15 0.17 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.521 0.729 . . . . 0.0 111.299 179.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 24.0 m -61.53 -38.03 85.93 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 115.021 -0.99 . . . . 0.0 109.102 168.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.498 HG21 HG23 ' A' ' 99' ' ' ILE . 73.1 mt -130.32 140.4 48.95 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.767 0 CA-C-N 114.819 -1.082 . . . . 0.0 110.174 -179.316 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.432 HG21 HG13 ' A' ' 6' ' ' ILE . 20.5 mt -133.01 131.56 58.88 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 C-N-CA 123.685 0.794 . . . . 0.0 109.098 172.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.0 mp -119.84 134.77 62.3 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 173.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 7.5 m170 -109.35 85.43 2.1 Favored 'General case' 0 N--CA 1.487 1.419 0 CA-C-N 118.931 0.787 . . . . 0.0 109.339 168.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.546 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 19.4 m -77.78 82.11 4.18 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 114.288 -1.324 . . . . 0.0 109.595 175.011 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.418 ' O ' ' HA ' ' A' ' 84' ' ' THR . 21.6 m -127.26 152.67 35.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 121.47 0.652 . . . . 0.0 111.313 -172.426 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -103.13 -29.02 11.59 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.315 1.046 . . . . 0.0 108.936 174.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 16.4 m -133.9 163.35 37.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 125.479 1.512 . . . . 0.0 108.447 177.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 26.3 m -64.72 117.59 39.78 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 122.942 0.497 . . . . 0.0 110.618 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.44 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 37.9 Cg_endo -67.6 148.81 78.94 Favored 'Trans proline' 0 C--N 1.374 1.874 0 C-N-CA 122.149 1.9 . . . . 0.0 111.079 175.037 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -63.51 -33.12 74.88 Favored 'General case' 0 N--CA 1.483 1.223 0 CA-C-O 121.242 0.544 . . . . 0.0 110.572 -179.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.491 ' HB3' ' HD3' ' A' ' 74' ' ' ARG . 1.3 m-20 -94.9 16.23 16.58 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.322 1.049 . . . . 0.0 112.357 -174.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.44 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 5.1 p30 -60.37 -36.08 77.2 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.256 0.622 . . . . 0.0 112.403 -174.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.64 -21.15 63.57 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.761 0.824 . . . . 0.0 112.945 -174.12 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.491 ' HD3' ' HB3' ' A' ' 71' ' ' ASP . 77.1 mtp180 -62.66 -42.89 99.86 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-O 122.215 1.007 . . . . 0.0 110.286 174.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -89.91 -17.97 27.01 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 113.72 -1.582 . . . . 0.0 111.04 -172.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -63.5 -27.38 69.23 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.311 0.645 . . . . 0.0 110.488 178.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 45.1 t -62.89 -34.73 78.04 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 124.071 0.948 . . . . 0.0 111.554 172.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.536 ' HG3' HG21 ' A' ' 55' ' ' ILE . 20.7 mmt180 -95.39 -175.98 3.64 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.329 1.052 . . . . 0.0 111.62 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -94.44 120.29 34.45 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.576 0.751 . . . . 0.0 109.826 173.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 62.1 t -130.42 148.49 33.13 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.163 0 C-N-CA 124.213 1.005 . . . . 0.0 110.296 -174.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -107.68 90.89 3.44 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.02 0.928 . . . . 0.0 109.342 173.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -75.68 111.52 11.1 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.42 0.688 . . . . 0.0 110.362 178.28 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.458 HG13 ' HA ' ' A' ' 64' ' ' SER . 44.2 pt -119.36 -175.53 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 124.489 1.116 . . . . 0.0 109.16 175.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.418 ' HA ' ' O ' ' A' ' 65' ' ' VAL . 22.0 p -83.2 148.14 27.62 Favored 'General case' 0 C--O 1.238 0.455 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 168.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.791 HD13 ' SG ' ' A' ' 11' ' ' CYS . 5.8 tt -62.41 -26.9 68.73 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.665 0.786 . . . . 0.0 111.482 178.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.512 ' HG2' ' HE3' ' A' ' 90' ' ' LYS . 33.7 tt0 -67.04 -40.62 87.2 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 123.795 0.838 . . . . 0.0 111.171 175.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.425 ' HB3' HD13 ' A' ' 83' ' ' ILE . 22.8 t70 -61.52 -29.84 70.25 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.456 0.702 . . . . 0.0 111.067 178.495 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -70.31 -18.52 63.1 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.715 0.806 . . . . 0.0 112.998 178.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 66.2 mt -95.91 -40.58 10.94 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.826 0 C-N-CA 123.518 0.727 . . . . 0.0 110.392 -179.258 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.512 ' HE3' ' HG2' ' A' ' 86' ' ' GLN . 18.1 ptpt -88.67 -31.05 18.7 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.196 0.598 . . . . 0.0 112.361 -175.044 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.442 HD21 HG13 ' A' ' 95' ' ' ILE . 6.0 t30 -126.58 26.78 6.23 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.374 0.669 . . . . 0.0 110.185 -170.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -49.15 -61.12 2.25 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.817 0.847 . . . . 0.0 113.026 -174.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.401 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . . . -59.24 -39.74 83.73 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.872 177.852 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -55.97 -47.38 80.29 Favored Glycine 0 C--N 1.353 1.517 0 O-C-N 124.886 1.366 . . . . 0.0 112.991 179.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.442 HG13 HD21 ' A' ' 91' ' ' ASN . 26.0 mt -58.32 -56.9 13.31 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 124.052 0.941 . . . . 0.0 110.053 -179.824 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.8 mp -57.25 -50.62 76.12 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.185 0 O-C-N 124.034 0.834 . . . . 0.0 111.42 -176.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.65 -29.73 70.34 Favored 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -176.751 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -66.71 -38.44 86.74 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.487 0.715 . . . . 0.0 110.236 177.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . 0.498 HG23 HG21 ' A' ' 60' ' ' ILE . 22.2 mt -77.92 -34.31 19.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 -177.669 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -61.14 -46.17 91.66 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.553 1.141 . . . . 0.0 111.821 177.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -74.53 -32.84 62.61 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 123.158 0.286 . . . . 0.0 111.465 -178.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 65.1 mtm -65.74 -45.57 82.11 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 122.638 0.375 . . . . 0.0 110.62 175.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 48.0 mt -65.93 -38.83 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 O-C-N 123.46 0.475 . . . . 0.0 109.938 176.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.36 -21.78 66.24 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.147 0.579 . . . . 0.0 111.371 177.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 44.6 t -88.58 -38.15 15.11 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 122.944 0.497 . . . . 0.0 111.199 -178.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -77.24 -25.48 51.61 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 122.396 0.278 . . . . 0.0 110.885 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 17.0 mm-40 -85.04 -50.24 7.62 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.02 0.528 . . . . 0.0 110.054 174.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 24.4 mm-40 . . . . . 0 CA--C 1.55 0.945 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 177.664 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 81.6 mtp . . . . . 0 N--CA 1.486 1.362 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.3 t -81.39 78.68 8.14 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 121.314 0.578 . . . . 0.0 110.216 -178.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 47.9 pttt -80.88 162.46 23.95 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 115.413 -0.812 . . . . 0.0 108.986 166.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.591 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.3 tmtp? -141.8 140.84 33.12 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 -172.873 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.472 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 10.1 tt -129.36 134.9 48.11 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 177.528 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.414 HD13 HD13 ' A' ' 50' ' ' LEU . 17.7 pt -128.01 165.17 27.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 173.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.565 ' HB2' HG12 ' A' ' 38' ' ' ILE . . . -152.48 169.08 23.48 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 122.775 0.43 . . . . 0.0 110.078 178.18 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.5 tt -139.73 114.28 9.25 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 -179.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.489 ' HA ' ' O ' ' A' ' 64' ' ' SER . 85.6 m -106.39 111.09 23.52 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 177.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.512 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -127.38 122.48 33.76 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 122.785 0.434 . . . . 0.0 111.235 -176.756 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.704 ' SG ' HD12 ' A' ' 85' ' ' LEU . 1.2 m -136.55 139.65 30.01 Favored Pre-proline 0 N--CA 1.474 0.74 0 C-N-CA 123.728 0.811 . . . . 0.0 109.878 176.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -75.91 -10.01 19.66 Favored 'Trans proline' 0 C--N 1.373 1.867 0 C-N-CA 122.856 2.371 . . . . 0.0 111.504 178.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 44.6 mtt -69.3 -56.97 5.98 Favored 'General case' 0 C--N 1.35 0.624 0 C-N-CA 124.93 1.292 . . . . 0.0 109.718 177.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 163.0 175.1 33.68 Favored Glycine 0 C--N 1.349 1.266 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.89 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 28.9 mt -69.89 -22.52 63.22 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.388 0.675 . . . . 0.0 112.759 -179.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -55.66 -44.65 77.45 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-O 120.956 0.408 . . . . 0.0 111.025 175.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -71.33 -36.5 71.57 Favored 'General case' 0 C--O 1.247 0.934 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.81 -178.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.408 ' HA ' HD11 ' A' ' 85' ' ' LEU . 44.8 p -70.97 -31.22 67.72 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.822 -178.396 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 -74.4 -28.13 60.95 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.298 0.639 . . . . 0.0 111.013 178.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 71.0 mtp -58.92 -51.26 70.81 Favored 'General case' 0 N--CA 1.483 1.189 0 CA-C-O 121.214 0.53 . . . . 0.0 109.838 169.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.01 -40.08 94.37 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.771 177.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.93 -37.11 78.7 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.876 0.87 . . . . 0.0 111.461 -176.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.417 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 8.4 tp-100 -64.5 -48.13 76.34 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.264 0.626 . . . . 0.0 109.715 178.273 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.11 -51.36 66.84 Favored 'General case' 0 CA--C 1.554 1.101 0 CA-C-N 115.221 -0.9 . . . . 0.0 111.934 -176.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 85.4 mt -63.91 -34.57 78.27 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.415 0.686 . . . . 0.0 112.048 -179.309 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.444 ' O ' HG21 ' A' ' 30' ' ' VAL . 39.0 tt0 -60.66 -56.72 17.9 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 123.979 0.799 . . . . 0.0 110.324 -179.022 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.469 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 21.3 mm-40 -56.96 -44.58 82.76 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 124.673 1.233 . . . . 0.0 111.196 -178.534 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.59 -49.45 77.42 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.839 0.855 . . . . 0.0 111.688 -179.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.15 -21.99 63.97 Favored 'General case' 0 CA--C 1.552 1.04 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 177.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.444 HG21 ' O ' ' A' ' 26' ' ' GLU . 42.3 t -73.61 -42.79 55.35 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.261 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 179.272 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 9.0 mm-40 -76.08 -20.3 57.82 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 114.559 -1.201 . . . . 0.0 110.814 -178.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -84.09 -14.6 50.0 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.719 0.808 . . . . 0.0 111.586 173.212 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 86.25 33.4 14.47 Favored Glycine 0 C--N 1.344 0.986 0 N-CA-C 114.792 0.677 . . . . 0.0 114.792 166.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -101.95 -179.19 3.93 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 117.781 0.791 . . . . 0.0 109.371 165.478 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.591 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 11.4 tp10 -87.71 132.31 34.17 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 156.618 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.472 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 8.7 p -117.47 135.74 56.88 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.27 0 CA-C-N 119.057 0.844 . . . . 0.0 110.667 -176.269 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.4 tptt -144.44 119.0 9.71 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.333 0.653 . . . . 0.0 109.278 177.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.565 HG12 ' HB2' ' A' ' 7' ' ' ALA . 46.6 mt -121.21 112.22 34.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 C-N-CA 123.082 0.553 . . . . 0.0 111.725 -173.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 49.0 tt0 -80.86 116.41 20.83 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.409 0.684 . . . . 0.0 110.115 175.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.423 ' HG1' ' HB3' ' A' ' 47' ' ' GLN . 22.6 p -97.26 114.31 26.04 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.841 0.856 . . . . 0.0 110.749 178.197 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.512 ' O ' ' HA ' ' A' ' 10' ' ' ALA . 45.7 mt-30 -105.09 137.27 43.11 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.918 0.887 . . . . 0.0 109.08 174.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -170.35 -165.84 28.33 Favored Glycine 0 C--N 1.345 1.041 0 C-N-CA 121.423 -0.417 . . . . 0.0 113.597 -177.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.99 -29.22 68.18 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.908 0.883 . . . . 0.0 112.601 -176.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -80.08 -11.25 59.78 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.283 0.633 . . . . 0.0 110.955 176.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 119.75 -157.35 15.57 Favored Glycine 0 C--N 1.345 1.075 0 N-CA-C 111.642 -0.583 . . . . 0.0 111.642 -179.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 55.4 mt -107.31 144.74 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 179.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.423 ' HB3' ' HG1' ' A' ' 40' ' ' THR . 9.0 tp-100 -145.7 150.42 36.24 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.944 0.898 . . . . 0.0 109.514 -174.439 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.6 t30 60.64 43.87 12.08 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.554 1.142 . . . . 0.0 110.058 177.119 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 19.9 tpp180 -53.37 124.2 14.08 Favored 'General case' 0 C--N 1.357 0.921 0 C-N-CA 124.863 1.265 . . . . 0.0 112.796 -173.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.457 ' HB2' HH22 ' A' ' 74' ' ' ARG . 51.4 mt -69.9 140.45 53.12 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 114.49 -1.232 . . . . 0.0 110.96 170.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 70.1 p -101.86 164.74 11.57 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.627 0.771 . . . . 0.0 109.76 178.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.59 -32.13 64.94 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 122.913 0.485 . . . . 0.0 110.744 173.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 44.8 tt0 -61.9 -53.65 52.84 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.96 0.904 . . . . 0.0 110.962 173.304 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -57.68 -41.06 80.8 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 123.257 0.623 . . . . 0.0 111.886 -177.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.54 HG21 ' HG3' ' A' ' 78' ' ' ARG . 55.0 mt -72.08 -31.32 39.52 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.125 0 C-N-CA 123.77 0.828 . . . . 0.0 110.962 -177.654 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.72 -45.19 53.72 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.362 0.665 . . . . 0.0 111.337 176.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -65.7 -32.92 74.74 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.159 0.984 . . . . 0.0 111.121 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -51.92 102.6 0.05 OUTLIER 'General case' 0 CA--C 1.543 0.693 0 O-C-N 124.857 1.348 . . . . 0.0 112.322 -174.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 29.0 m -61.25 -37.96 84.99 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.089 165.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 91.7 mt -137.05 139.52 44.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 124.255 1.022 . . . . 0.0 110.371 -176.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.445 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 23.5 mt -126.05 141.21 46.36 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 172.6 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.0 mp -129.52 111.92 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 CA-C-N 118.248 0.476 . . . . 0.0 109.827 174.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . 0.402 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 12.7 m170 -87.74 85.67 7.08 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-O 121.618 0.723 . . . . 0.0 110.021 174.204 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.489 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 19.6 m -82.87 83.22 7.84 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 114.605 -1.179 . . . . 0.0 109.7 176.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.422 ' O ' ' HA ' ' A' ' 84' ' ' THR . 31.3 m -129.17 158.76 41.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 CA-C-O 121.668 0.747 . . . . 0.0 112.487 -170.482 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -113.97 -14.66 12.42 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.116 1.366 . . . . 0.0 109.445 175.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.3 m -134.1 150.24 31.03 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 125.786 1.635 . . . . 0.0 107.94 174.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 50.0 m -64.12 111.39 5.34 Favored Pre-proline 0 CA--C 1.548 0.903 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 174.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.549 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 33.4 Cg_endo -62.79 148.43 93.42 Favored 'Trans proline' 0 C--N 1.38 2.187 0 C-N-CA 122.467 2.111 . . . . 0.0 112.223 -173.721 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -65.13 -32.46 74.16 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.645 -179.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -96.55 15.66 20.96 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 115.084 -0.962 . . . . 0.0 112.424 -175.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.549 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 51.6 t30 -58.16 -33.51 69.3 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 124.033 0.933 . . . . 0.0 112.137 -179.189 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.42 -23.54 65.55 Favored 'General case' 0 N--CA 1.485 1.283 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -175.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.457 HH22 ' HB2' ' A' ' 50' ' ' LEU . 40.7 mtp180 -64.51 -38.12 89.92 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.385 0.674 . . . . 0.0 112.021 174.44 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -91.13 -3.04 57.43 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-N 114.615 -1.175 . . . . 0.0 111.357 -174.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -60.46 -30.65 69.81 Favored 'General case' 0 CA--C 1.554 1.099 0 C-N-CA 124.471 1.108 . . . . 0.0 112.021 -176.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 52.7 p -74.95 -18.68 60.35 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 124.048 0.939 . . . . 0.0 112.802 179.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.54 ' HG3' HG21 ' A' ' 55' ' ' ILE . 19.9 mmt180 -116.7 168.62 10.04 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.594 0.757 . . . . 0.0 111.881 -166.173 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -76.95 102.65 6.5 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.719 0.808 . . . . 0.0 110.349 -178.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.445 ' HA ' ' HB ' ' A' ' 61' ' ' ILE . 58.1 t -112.75 129.28 68.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 123.427 0.691 . . . . 0.0 110.807 -177.47 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 -99.87 90.08 4.31 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.387 1.075 . . . . 0.0 108.41 176.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.402 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 47.3 mt-10 -79.29 126.87 31.35 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.953 -176.514 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.536 HD12 ' HB3' ' A' ' 87' ' ' ASP . 38.2 pt -140.91 -172.9 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 C-N-CA 125.278 1.431 . . . . 0.0 109.137 178.729 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.422 ' HA ' ' O ' ' A' ' 65' ' ' VAL . 34.4 p -85.21 153.89 22.33 Favored 'General case' 0 C--N 1.346 0.45 0 CA-C-O 121.071 0.463 . . . . 0.0 110.324 168.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.704 HD12 ' SG ' ' A' ' 11' ' ' CYS . 7.6 tt -63.99 -27.54 69.19 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.039 176.179 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.459 ' HG2' ' HE2' ' A' ' 90' ' ' LYS . 35.7 tt0 -64.34 -42.96 96.0 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.864 0.866 . . . . 0.0 111.48 176.226 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.536 ' HB3' HD12 ' A' ' 83' ' ' ILE . 30.1 t70 -62.12 -30.86 71.32 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.462 0.705 . . . . 0.0 111.131 -179.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.402 ' HB3' ' HB3' ' A' ' 64' ' ' SER . . . -67.46 -27.44 67.03 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.852 0.861 . . . . 0.0 112.885 178.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 37.6 mt -88.11 -45.96 15.83 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 C-N-CA 123.01 0.524 . . . . 0.0 109.996 -178.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.459 ' HE2' ' HG2' ' A' ' 86' ' ' GLN . 0.2 OUTLIER -78.82 -38.06 39.08 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 122.942 0.497 . . . . 0.0 112.089 -175.423 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -122.25 25.34 9.01 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.377 0.671 . . . . 0.0 110.56 -167.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.07 -59.37 3.18 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.401 0.68 . . . . 0.0 112.499 -176.186 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.06 -37.4 76.96 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 114.781 -1.1 . . . . 0.0 111.109 178.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.55 -50.7 60.03 Favored Glycine 0 C--N 1.354 1.548 0 O-C-N 124.578 1.174 . . . . 0.0 112.62 -178.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.421 ' O ' HG13 ' A' ' 99' ' ' ILE . 33.4 mt -54.38 -57.38 6.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 124.463 1.105 . . . . 0.0 110.126 -179.082 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.0 mp -56.8 -51.36 68.33 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.986 0 O-C-N 124.192 0.932 . . . . 0.0 111.021 -176.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.48 -28.12 68.32 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -176.838 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 35.7 mm-40 -70.91 -33.2 70.3 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.554 0.742 . . . . 0.0 110.652 178.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . 0.421 HG13 ' O ' ' A' ' 95' ' ' ILE . 19.4 mt -82.14 -33.19 11.38 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 178.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -57.0 -49.76 74.8 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.479 1.112 . . . . 0.0 111.091 174.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -74.12 -33.93 63.75 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 123.576 0.548 . . . . 0.0 111.7 -177.046 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 66.8 mtm -63.13 -53.55 51.76 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 122.173 0.189 . . . . 0.0 110.6 175.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 21.7 mt -64.57 -39.32 85.2 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 O-C-N 123.821 0.701 . . . . 0.0 110.674 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.82 -42.08 99.57 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 122.263 0.225 . . . . 0.0 110.833 178.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 14.8 t -69.78 -35.4 74.85 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 122.703 0.401 . . . . 0.0 111.166 -172.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -81.18 -28.69 34.86 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 122.811 0.444 . . . . 0.0 111.618 179.169 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -87.26 -21.78 25.59 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.078 0.551 . . . . 0.0 112.033 -178.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 . . . . . 0 N--CA 1.481 1.089 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 175.032 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.0 ttp . . . . . 0 N--CA 1.485 1.305 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.8 p -81.48 90.7 6.24 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-O 121.315 0.578 . . . . 0.0 109.545 177.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 37.8 pttt -95.91 170.46 9.28 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.516 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.569 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.2 tmtp? -142.42 134.49 27.36 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 -175.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.449 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.9 tt -127.08 136.82 52.69 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 179.091 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 19.6 pt -128.22 164.23 30.42 Favored 'Isoleucine or valine' 0 C--O 1.243 0.724 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 173.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.542 ' HB2' HG12 ' A' ' 38' ' ' ILE . . . -152.28 165.74 33.98 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.877 177.504 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.499 HD23 ' HG3' ' A' ' 41' ' ' GLN . 3.2 tt -137.34 109.95 7.51 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 -179.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.497 ' HA ' ' O ' ' A' ' 64' ' ' SER . 64.1 m -102.25 113.25 26.37 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 123.725 0.81 . . . . 0.0 108.966 177.472 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.418 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -129.01 124.08 34.01 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 122.703 0.401 . . . . 0.0 111.032 -176.887 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.724 ' SG ' HD12 ' A' ' 85' ' ' LEU . 1.3 m -144.17 148.88 43.13 Favored Pre-proline 0 N--CA 1.477 0.891 0 C-N-CA 123.753 0.821 . . . . 0.0 110.552 178.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -81.61 -7.16 12.62 Favored 'Trans proline' 0 C--N 1.373 1.863 0 C-N-CA 122.725 2.283 . . . . 0.0 111.411 176.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 55.0 mtt -70.52 -20.83 62.8 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.68 1.192 . . . . 0.0 110.991 177.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.17 -178.59 17.89 Favored Glycine 0 C--N 1.344 1.007 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.943 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 39.2 mt -72.33 -22.55 61.16 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 112.832 0.679 . . . . 0.0 112.832 -175.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.66 -43.53 93.91 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-N 118.484 0.584 . . . . 0.0 111.479 178.074 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.4 t-160 -70.07 -39.63 75.52 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.391 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.431 ' HA ' HD11 ' A' ' 85' ' ' LEU . 48.7 p -68.45 -28.08 66.73 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.419 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.1 m-30 -75.7 -28.23 58.55 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.599 0.76 . . . . 0.0 111.185 177.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' MET . . . . . 0.443 ' HE2' HD11 ' A' ' 89' ' ' ILE . 78.7 mtp -61.26 -46.14 91.59 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-O 121.303 0.573 . . . . 0.0 109.654 171.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.93 -38.05 69.93 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 114.888 -1.051 . . . . 0.0 111.507 178.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.23 -42.32 93.5 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.65 0.78 . . . . 0.0 110.837 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.404 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 24.2 tp60 -66.22 -43.49 86.52 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 122.812 0.445 . . . . 0.0 109.991 178.265 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.478 ' HB2' ' HB2' ' A' ' 92' ' ' ALA . . . -60.27 -56.53 20.42 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.912 -177.102 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.405 HD12 ' OG ' ' A' ' 64' ' ' SER . 96.6 mt -65.59 -30.49 71.23 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.789 0.835 . . . . 0.0 111.894 -179.275 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.505 ' HA ' HG23 ' A' ' 36' ' ' VAL . 35.5 tt0 -60.03 -55.37 34.77 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 123.733 0.646 . . . . 0.0 110.054 176.504 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.539 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 55.4 mm-40 -53.03 -51.12 62.72 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 124.513 1.133 . . . . 0.0 110.518 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.74 -49.8 72.1 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.454 1.102 . . . . 0.0 112.032 -177.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.94 -23.57 64.17 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 113.508 0.929 . . . . 0.0 113.508 177.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.48 HG21 ' O ' ' A' ' 26' ' ' GLU . 49.0 t -75.87 -43.23 39.75 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 -179.707 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.539 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 24.6 mm-40 -69.81 -33.36 72.24 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 114.486 -1.234 . . . . 0.0 110.134 179.32 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -77.35 -19.21 56.63 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.558 0.743 . . . . 0.0 111.707 176.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 89.67 39.16 6.32 Favored Glycine 0 C--N 1.342 0.861 0 N-CA-C 114.722 0.649 . . . . 0.0 114.722 166.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -104.53 170.27 7.99 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 165.197 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.569 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 45.4 tt0 -78.99 129.45 34.46 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 156.048 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.505 HG23 ' HA ' ' A' ' 26' ' ' GLU . 12.2 p -113.97 137.5 46.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 CA-C-N 118.336 0.516 . . . . 0.0 110.01 -175.626 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 47.8 tptt -144.38 113.33 6.8 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 177.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.542 HG12 ' HB2' ' A' ' 7' ' ' ALA . 61.3 mt -118.3 110.96 32.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 122.55 0.34 . . . . 0.0 111.418 -175.321 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -74.29 142.1 45.26 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 123.805 0.691 . . . . 0.0 109.136 171.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 14.0 p -128.0 117.55 21.9 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.745 0.818 . . . . 0.0 109.219 -176.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.499 ' HG3' HD23 ' A' ' 8' ' ' LEU . 8.2 mt-30 -110.17 128.85 55.7 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 178.428 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -152.79 -176.37 25.28 Favored Glycine 0 C--N 1.336 0.564 0 N-CA-C 112.113 -0.395 . . . . 0.0 112.113 -177.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.51 -27.67 69.43 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.711 0.805 . . . . 0.0 111.695 -179.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -72.57 -36.32 68.16 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.972 0.909 . . . . 0.0 110.751 177.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 146.64 -159.42 27.99 Favored Glycine 0 C--N 1.347 1.155 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.054 -177.052 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 76.1 mt -111.57 131.96 61.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 123.397 0.679 . . . . 0.0 109.58 178.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -128.29 150.47 50.04 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.458 1.103 . . . . 0.0 109.691 -177.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 17.0 t30 60.63 41.42 15.32 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 124.61 1.164 . . . . 0.0 110.259 176.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 18.7 tpp180 -47.35 125.39 8.01 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 125.496 1.519 . . . . 0.0 113.142 -174.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 42.2 mt -75.09 127.93 34.35 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.778 173.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 50.1 p -87.34 161.2 18.06 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.423 176.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -57.48 -29.63 64.41 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 122.971 0.509 . . . . 0.0 111.47 175.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -73.06 -37.1 66.95 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.648 0.779 . . . . 0.0 111.378 178.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -62.02 -40.83 97.04 Favored 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 110.332 -0.247 . . . . 0.0 110.332 174.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.557 HG21 ' HG3' ' A' ' 78' ' ' ARG . 31.9 mt -73.6 -30.04 28.43 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.991 0 O-C-N 124.206 0.941 . . . . 0.0 110.888 -178.891 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.97 -48.99 31.75 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.598 0.759 . . . . 0.0 111.173 179.303 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -84.23 -4.38 58.79 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.593 0.757 . . . . 0.0 112.025 -177.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.91 104.19 0.82 Allowed 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.912 0.387 . . . . 0.0 110.58 177.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 26.1 m -60.64 -37.66 82.23 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.226 167.353 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 73.0 mt -135.65 142.45 39.32 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 C-N-CA 123.527 0.731 . . . . 0.0 110.646 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 23.4 mt -129.17 135.79 61.09 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 C-N-CA 124.105 0.962 . . . . 0.0 108.446 171.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -125.82 112.69 31.44 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 C-N-CA 123.106 0.562 . . . . 0.0 109.586 174.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . 0.458 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 16.4 m170 -88.25 86.22 7.04 Favored 'General case' 0 N--CA 1.485 1.319 0 CA-C-N 118.833 0.742 . . . . 0.0 109.45 172.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.497 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 23.1 m -82.92 81.62 8.54 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-N 114.808 -1.087 . . . . 0.0 109.466 176.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 28.0 m -126.88 159.05 37.25 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-O 121.677 0.751 . . . . 0.0 112.252 -170.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -117.54 -21.57 8.52 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.106 1.362 . . . . 0.0 108.822 173.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 12.3 m -126.04 156.83 36.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 125.106 1.362 . . . . 0.0 108.197 175.203 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 38.7 m -65.79 118.29 50.23 Favored Pre-proline 0 CA--C 1.546 0.812 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 177.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.529 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 56.2 Cg_endo -69.49 146.38 61.67 Favored 'Trans proline' 0 C--N 1.373 1.839 0 C-N-CA 121.683 1.589 . . . . 0.0 110.705 175.385 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -62.69 -48.28 79.99 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-O 121.538 0.685 . . . . 0.0 111.196 -175.358 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -94.76 26.58 3.47 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 114.76 -1.109 . . . . 0.0 111.789 -170.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.529 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 6.5 p30 -60.19 -27.75 67.41 Favored 'General case' 0 CA--C 1.557 1.237 0 C-N-CA 124.616 1.166 . . . . 0.0 112.043 -178.557 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.98 -13.1 60.01 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.06 0.944 . . . . 0.0 112.809 -177.334 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -69.53 -23.28 63.57 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-O 121.34 0.591 . . . . 0.0 110.66 171.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -104.21 7.72 36.08 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 124.932 1.293 . . . . 0.0 110.563 -177.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -56.6 -52.47 64.72 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 124.883 1.273 . . . . 0.0 112.584 -171.069 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 48.4 t -86.79 -2.6 58.69 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.193 0.997 . . . . 0.0 112.046 -175.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.557 ' HG3' HG21 ' A' ' 55' ' ' ILE . 25.2 mmt180 -103.41 159.72 15.33 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.925 0.89 . . . . 0.0 110.12 -173.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -77.1 99.2 5.28 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-O 121.222 0.534 . . . . 0.0 111.211 -176.291 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 41.6 t -112.44 142.02 26.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 123.982 0.913 . . . . 0.0 110.501 -177.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -116.94 93.29 4.13 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.487 1.115 . . . . 0.0 108.656 177.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.458 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 42.1 mt-10 -81.81 114.53 20.5 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.598 -176.589 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.514 HD12 ' HB3' ' A' ' 87' ' ' ASP . 45.2 pt -125.46 -173.78 0.95 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.882 0 C-N-CA 124.704 1.201 . . . . 0.0 109.008 177.244 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 40.4 p -80.88 152.52 28.09 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-O 120.935 0.397 . . . . 0.0 110.0 168.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.724 HD12 ' SG ' ' A' ' 11' ' ' CYS . 6.7 tt -62.59 -26.09 68.42 Favored 'General case' 0 CA--C 1.551 1.012 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.724 173.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.57 ' HG2' ' HE2' ' A' ' 90' ' ' LYS . 34.6 tt0 -64.98 -45.6 84.97 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.733 0.813 . . . . 0.0 111.292 176.387 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.514 ' HB3' HD12 ' A' ' 83' ' ' ILE . 20.3 t70 -61.57 -30.71 70.84 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.375 0.67 . . . . 0.0 111.102 -178.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.97 -43.42 95.83 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.514 0.726 . . . . 0.0 111.794 175.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.443 HD11 ' HE2' ' A' ' 20' ' ' MET . 75.3 mt -68.45 -41.22 83.16 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.926 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.271 -177.164 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.57 ' HE2' ' HG2' ' A' ' 86' ' ' GLN . 0.2 OUTLIER -87.35 -53.22 4.95 Favored 'General case' 0 N--CA 1.485 1.299 0 CA-C-O 120.964 0.412 . . . . 0.0 111.938 -175.607 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -102.73 28.15 6.36 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.3 1.04 . . . . 0.0 110.667 -166.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.478 ' HB2' ' HB2' ' A' ' 24' ' ' ALA . . . -43.56 -62.5 1.06 Allowed 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.835 0.854 . . . . 0.0 112.922 -175.272 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.24 -39.17 85.79 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.177 -0.92 . . . . 0.0 110.958 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.412 ' O ' ' HG2' ' A' ' 98' ' ' GLU . . . -58.79 -53.91 42.35 Favored Glycine 0 C--N 1.353 1.508 0 O-C-N 124.72 1.262 . . . . 0.0 112.828 -178.162 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 25.8 mt -51.18 -55.74 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 124.481 1.113 . . . . 0.0 110.624 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.8 mp -57.96 -50.61 77.37 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.112 0 O-C-N 124.199 0.937 . . . . 0.0 111.298 -176.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.36 -27.42 66.23 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 122.91 0.484 . . . . 0.0 112.174 -176.359 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.412 ' HG2' ' O ' ' A' ' 94' ' ' GLY . 57.7 mm-40 -67.15 -38.75 86.03 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.232 0.613 . . . . 0.0 109.753 176.811 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . 0.406 ' O ' HG13 ' A' ' 103' ' ' ILE . 21.1 mt -77.06 -37.17 25.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -52.13 -51.72 56.11 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 124.735 1.214 . . . . 0.0 111.981 174.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -71.46 -33.14 69.06 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 123.505 0.503 . . . . 0.0 111.218 -177.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 71.0 mtm -67.49 -39.24 85.21 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 122.617 0.367 . . . . 0.0 111.042 175.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.49 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 9.3 mt -70.08 -42.8 79.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 176.871 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.37 -21.2 66.23 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.242 0.617 . . . . 0.0 111.23 179.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 26.3 t -85.19 -42.18 14.95 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 122.931 0.492 . . . . 0.0 110.09 179.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.49 ' HG2' ' HA ' ' A' ' 103' ' ' ILE . 13.1 pt-20 -76.35 -23.3 54.19 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 122.897 0.479 . . . . 0.0 111.599 -178.05 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.9 mm-40 -90.02 -39.86 12.68 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.122 0.569 . . . . 0.0 110.535 177.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 80.3 mm-40 . . . . . 0 CA--C 1.554 1.104 0 CA-C-O 118.587 -0.72 . . . . 0.0 109.495 179.891 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.9 ptt? . . . . . 0 N--CA 1.483 1.188 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.8 m -73.73 91.44 1.91 Allowed 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.373 0.669 . . . . 0.0 110.394 -179.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.656 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 27.9 pttt -82.18 170.12 15.81 Favored 'General case' 0 C--O 1.245 0.838 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.04 176.056 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.579 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.9 tmtp? -143.75 143.68 31.49 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.477 -172.606 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.481 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.0 tt -128.01 131.13 49.22 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 174.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 18.7 pt -122.98 161.72 24.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 108.482 -0.932 . . . . 0.0 108.482 170.097 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.54 ' HB2' HG12 ' A' ' 38' ' ' ILE . . . -146.48 171.34 15.21 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.001 176.444 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.5 tt -146.48 117.31 7.66 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 -178.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.508 ' HA ' ' O ' ' A' ' 64' ' ' SER . 56.2 m -104.73 112.86 26.11 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.932 0.893 . . . . 0.0 109.239 176.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.526 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -128.36 117.24 21.08 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 122.496 0.318 . . . . 0.0 111.183 -178.206 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.754 ' SG ' HD11 ' A' ' 85' ' ' LEU . 1.3 m -138.78 141.78 31.77 Favored Pre-proline 0 N--CA 1.484 1.226 0 C-N-CA 123.89 0.876 . . . . 0.0 110.868 178.186 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -82.94 -7.66 11.21 Favored 'Trans proline' 0 C--N 1.375 1.928 0 C-N-CA 123.434 2.756 . . . . 0.0 111.533 176.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 47.9 ttm -65.12 -30.15 71.07 Favored 'General case' 0 C--N 1.354 0.764 0 C-N-CA 124.738 1.215 . . . . 0.0 110.318 170.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 125.79 -176.08 17.43 Favored Glycine 0 C--N 1.346 1.126 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.407 179.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 48.9 mt -78.17 -21.75 49.72 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 -173.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.82 -41.96 88.06 Favored 'General case' 0 N--CA 1.488 1.463 0 CA-C-N 118.922 0.783 . . . . 0.0 110.898 178.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.43 ' ND1' HD21 ' A' ' 85' ' ' LEU . 4.9 t-80 -67.55 -44.63 77.83 Favored 'General case' 0 C--O 1.247 0.94 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.165 -179.603 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 50.1 p -65.76 -36.43 83.53 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 114.816 -1.084 . . . . 0.0 110.916 -178.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -68.62 -30.82 69.64 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.34 0.656 . . . . 0.0 111.352 -179.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' MET . . . . . 0.43 ' HE1' ' HA ' ' A' ' 17' ' ' HIS . 64.7 mtm -68.28 -40.55 81.77 Favored 'General case' 0 N--CA 1.485 1.293 0 CA-C-O 120.473 0.178 . . . . 0.0 111.1 175.266 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.63 -38.48 83.94 Favored 'General case' 0 N--CA 1.485 1.29 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.133 175.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.8 -39.35 80.17 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.084 0.953 . . . . 0.0 110.975 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.4 tp60 -62.71 -50.91 69.24 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.672 0.789 . . . . 0.0 109.513 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.15 -50.63 69.66 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 124.265 0.978 . . . . 0.0 111.956 -175.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 68.2 mt -63.93 -34.22 77.48 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 122.95 0.5 . . . . 0.0 111.743 179.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.406 ' O ' HG23 ' A' ' 30' ' ' VAL . 42.4 tt0 -63.39 -54.12 41.75 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 122.463 0.305 . . . . 0.0 110.313 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -51.28 -50.74 58.7 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 124.616 1.198 . . . . 0.0 111.445 179.357 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.43 ' HB1' HD11 ' A' ' 96' ' ' ILE . . . -67.48 -35.85 79.96 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 115.177 -0.92 . . . . 0.0 112.195 -176.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.04 -25.84 59.01 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.073 0.549 . . . . 0.0 111.716 178.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 26' ' ' GLU . 53.7 t -71.73 -39.37 68.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 175.205 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -65.87 -29.52 69.98 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 114.688 -1.142 . . . . 0.0 111.088 174.521 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -82.49 1.5 37.38 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 123.45 0.7 . . . . 0.0 112.41 177.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.96 -45.93 1.77 Allowed Glycine 0 C--N 1.353 1.503 0 N-CA-C 114.423 0.529 . . . . 0.0 114.423 165.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.656 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.1 OUTLIER -71.56 175.72 5.34 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -174.418 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.579 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 37.8 tt0 -77.07 144.03 38.83 Favored 'General case' 0 C--N 1.351 0.638 0 CA-C-N 114.446 -1.252 . . . . 0.0 109.111 178.515 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.481 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 9.3 p -128.66 135.92 61.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 122.66 0.384 . . . . 0.0 110.944 -178.612 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.9 tptt -142.46 113.35 7.5 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.248 0.619 . . . . 0.0 109.482 174.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.54 HG12 ' HB2' ' A' ' 7' ' ' ALA . 40.7 mt -117.54 112.78 40.24 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 122.854 0.462 . . . . 0.0 111.536 -176.376 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.497 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 32.0 tt0 -84.59 124.14 31.1 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.176 0.591 . . . . 0.0 110.288 177.262 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.548 ' HG1' ' HB3' ' A' ' 47' ' ' GLN . 24.9 p -100.95 105.27 16.49 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.871 0.868 . . . . 0.0 110.413 177.213 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.526 ' O ' ' HA ' ' A' ' 10' ' ' ALA . 40.0 mt-30 -95.35 141.83 28.45 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 172.219 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -162.19 -176.95 34.81 Favored Glycine 0 N--CA 1.464 0.564 0 CA-C-O 120.019 -0.323 . . . . 0.0 112.718 -177.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.6 -28.91 67.6 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.73 0.812 . . . . 0.0 111.807 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -72.69 -43.93 62.45 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.147 0.979 . . . . 0.0 110.363 175.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 148.69 -158.58 27.72 Favored Glycine 0 C--N 1.345 1.044 0 CA-C-N 115.257 -0.883 . . . . 0.0 112.007 -175.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 64.8 mt -106.82 138.6 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 123.699 0.8 . . . . 0.0 110.146 -175.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.548 ' HB3' ' HG1' ' A' ' 40' ' ' THR . 8.9 tp-100 -140.02 151.23 45.29 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.903 0.881 . . . . 0.0 109.191 -177.384 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 21.7 t30 57.57 48.27 14.61 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 124.507 1.123 . . . . 0.0 109.702 -177.016 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 32.0 tpt180 -48.4 123.36 6.46 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 126.228 1.811 . . . . 0.0 113.704 -173.09 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.497 ' HG ' ' HB2' ' A' ' 39' ' ' GLU . 52.2 mt -75.17 135.54 41.08 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 124.086 0.954 . . . . 0.0 110.318 170.595 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 44.4 p -103.77 173.03 6.48 Favored 'General case' 0 C--O 1.244 0.808 0 C-N-CA 124.164 0.985 . . . . 0.0 109.38 177.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.09 -33.81 73.93 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 122.813 0.445 . . . . 0.0 110.759 175.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -63.96 -44.75 91.83 Favored 'General case' 0 C--N 1.359 0.982 0 O-C-N 124.066 0.854 . . . . 0.0 110.944 178.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -57.99 -47.84 81.81 Favored 'General case' 0 N--CA 1.48 1.045 0 O-C-N 123.8 0.688 . . . . 0.0 110.983 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.534 HG23 ' HG3' ' A' ' 78' ' ' ARG . 14.2 mt -74.94 -28.83 21.57 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 O-C-N 123.741 0.65 . . . . 0.0 111.256 -177.191 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.94 -44.17 70.11 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.561 0.744 . . . . 0.0 111.401 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -89.36 -9.02 51.97 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.322 0.649 . . . . 0.0 111.602 -176.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.35 96.74 0.11 Allowed 'General case' 0 C--N 1.351 0.67 0 C-N-CA 123.548 0.739 . . . . 0.0 111.647 -177.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 26.3 m -62.58 -35.99 81.25 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 114.836 -1.075 . . . . 0.0 109.745 172.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.446 HG21 HG22 ' A' ' 99' ' ' ILE . 79.8 mt -131.55 137.18 55.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 CA-C-N 114.883 -1.053 . . . . 0.0 109.209 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 30.1 mt -131.23 133.66 62.14 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 175.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -124.95 111.11 26.72 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 174.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 11.8 m170 -89.19 85.49 6.65 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-O 121.576 0.703 . . . . 0.0 109.626 173.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.508 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 18.5 p -79.29 81.27 5.58 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-N 114.531 -1.213 . . . . 0.0 108.973 175.138 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.419 ' O ' ' HA ' ' A' ' 84' ' ' THR . 35.9 m -126.51 159.72 35.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 121.631 0.729 . . . . 0.0 111.553 -171.027 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -128.89 -3.22 5.21 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.068 1.347 . . . . 0.0 109.275 176.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.8 m -138.71 158.25 30.31 Favored 'Isoleucine or valine' 0 C--N 1.349 0.564 0 C-N-CA 125.912 1.685 . . . . 0.0 107.356 168.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 39.2 m -63.41 118.43 43.78 Favored Pre-proline 0 CA--C 1.547 0.828 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 175.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.468 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 58.9 Cg_endo -67.37 146.44 75.05 Favored 'Trans proline' 0 C--N 1.377 2.054 0 C-N-CA 122.095 1.863 . . . . 0.0 110.686 179.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -61.82 -38.79 89.47 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-O 121.752 0.787 . . . . 0.0 110.752 -176.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -94.57 16.54 15.19 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 114.514 -1.221 . . . . 0.0 112.417 -172.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.468 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 4.1 p30 -54.11 -26.59 28.2 Favored 'General case' 0 CA--C 1.565 1.541 0 C-N-CA 123.965 0.906 . . . . 0.0 110.766 174.404 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -56.13 -45.52 79.52 Favored 'General case' 0 CA--C 1.565 1.52 0 C-N-CA 125.836 1.654 . . . . 0.0 112.702 171.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 58.7 mtt85 -71.02 -17.77 62.61 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 124.6 1.16 . . . . 0.0 112.656 -176.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.505 ' HB3' HG21 ' A' ' 80' ' ' VAL . 77.1 m-85 -103.23 19.12 20.22 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.048 0.939 . . . . 0.0 110.991 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 13.7 tp10 -57.33 -56.51 20.91 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.409 1.083 . . . . 0.0 112.305 -174.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 64.8 p -86.2 -9.78 55.93 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.674 0.789 . . . . 0.0 112.453 -174.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.534 ' HG3' HG23 ' A' ' 55' ' ' ILE . 38.5 mmt180 -91.37 157.11 17.28 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 123.357 0.663 . . . . 0.0 111.927 -170.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -82.14 97.96 8.46 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.668 0.787 . . . . 0.0 109.751 -178.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.505 HG21 ' HB3' ' A' ' 75' ' ' PHE . 41.6 t -110.73 118.43 57.22 Favored 'Isoleucine or valine' 0 C--O 1.24 0.602 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.96 -174.854 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -86.39 89.41 7.87 Favored 'General case' 0 C--O 1.24 0.574 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 172.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -84.52 125.37 32.34 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.157 -177.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.598 HD12 ' HB3' ' A' ' 87' ' ' ASP . 39.0 pt -135.2 -175.37 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 125.024 1.33 . . . . 0.0 109.224 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.419 ' HA ' ' O ' ' A' ' 65' ' ' VAL . 24.8 p -79.57 151.35 30.71 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.847 0.356 . . . . 0.0 110.475 168.241 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.754 HD11 ' SG ' ' A' ' 11' ' ' CYS . 6.5 tt -61.88 -32.15 72.49 Favored 'General case' 0 N--CA 1.48 1.059 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.492 176.066 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 31.2 tt0 -59.83 -43.55 94.51 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.794 0.838 . . . . 0.0 111.181 175.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.598 ' HB3' HD12 ' A' ' 83' ' ' ILE . 5.1 t70 -60.31 -31.67 70.5 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.95 0.9 . . . . 0.0 110.773 -176.621 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.93 -28.74 63.67 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.468 0.707 . . . . 0.0 112.831 178.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 86.0 mt -77.92 -48.14 24.01 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.874 0 C-N-CA 123.041 0.536 . . . . 0.0 110.32 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -80.31 -43.17 21.71 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.075 0.55 . . . . 0.0 112.323 -176.25 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -114.46 27.86 9.16 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.507 0.723 . . . . 0.0 110.557 -168.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -45.38 -60.08 2.34 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 124.063 0.945 . . . . 0.0 112.781 -177.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.66 -41.38 94.9 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 114.074 -1.421 . . . . 0.0 110.702 177.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -62.81 -42.1 99.74 Favored Glycine 0 C--N 1.354 1.566 0 O-C-N 124.391 1.057 . . . . 0.0 113.301 -173.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.411 ' O ' HG13 ' A' ' 99' ' ' ILE . 19.7 mt -63.25 -57.51 11.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 123.909 0.884 . . . . 0.0 108.682 179.45 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.43 HD11 ' HB1' ' A' ' 28' ' ' ALA . 82.6 mt -58.61 -45.77 90.44 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 CA-C-N 114.04 -1.437 . . . . 0.0 111.722 -174.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -33.07 73.5 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 122.755 0.422 . . . . 0.0 111.365 -177.531 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -67.5 -37.56 83.01 Favored 'General case' 0 C--N 1.355 0.809 0 O-C-N 123.614 0.571 . . . . 0.0 110.404 177.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . 0.446 HG22 HG21 ' A' ' 60' ' ' ILE . 57.1 mt -75.14 -34.94 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 -177.128 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -63.37 -49.5 73.59 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 114.892 -1.049 . . . . 0.0 111.374 176.081 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -73.57 -30.7 63.19 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-O 119.613 -0.232 . . . . 0.0 111.307 -177.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.462 ' O ' ' HG2' ' A' ' 106' ' ' GLU . 68.3 mtm -65.47 -61.97 1.8 Allowed 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 175.165 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 41.3 mt -58.58 -48.49 85.44 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 O-C-N 123.932 0.77 . . . . 0.0 111.419 -176.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.83 -37.55 88.01 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -175.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 15.3 t -80.88 -23.47 39.0 Favored 'General case' 0 N--CA 1.484 1.275 0 CA-C-N 117.763 0.256 . . . . 0.0 111.643 -172.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 102' ' ' MET . 11.6 pt-20 -86.79 -41.69 13.89 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 122.549 0.34 . . . . 0.0 111.058 176.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -73.26 -35.62 66.23 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.025 0.53 . . . . 0.0 110.905 -177.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 76.3 mm-40 . . . . . 0 CA--C 1.55 0.965 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 175.217 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.2 mtt . . . . . 0 N--CA 1.482 1.13 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 55.2 p -72.57 94.99 1.76 Allowed 'General case' 0 CA--C 1.546 0.8 0 CA-C-O 121.481 0.658 . . . . 0.0 109.701 177.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.627 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 18.1 pttt -73.57 -177.38 2.66 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-N 114.793 -1.094 . . . . 0.0 111.684 -178.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.457 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.4 tmtp? -142.2 141.0 32.52 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-O 121.029 0.442 . . . . 0.0 109.834 -173.555 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.483 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 8.9 tt -128.4 139.58 52.3 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 176.199 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.426 HD13 HD11 ' A' ' 50' ' ' LEU . 18.3 pt -131.08 169.48 21.58 Favored 'Isoleucine or valine' 0 C--O 1.244 0.77 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 172.187 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.577 ' HB2' HG12 ' A' ' 38' ' ' ILE . . . -155.22 167.74 29.35 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.22 176.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.4 ' HA ' ' O ' ' A' ' 39' ' ' GLU . 3.8 tt -138.53 115.23 10.65 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 178.127 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.514 ' HA ' ' O ' ' A' ' 64' ' ' SER . 65.1 m -105.33 112.53 25.67 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.567 0.747 . . . . 0.0 109.045 176.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.449 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -126.51 128.26 46.62 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 122.718 0.407 . . . . 0.0 111.641 -176.387 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.743 ' SG ' HD12 ' A' ' 85' ' ' LEU . 20.9 m -125.82 151.15 70.65 Favored Pre-proline 0 N--CA 1.476 0.83 0 C-N-CA 124.24 1.016 . . . . 0.0 109.989 175.516 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -82.15 -0.54 10.32 Favored 'Trans proline' 0 C--N 1.374 1.897 0 C-N-CA 122.757 2.304 . . . . 0.0 112.099 173.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 46.6 ttm -99.4 -62.36 1.25 Allowed 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.307 1.043 . . . . 0.0 110.458 -173.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 179.52 -178.22 48.57 Favored Glycine 0 C--N 1.347 1.168 0 CA-C-N 115.96 -0.564 . . . . 0.0 113.336 -176.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 74.6 mt -82.32 -17.13 46.84 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 -174.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.6 -45.99 91.92 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-N 118.69 0.677 . . . . 0.0 110.998 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 8.0 t-160 -68.88 -36.6 78.28 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.406 -179.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.443 ' HA ' HD11 ' A' ' 85' ' ' LEU . 36.2 p -68.81 -30.31 68.85 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.566 179.643 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.448 ' HA ' ' HB1' ' A' ' 22' ' ' ALA . 19.8 m-85 -77.48 -22.35 51.43 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.467 0.707 . . . . 0.0 111.681 177.048 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' MET . . . . . 0.476 ' HE2' HD13 ' A' ' 89' ' ' ILE . 77.6 mtp -66.49 -44.33 82.93 Favored 'General case' 0 N--CA 1.486 1.336 0 CA-C-O 121.322 0.582 . . . . 0.0 109.471 171.379 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.73 -37.49 70.58 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 114.687 -1.142 . . . . 0.0 111.101 176.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.448 ' HB1' ' HA ' ' A' ' 19' ' ' PHE . . . -70.32 -34.01 72.19 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.437 0.695 . . . . 0.0 110.85 -179.318 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.1 tt0 -61.85 -55.37 30.5 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.342 0.657 . . . . 0.0 109.328 173.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.68 -44.37 86.42 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 114.372 -1.286 . . . . 0.0 112.447 -170.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.426 HD11 ' OG ' ' A' ' 64' ' ' SER . 96.2 mt -70.04 -34.77 73.66 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 122.745 0.418 . . . . 0.0 111.323 178.299 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.439 ' O ' HG21 ' A' ' 30' ' ' VAL . 36.8 tt0 -60.49 -55.45 33.3 Favored 'General case' 0 C--N 1.354 0.796 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 178.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -54.14 -50.2 67.47 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 124.579 1.174 . . . . 0.0 110.886 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.4 -45.1 92.43 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.162 0.985 . . . . 0.0 112.201 -176.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.58 -24.81 61.15 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 178.423 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.439 HG21 ' O ' ' A' ' 26' ' ' GLU . 40.6 t -70.43 -43.04 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 175.582 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -62.63 -34.04 76.24 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 114.588 -1.187 . . . . 0.0 111.064 178.193 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.68 -42.28 95.47 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.478 0.711 . . . . 0.0 111.65 177.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 135.09 -43.96 1.21 Allowed Glycine 0 C--N 1.348 1.207 0 CA-C-N 116.861 -0.154 . . . . 0.0 113.206 174.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.627 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -71.6 177.88 3.85 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 -177.266 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.457 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 30.2 tt0 -78.66 154.66 30.0 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 115.083 -0.962 . . . . 0.0 109.505 178.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.483 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 7.1 p -134.94 136.61 51.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 123.226 0.61 . . . . 0.0 110.138 176.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 45.9 tptt -143.69 113.83 7.32 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 175.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.577 HG12 ' HB2' ' A' ' 7' ' ' ALA . 41.5 mt -116.01 109.85 29.6 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 C-N-CA 122.654 0.382 . . . . 0.0 111.844 -174.232 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.4 ' O ' ' HA ' ' A' ' 8' ' ' LEU . 32.7 tt0 -76.08 135.63 39.88 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 172.067 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 12.2 p -118.93 119.04 33.16 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 123.657 0.783 . . . . 0.0 109.65 -177.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.449 ' O ' ' HA ' ' A' ' 10' ' ' ALA . 40.4 mt-30 -109.65 137.68 47.11 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 123.796 0.838 . . . . 0.0 109.969 179.153 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -164.45 176.31 40.36 Favored Glycine 0 C--O 1.243 0.664 0 N-CA-C 112.136 -0.386 . . . . 0.0 112.136 179.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.72 -19.79 66.03 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.292 0.637 . . . . 0.0 112.034 -179.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -74.56 -40.32 61.73 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.159 0.584 . . . . 0.0 110.876 173.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 156.06 -158.02 28.28 Favored Glycine 0 C--N 1.343 0.97 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.004 -176.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.422 HG12 ' HG2' ' A' ' 41' ' ' GLN . 74.6 mt -124.12 137.98 55.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 C-N-CA 123.316 0.647 . . . . 0.0 109.769 177.364 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -132.98 152.42 51.95 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.178 0.991 . . . . 0.0 109.636 -178.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.1 t30 63.58 36.82 10.74 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 124.24 1.016 . . . . 0.0 110.238 175.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.407 HH22 HD12 ' A' ' 46' ' ' ILE . 20.2 tpp180 -45.26 122.51 3.47 Favored 'General case' 0 C--N 1.362 1.117 0 C-N-CA 126.088 1.755 . . . . 0.0 112.762 -175.675 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.426 HD11 HD13 ' A' ' 6' ' ' ILE . 41.1 mt -76.2 147.17 38.59 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.264 172.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 17.1 p -104.86 171.88 7.08 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 175.204 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.7 -29.33 70.58 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 122.664 0.386 . . . . 0.0 111.231 175.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -64.94 -46.93 79.55 Favored 'General case' 0 C--N 1.354 0.781 0 O-C-N 123.759 0.662 . . . . 0.0 110.243 176.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -56.25 -46.09 79.78 Favored 'General case' 0 N--CA 1.484 1.267 0 O-C-N 123.928 0.768 . . . . 0.0 111.403 179.02 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.576 HG23 ' HG3' ' A' ' 78' ' ' ARG . 28.6 mt -74.19 -31.49 29.46 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 O-C-N 123.925 0.765 . . . . 0.0 111.121 -174.708 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.25 -50.02 30.5 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.164 0.585 . . . . 0.0 111.093 178.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -79.95 -9.56 59.69 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.4 0.68 . . . . 0.0 111.652 -176.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.82 103.25 0.42 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.297 0.639 . . . . 0.0 110.538 176.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 30.2 m -61.85 -36.08 80.16 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.656 170.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.471 HG22 HG23 ' A' ' 99' ' ' ILE . 79.8 mt -132.36 141.44 45.26 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.292 179.308 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.418 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 21.9 mt -132.12 140.78 47.07 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 123.856 0.862 . . . . 0.0 108.887 171.634 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.2 mp -126.03 116.65 46.51 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.329 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 173.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . 0.414 ' HE1' ' HA ' ' A' ' 72' ' ' ASN . 5.2 m170 -92.32 86.21 5.64 Favored 'General case' 0 N--CA 1.486 1.334 0 CA-C-O 121.739 0.78 . . . . 0.0 109.834 173.339 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.514 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 22.7 m -82.43 78.91 9.01 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 114.381 -1.282 . . . . 0.0 109.956 178.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.447 HG11 ' HG3' ' A' ' 69' ' ' PRO . 34.2 m -125.35 157.14 34.61 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 CA-C-O 121.858 0.837 . . . . 0.0 111.721 -170.074 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -107.77 -23.3 12.14 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 114.17 -1.377 . . . . 0.0 109.483 178.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 15.8 m -136.86 179.64 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 125.051 1.341 . . . . 0.0 108.757 178.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 86.8 m -69.98 116.02 39.82 Favored Pre-proline 0 CA--C 1.549 0.938 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 172.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.596 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 58.1 Cg_endo -73.31 146.8 40.82 Favored 'Trans proline' 0 C--N 1.373 1.857 0 C-N-CA 122.406 2.07 . . . . 0.0 110.859 175.833 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.417 ' HB2' HE22 ' A' ' 41' ' ' GLN . 14.2 mm-40 -67.36 -23.76 65.63 Favored 'General case' 0 N--CA 1.482 1.175 0 CA-C-O 121.219 0.533 . . . . 0.0 111.338 -175.478 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -101.6 10.06 40.57 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.152 -176.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.596 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 8.4 t30 -56.45 -34.83 67.23 Favored 'General case' 0 N--CA 1.495 1.814 0 C-N-CA 123.499 0.72 . . . . 0.0 112.021 179.592 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -57.96 -22.24 48.18 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 125.264 1.425 . . . . 0.0 113.314 179.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 43.1 mtp180 -86.03 -28.51 24.09 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.409 1.083 . . . . 0.0 112.537 -176.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 58.0 m-85 -99.98 -17.77 17.37 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.702 0.801 . . . . 0.0 111.969 -173.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -59.08 -29.49 67.38 Favored 'General case' 0 CA--C 1.559 1.292 0 C-N-CA 124.098 0.959 . . . . 0.0 113.282 -168.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 14.2 t -85.16 0.41 51.81 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.522 0.729 . . . . 0.0 112.142 -178.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.576 ' HG3' HG23 ' A' ' 55' ' ' ILE . 36.8 mmt180 -114.67 168.53 9.8 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.0 0.92 . . . . 0.0 110.081 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -75.65 86.45 2.7 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-O 121.785 0.802 . . . . 0.0 110.28 -178.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.418 ' HA ' ' HB ' ' A' ' 61' ' ' ILE . 60.2 t -101.56 125.94 55.53 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 CA-C-N 114.619 -1.173 . . . . 0.0 110.109 179.415 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -98.74 89.53 4.38 Favored 'General case' 0 C--O 1.24 0.592 0 N-CA-C 107.4 -1.333 . . . . 0.0 107.4 174.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -78.86 125.33 29.23 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.051 -177.206 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.445 HD13 ' HB3' ' A' ' 87' ' ' ASP . 46.4 pt -128.62 -174.06 1.1 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.856 0 C-N-CA 124.491 1.116 . . . . 0.0 109.379 177.388 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 23.3 p -84.36 149.3 26.13 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 109.908 -0.405 . . . . 0.0 109.908 166.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.743 HD12 ' SG ' ' A' ' 11' ' ' CYS . 7.6 tt -61.65 -31.03 71.12 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.865 179.209 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -61.51 -42.98 99.61 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 123.403 0.681 . . . . 0.0 110.938 176.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.445 ' HB3' HD13 ' A' ' 83' ' ' ILE . 9.2 t70 -62.8 -31.88 72.96 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.569 0.748 . . . . 0.0 110.913 -179.157 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.54 -14.5 63.05 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.836 0.854 . . . . 0.0 112.906 179.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.476 HD13 ' HE2' ' A' ' 20' ' ' MET . 47.5 mt -96.76 -56.6 5.07 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 123.662 0.785 . . . . 0.0 109.536 178.101 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -77.82 -30.37 51.08 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 -173.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -118.35 15.25 13.9 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.443 0.697 . . . . 0.0 110.55 -175.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.426 ' HA ' HD13 ' A' ' 95' ' ' ILE . . . -41.97 -57.91 2.26 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 124.49 1.116 . . . . 0.0 113.467 -173.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.82 -41.19 97.48 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.944 179.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -58.93 -44.08 96.34 Favored Glycine 0 C--N 1.35 1.345 0 O-C-N 124.343 1.027 . . . . 0.0 112.339 -179.439 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.426 HD13 ' HA ' ' A' ' 92' ' ' ALA . 22.3 mt -59.42 -58.53 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 124.144 0.978 . . . . 0.0 110.272 -179.517 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.7 mp -54.37 -51.14 51.72 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 O-C-N 124.175 0.922 . . . . 0.0 110.832 -176.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.48 -29.82 69.36 Favored 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -175.431 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -68.34 -36.55 79.42 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 177.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . 0.471 HG23 HG22 ' A' ' 60' ' ' ILE . 38.3 mt -76.91 -36.45 25.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 -177.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -57.38 -52.58 64.8 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 114.502 -1.226 . . . . 0.0 111.063 177.291 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -71.05 -32.15 68.78 Favored 'General case' 0 CA--C 1.546 0.805 0 O-C-N 123.671 0.607 . . . . 0.0 111.838 -176.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 70.7 mtm -66.06 -53.83 33.46 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 122.837 0.455 . . . . 0.0 110.954 177.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 40.7 mt -67.7 -33.38 61.5 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.837 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.714 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -72.21 -25.36 61.63 Favored 'General case' 0 C--O 1.212 -0.917 0 CA-C-O 119.666 -0.207 . . . . 0.0 111.066 177.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 21.0 t -78.04 -38.76 43.85 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 118.01 0.368 . . . . 0.0 110.88 -178.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -72.32 -37.56 68.89 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 122.354 0.262 . . . . 0.0 111.159 178.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -84.08 -31.15 25.48 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 122.932 0.493 . . . . 0.0 111.355 -177.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 65.9 mm-40 . . . . . 0 C--O 1.25 1.111 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.124 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.6 ttt . . . . . 0 N--CA 1.483 1.215 0 N-CA-C 110.431 -0.211 . . . . 0.0 110.431 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.8 p -65.75 98.67 0.41 Allowed 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 123.233 0.613 . . . . 0.0 111.509 -176.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.559 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 14.6 pttt -91.67 178.49 5.91 Favored 'General case' 0 C--O 1.256 1.395 0 C-N-CA 123.828 0.851 . . . . 0.0 111.192 178.186 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.556 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 3.7 tmtp? -149.64 141.49 23.73 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.126 -172.428 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.481 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.6 tt -128.48 139.05 52.53 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 176.154 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 16.0 pt -130.14 165.46 30.24 Favored 'Isoleucine or valine' 0 C--O 1.241 0.625 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 168.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.525 ' HB2' HG12 ' A' ' 38' ' ' ILE . . . -152.16 169.11 23.24 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 176.304 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.1 tt -140.97 109.69 6.02 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -178.413 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.552 ' HA ' ' O ' ' A' ' 64' ' ' SER . 66.8 m -101.05 107.61 19.1 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.938 0.895 . . . . 0.0 109.463 176.848 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -125.9 115.31 19.74 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 122.852 0.461 . . . . 0.0 110.096 -177.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.557 ' SG ' ' HB3' ' A' ' 13' ' ' MET . 25.7 t -123.04 139.06 30.77 Favored Pre-proline 0 N--CA 1.476 0.846 0 C-N-CA 123.034 0.533 . . . . 0.0 110.664 -175.567 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -74.39 -15.9 22.12 Favored 'Trans proline' 0 C--N 1.374 1.911 0 C-N-CA 123.151 2.568 . . . . 0.0 112.848 170.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.557 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 44.2 ttm -69.05 -57.13 5.85 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.557 0.743 . . . . 0.0 110.282 177.779 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 164.85 171.47 31.13 Favored Glycine 0 C--O 1.245 0.812 0 CA-C-N 114.886 -1.052 . . . . 0.0 111.813 -177.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 81.0 mt -67.5 -20.01 65.4 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.246 0.619 . . . . 0.0 111.941 178.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -57.06 -45.35 83.32 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-O 121.047 0.451 . . . . 0.0 110.996 175.361 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 7.7 t-160 -73.01 -36.06 66.93 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.432 -178.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.415 ' HA ' HD13 ' A' ' 85' ' ' LEU . 37.4 p -64.41 -37.79 88.77 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.563 179.505 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -75.18 -23.42 57.72 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.416 0.687 . . . . 0.0 111.926 -179.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' MET . . . . . 0.472 ' HE2' HD11 ' A' ' 89' ' ' ILE . 83.8 mtp -61.32 -48.45 81.3 Favored 'General case' 0 N--CA 1.484 1.262 0 CA-C-O 121.173 0.511 . . . . 0.0 110.064 169.088 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.89 -38.91 73.05 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.951 178.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.48 -39.83 81.18 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.934 0.893 . . . . 0.0 111.225 -176.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.453 ' O ' ' HG3' ' A' ' 27' ' ' GLU . 16.2 tt0 -65.37 -50.35 65.89 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 123.482 0.489 . . . . 0.0 110.241 176.77 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.87 -48.98 79.35 Favored 'General case' 0 CA--C 1.551 1.013 0 O-C-N 123.829 0.705 . . . . 0.0 112.213 -174.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 73.4 mt -64.84 -37.07 86.4 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 122.97 0.508 . . . . 0.0 111.587 177.221 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.461 ' O ' HG23 ' A' ' 30' ' ' VAL . 41.3 tt0 -59.88 -55.23 36.79 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 123.35 0.406 . . . . 0.0 110.25 -179.039 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.536 ' O ' ' HG3' ' A' ' 31' ' ' GLU . 44.6 mt-10 -52.84 -53.11 53.49 Favored 'General case' 0 N--CA 1.475 0.825 0 O-C-N 124.616 1.198 . . . . 0.0 111.159 -179.584 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -62.01 -37.48 85.02 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.721 -176.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.56 -24.11 49.91 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.164 0.585 . . . . 0.0 112.503 179.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.461 HG23 ' O ' ' A' ' 26' ' ' GLU . 40.6 t -64.14 -43.87 97.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 172.748 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.536 ' HG3' ' O ' ' A' ' 27' ' ' GLU . 25.9 mt-10 -80.13 -20.78 44.16 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 113.506 -1.679 . . . . 0.0 111.643 -176.086 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.65 -16.54 62.27 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.373 0.669 . . . . 0.0 111.221 174.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 116.11 -19.01 13.79 Favored Glycine 0 C--N 1.354 1.579 0 N-CA-C 114.53 0.572 . . . . 0.0 114.53 167.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.559 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -106.02 -179.58 3.98 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 113.323 0.861 . . . . 0.0 113.323 -173.481 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.556 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 10.8 tp10 -75.77 150.27 37.81 Favored 'General case' 0 C--N 1.355 0.812 0 CA-C-N 114.479 -1.237 . . . . 0.0 109.021 175.419 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.481 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 7.1 p -137.4 132.94 46.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 122.921 0.489 . . . . 0.0 110.238 177.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 48.2 tptt -142.11 112.82 7.3 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 179.132 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.525 HG12 ' HB2' ' A' ' 7' ' ' ALA . 45.5 mt -118.6 111.08 32.3 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 -173.785 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -75.55 139.68 42.27 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.829 0.851 . . . . 0.0 109.74 174.007 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.404 ' HA ' ' O ' ' A' ' 9' ' ' CYS . 17.0 p -123.1 111.68 16.83 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.881 0.872 . . . . 0.0 109.463 -178.293 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.41 HE22 ' HB2' ' A' ' 70' ' ' GLU . 41.9 mt-30 -105.74 146.38 29.87 Favored 'General case' 0 C--O 1.243 0.744 0 CA-C-O 121.174 0.511 . . . . 0.0 111.376 -177.428 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -169.78 169.24 41.97 Favored Glycine 0 C--N 1.342 0.866 0 CA-C-N 114.917 -1.038 . . . . 0.0 111.752 175.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.94 -24.76 67.85 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.556 0.743 . . . . 0.0 111.741 -179.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -72.42 -39.93 67.5 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.201 0.6 . . . . 0.0 110.603 174.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 163.93 -173.73 40.0 Favored Glycine 0 C--N 1.344 1.027 0 CA-C-N 116.214 -0.448 . . . . 0.0 113.333 -179.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 78.2 mt -122.63 134.82 64.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.215 1.006 . . . . 0.0 108.836 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -128.89 152.76 48.18 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.931 0.892 . . . . 0.0 109.628 -179.144 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 10.3 t30 60.21 40.45 18.03 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 124.364 1.066 . . . . 0.0 109.977 176.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 17.4 tpp180 -47.58 124.54 7.18 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 125.854 1.662 . . . . 0.0 113.118 -175.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 55.0 mt -77.81 132.91 38.26 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.318 1.047 . . . . 0.0 110.6 173.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 43.0 p -96.68 169.77 9.65 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.721 177.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.09 -34.89 70.66 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 122.904 0.482 . . . . 0.0 111.204 175.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 19.9 tt0 -65.23 -46.74 79.38 Favored 'General case' 0 C--N 1.352 0.716 0 O-C-N 123.717 0.636 . . . . 0.0 110.463 178.117 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -53.66 -44.79 69.94 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 123.362 0.665 . . . . 0.0 111.71 179.267 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 45.8 mt -71.74 -32.73 46.11 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.94 0 O-C-N 124.302 1.002 . . . . 0.0 110.935 -177.47 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.35 -41.55 69.62 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.467 0.707 . . . . 0.0 111.42 178.02 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -72.3 -32.38 66.52 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.99 0.916 . . . . 0.0 111.003 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.73 102.56 0.07 Allowed 'General case' 0 N--CA 1.471 0.622 0 O-C-N 124.568 1.168 . . . . 0.0 112.587 -173.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 26.9 m -61.88 -38.59 88.87 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 124.049 0.94 . . . . 0.0 109.429 168.043 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.442 HG22 HG21 ' A' ' 99' ' ' ILE . 70.6 mt -128.44 139.78 50.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.092 -178.44 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.404 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 25.9 mt -131.21 133.49 62.38 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.286 0 C-N-CA 123.821 0.848 . . . . 0.0 108.919 171.401 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.1 mp -121.9 112.5 35.18 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.339 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 174.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . 0.505 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 9.4 m170 -86.48 86.04 7.33 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-O 121.678 0.751 . . . . 0.0 109.15 173.42 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.552 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 15.0 m -81.25 78.98 7.99 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 114.074 -1.421 . . . . 0.0 109.222 177.452 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 35.3 m -127.5 157.98 39.04 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-O 121.688 0.756 . . . . 0.0 111.537 -169.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -117.11 -10.38 10.87 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.524 1.13 . . . . 0.0 109.418 175.164 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 4.0 m -141.84 162.3 20.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 125.699 1.6 . . . . 0.0 108.498 173.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 47.0 m -61.83 114.93 12.76 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 123.286 0.634 . . . . 0.0 110.162 175.62 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.533 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 69.1 Cg_endo -70.53 151.54 64.75 Favored 'Trans proline' 0 C--N 1.377 2.055 0 C-N-CA 122.241 1.961 . . . . 0.0 110.87 178.083 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.41 ' HB2' HE22 ' A' ' 41' ' ' GLN . 11.6 mm-40 -67.57 -45.49 75.45 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-O 121.216 0.531 . . . . 0.0 111.107 -172.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -89.64 14.4 11.74 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.746 0.818 . . . . 0.0 112.305 -169.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.533 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 5.2 p30 -55.47 -27.35 47.77 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 124.83 1.252 . . . . 0.0 112.817 -176.313 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -56.89 -33.6 67.06 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.958 1.303 . . . . 0.0 113.03 -177.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -72.58 -38.15 67.97 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.929 0.892 . . . . 0.0 110.812 -175.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -77.09 -12.78 59.99 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 114.447 -1.251 . . . . 0.0 111.456 -174.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -54.48 -33.28 59.44 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 124.663 1.185 . . . . 0.0 112.352 178.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 73.5 p -73.83 -19.42 60.74 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 -177.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 40.6 mmt180 -115.46 170.25 8.55 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.756 0.822 . . . . 0.0 111.803 -170.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -76.9 93.94 3.84 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.412 0.685 . . . . 0.0 110.177 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.404 ' HA ' ' HB ' ' A' ' 61' ' ' ILE . 48.3 t -99.0 139.76 20.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.25 177.818 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -116.5 91.14 3.5 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 179.382 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.505 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 49.1 mt-10 -81.14 123.93 28.82 Favored 'General case' 0 C--N 1.35 0.623 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.756 -175.569 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.594 HD13 ' HB3' ' A' ' 87' ' ' ASP . 45.5 pt -131.33 179.57 4.22 Favored 'Isoleucine or valine' 0 C--O 1.248 1.02 0 C-N-CA 125.112 1.365 . . . . 0.0 108.764 178.227 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 3.2 m -80.34 151.59 29.4 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 109.138 -0.689 . . . . 0.0 109.138 167.06 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.531 HD11 ' HB2' ' A' ' 11' ' ' CYS . 7.8 tt -62.86 -29.95 71.13 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.18 0.592 . . . . 0.0 111.591 -178.019 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.523 ' HG2' ' HE2' ' A' ' 90' ' ' LYS . 34.5 tt0 -64.83 -37.01 86.18 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.095 0.558 . . . . 0.0 111.397 179.133 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.594 ' HB3' HD13 ' A' ' 83' ' ' ILE . 5.3 t70 -61.88 -34.06 75.32 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.881 0.872 . . . . 0.0 110.366 -179.411 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -72.23 -11.63 60.81 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.883 0.873 . . . . 0.0 113.017 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.472 HD11 ' HE2' ' A' ' 20' ' ' MET . 84.2 mt -96.43 -53.0 8.59 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 123.641 0.776 . . . . 0.0 109.723 178.27 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.523 ' HE2' ' HG2' ' A' ' 86' ' ' GLN . 0.2 OUTLIER -72.97 -42.46 63.31 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.456 0.702 . . . . 0.0 111.834 -176.453 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -117.81 26.67 9.52 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.343 1.057 . . . . 0.0 110.098 -167.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.49 -58.89 3.68 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.667 0.787 . . . . 0.0 112.956 -174.393 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -64.66 -33.92 77.08 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.103 177.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.437 ' O ' ' HG2' ' A' ' 98' ' ' GLU . . . -60.5 -52.24 53.8 Favored Glycine 0 C--N 1.354 1.579 0 O-C-N 124.474 1.109 . . . . 0.0 112.269 -178.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 22.1 mt -55.73 -53.8 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 124.653 1.181 . . . . 0.0 109.933 -179.143 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 88.8 mt -57.05 -51.34 70.24 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.954 0 CA-C-N 114.47 -1.241 . . . . 0.0 111.638 -177.074 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.03 -30.44 69.66 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -178.355 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 94' ' ' GLY . 31.2 mm-40 -63.15 -41.35 99.26 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.4 0.68 . . . . 0.0 109.751 177.107 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . 0.442 HG21 HG22 ' A' ' 60' ' ' ILE . 58.5 mt -76.23 -35.25 27.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 -177.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -60.77 -48.14 83.14 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.024 0.93 . . . . 0.0 111.516 178.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -70.25 -36.85 74.75 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.952 -179.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 62.3 mtm -69.4 -52.01 31.02 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.905 0.482 . . . . 0.0 111.645 -178.033 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 20.0 mt -59.89 -49.08 85.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 O-C-N 123.677 0.611 . . . . 0.0 110.43 178.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.34 -28.21 69.85 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -178.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 32.8 t -81.4 -35.57 30.58 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 122.789 0.435 . . . . 0.0 111.551 -178.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -81.7 -30.27 32.64 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 122.368 0.267 . . . . 0.0 111.48 -178.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -76.45 -46.53 26.56 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 122.474 0.309 . . . . 0.0 110.457 178.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 86.9 mm-40 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.877 -0.583 . . . . 0.0 110.316 179.605 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.0 tmm? . . . . . 0 N--CA 1.482 1.145 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 44.0 p -73.49 84.8 1.52 Allowed 'General case' 0 CA--C 1.548 0.889 0 CA-C-O 121.357 0.599 . . . . 0.0 111.184 -177.365 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 48.7 pttt -86.16 159.6 19.46 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.642 0.777 . . . . 0.0 110.249 177.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.567 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.7 tmtp? -145.34 132.85 20.81 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 -169.261 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.49 HD12 HG13 ' A' ' 96' ' ' ILE . 10.4 tt -121.23 135.16 55.18 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 107.705 -1.22 . . . . 0.0 107.705 176.145 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.544 HD12 HD11 ' A' ' 50' ' ' LEU . 15.9 pt -127.92 161.27 36.33 Favored 'Isoleucine or valine' 0 C--O 1.242 0.705 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 174.75 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.546 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -152.62 167.54 28.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.12 178.654 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.534 HD23 ' HG3' ' A' ' 41' ' ' GLN . 2.5 tt -140.73 114.97 9.26 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 -178.344 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.531 ' HA ' ' O ' ' A' ' 64' ' ' SER . 56.2 m -107.08 113.14 26.42 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.817 0.847 . . . . 0.0 108.973 176.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -128.87 123.89 33.84 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 122.596 0.358 . . . . 0.0 111.225 -177.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.749 ' SG ' HD12 ' A' ' 85' ' ' LEU . 1.2 m -133.55 149.77 73.09 Favored Pre-proline 0 N--CA 1.479 0.996 0 C-N-CA 124.022 0.929 . . . . 0.0 110.362 177.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -79.52 -11.86 14.12 Favored 'Trans proline' 0 C--N 1.375 1.928 0 C-N-CA 122.596 2.197 . . . . 0.0 112.013 176.657 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 21.8 mmt -73.33 -50.61 21.16 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.309 1.043 . . . . 0.0 110.348 -176.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 158.66 -175.18 35.75 Favored Glycine 0 C--N 1.346 1.105 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.107 -179.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 74.3 mt -78.6 -16.47 57.34 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.111 0.564 . . . . 0.0 112.357 -176.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -57.69 -51.52 69.21 Favored 'General case' 0 C--O 1.25 1.088 0 CA-C-O 121.29 0.567 . . . . 0.0 111.309 177.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.438 ' ND1' HD23 ' A' ' 85' ' ' LEU . 4.3 t-80 -67.06 -38.54 85.97 Favored 'General case' 0 C--O 1.248 1.017 0 CA-C-N 114.866 -1.061 . . . . 0.0 110.213 -176.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 44.8 p -67.98 -35.68 78.76 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.968 -178.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -70.59 -26.77 63.67 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 122.839 0.455 . . . . 0.0 111.789 178.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 38.1 mtm -68.56 -43.06 77.41 Favored 'General case' 0 N--CA 1.484 1.233 0 CA-C-N 117.717 0.235 . . . . 0.0 110.603 174.009 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.91 -41.94 95.16 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.768 174.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.73 -43.8 98.14 Favored 'General case' 0 C--O 1.216 -0.705 0 CA-C-N 115.201 -0.909 . . . . 0.0 110.743 179.005 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.434 ' O ' ' HG3' ' A' ' 27' ' ' GLU . 9.0 tp-100 -62.71 -44.47 96.14 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.245 0.618 . . . . 0.0 110.816 -178.316 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.461 ' HB1' ' HB1' ' A' ' 92' ' ' ALA . . . -68.02 -49.18 63.1 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.65 -175.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 98.6 mt -64.24 -31.21 72.32 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.241 0.616 . . . . 0.0 111.694 177.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.476 ' O ' HG23 ' A' ' 30' ' ' VAL . 30.7 tt0 -63.09 -56.41 17.14 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.632 0.773 . . . . 0.0 110.17 179.113 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.434 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 49.7 mt-10 -55.05 -46.73 75.37 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 124.187 0.929 . . . . 0.0 110.657 -179.525 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.24 -51.01 71.54 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.322 1.049 . . . . 0.0 111.625 -178.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.14 -22.73 65.77 Favored 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 113.788 1.032 . . . . 0.0 113.788 178.053 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.476 HG23 ' O ' ' A' ' 26' ' ' GLU . 52.1 t -76.56 -43.66 34.87 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 178.748 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -68.45 -26.73 65.65 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 114.831 -1.077 . . . . 0.0 110.354 176.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -76.52 -26.48 55.26 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.211 1.004 . . . . 0.0 111.636 176.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 102.75 15.03 25.63 Favored Glycine 0 C--N 1.349 1.277 0 N-CA-C 114.654 0.622 . . . . 0.0 114.654 168.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.689 ' HH ' ' HG2' ' A' ' 100' ' ' GLU . 1.7 m-85 -95.54 162.54 13.59 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-N 117.844 0.822 . . . . 0.0 109.549 176.028 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.567 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 43.4 tt0 -74.0 126.19 29.94 Favored 'General case' 0 C--O 1.222 -0.373 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 160.732 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.482 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 12.5 p -115.11 132.66 63.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-N 118.772 0.715 . . . . 0.0 111.093 -172.68 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 49.3 tptt -142.33 117.55 10.12 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 179.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.546 HG12 ' HB3' ' A' ' 7' ' ' ALA . 55.9 mt -121.1 112.02 33.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -174.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.504 ' HG3' ' HA ' ' A' ' 49' ' ' ARG . 41.9 tt0 -71.09 138.91 50.13 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.249 1.02 . . . . 0.0 109.176 172.882 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 7.0 p -128.52 122.1 30.34 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 123.895 0.878 . . . . 0.0 108.911 -177.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.534 ' HG3' HD23 ' A' ' 8' ' ' LEU . 2.5 mt-30 -122.04 151.75 40.51 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.622 0.725 . . . . 0.0 111.675 -176.218 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -161.31 173.1 37.68 Favored Glycine 0 C--O 1.241 0.554 0 CA-C-N 114.086 -1.415 . . . . 0.0 110.239 172.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.02 -16.45 63.72 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 122.919 0.487 . . . . 0.0 110.993 176.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -75.7 -34.82 60.43 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 123.821 0.848 . . . . 0.0 110.674 172.067 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 154.26 -176.99 31.91 Favored Glycine 0 C--N 1.348 1.198 0 CA-C-N 116.348 -0.387 . . . . 0.0 113.163 178.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.488 HG22 ' HG2' ' A' ' 41' ' ' GLN . 44.1 mt -108.73 156.15 9.44 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 124.434 1.094 . . . . 0.0 109.677 -178.187 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -151.2 149.61 29.63 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.821 0.848 . . . . 0.0 109.514 178.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.6 t30 60.4 34.68 20.6 Favored 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 124.135 0.974 . . . . 0.0 110.623 173.079 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.504 ' HA ' ' HG3' ' A' ' 39' ' ' GLU . 23.8 ttp180 -63.2 138.64 58.61 Favored 'General case' 0 C--N 1.351 0.652 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 -168.256 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.544 HD11 HD12 ' A' ' 6' ' ' ILE . 57.8 mt -80.4 121.55 25.86 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 113.747 -1.57 . . . . 0.0 111.504 -177.833 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 43.8 p -87.62 166.92 14.35 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 114.675 -1.148 . . . . 0.0 110.229 -177.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -53.13 -34.03 54.95 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.636 0.774 . . . . 0.0 111.898 179.056 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -68.28 -48.19 65.67 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 123.906 0.754 . . . . 0.0 111.271 178.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -58.85 -41.88 88.04 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.398 0.679 . . . . 0.0 111.236 -178.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.494 HG23 ' HG3' ' A' ' 78' ' ' ARG . 41.1 mt -76.09 -35.39 28.63 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.299 -173.834 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.82 -43.81 62.23 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.23 0.612 . . . . 0.0 111.181 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -85.44 -1.31 56.9 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.436 0.694 . . . . 0.0 111.985 -177.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.98 110.2 4.33 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.034 0.534 . . . . 0.0 111.202 178.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 16.4 m -61.55 -36.0 79.35 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 124.299 1.04 . . . . 0.0 110.082 167.012 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.512 HG21 HG23 ' A' ' 99' ' ' ILE . 55.6 mt -135.26 143.13 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 C-N-CA 123.885 0.874 . . . . 0.0 110.416 -179.381 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 23.0 mt -135.17 123.49 39.67 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 123.776 0.83 . . . . 0.0 109.165 173.608 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.2 mp -111.65 140.61 30.31 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.332 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 173.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . 0.524 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 6.9 m170 -114.36 84.89 2.13 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 168.473 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.531 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 15.9 m -81.39 81.98 7.36 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 114.821 -1.081 . . . . 0.0 109.483 176.002 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 30.2 m -125.33 162.72 27.49 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-O 121.782 0.801 . . . . 0.0 112.114 -171.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -114.98 -28.35 7.05 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 114.029 -1.441 . . . . 0.0 108.776 173.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 22.8 m -137.11 168.6 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 125.371 1.469 . . . . 0.0 108.955 178.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 62.1 m -66.42 119.28 61.24 Favored Pre-proline 0 CA--C 1.551 1.013 0 C-N-CA 123.191 0.597 . . . . 0.0 111.02 179.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.498 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 57.9 Cg_endo -72.68 146.3 43.1 Favored 'Trans proline' 0 C--N 1.371 1.718 0 C-N-CA 122.406 2.07 . . . . 0.0 111.12 170.285 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -64.77 -31.98 73.46 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 123.12 0.568 . . . . 0.0 111.826 -175.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -102.81 25.6 9.06 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.461 0.704 . . . . 0.0 111.731 -177.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.498 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 5.8 p30 -60.89 -27.65 68.31 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.088 0.555 . . . . 0.0 110.726 174.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -59.94 -27.28 66.66 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 125.19 1.396 . . . . 0.0 112.985 177.344 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 81.6 mtt180 -68.59 -21.01 64.54 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.285 0.634 . . . . 0.0 111.85 178.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.436 ' HB3' HG23 ' A' ' 80' ' ' VAL . 32.3 m-85 -111.31 7.26 20.96 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.371 1.069 . . . . 0.0 111.236 -174.593 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -53.56 -47.61 69.89 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.761 1.224 . . . . 0.0 113.279 -172.392 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 94.4 p -101.55 4.2 40.81 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.277 0.631 . . . . 0.0 112.348 -174.005 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.494 ' HG3' HG23 ' A' ' 55' ' ' ILE . 29.8 mmt180 -101.65 162.67 12.73 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 122.685 0.394 . . . . 0.0 111.062 -174.216 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -76.7 91.37 3.45 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.357 0.663 . . . . 0.0 110.644 -177.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.436 HG23 ' HB3' ' A' ' 75' ' ' PHE . 31.3 t -109.78 148.96 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 123.815 0.846 . . . . 0.0 110.724 -175.873 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -121.24 89.85 3.21 Favored 'General case' 0 C--N 1.348 0.509 0 C-N-CA 124.448 1.099 . . . . 0.0 108.706 -178.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.524 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 41.9 mt-10 -79.07 122.49 26.28 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.372 -175.082 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.432 HG13 ' HA ' ' A' ' 64' ' ' SER . 46.1 pt -135.69 -176.55 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.85 0 C-N-CA 124.962 1.305 . . . . 0.0 108.954 178.254 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 23.8 p -81.4 152.48 27.42 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-O 120.878 0.37 . . . . 0.0 110.211 170.244 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.749 HD12 ' SG ' ' A' ' 11' ' ' CYS . 6.3 tt -63.86 -29.82 70.97 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.064 175.716 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -63.9 -44.75 92.05 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.85 176.039 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -60.63 -32.12 71.29 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 122.921 0.488 . . . . 0.0 110.973 -177.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.11 -35.87 81.66 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.05 0.94 . . . . 0.0 112.748 178.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 59.5 mt -76.41 -38.11 31.96 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 O-C-N 123.648 0.593 . . . . 0.0 110.621 -176.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.21 -56.94 3.11 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 122.894 0.478 . . . . 0.0 112.069 -177.675 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -98.21 29.78 3.4 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.11 0.964 . . . . 0.0 110.651 -169.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.461 ' HB1' ' HB1' ' A' ' 24' ' ' ALA . . . -43.74 -63.08 0.91 Allowed 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.35 1.06 . . . . 0.0 113.316 -176.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.96 -34.04 75.39 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.357 -179.53 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.445 ' O ' ' HG2' ' A' ' 98' ' ' GLU . . . -63.83 -47.48 85.77 Favored Glycine 0 C--N 1.353 1.52 0 O-C-N 124.127 0.892 . . . . 0.0 112.613 -179.321 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 19.1 mt -61.7 -53.54 46.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 123.947 0.899 . . . . 0.0 110.461 -177.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.49 HG13 HD12 ' A' ' 5' ' ' LEU . 1.9 mp -55.78 -51.04 64.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 O-C-N 124.015 0.822 . . . . 0.0 110.439 -178.615 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.72 -28.29 67.53 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 123.565 0.54 . . . . 0.0 111.781 -176.074 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.445 ' HG2' ' O ' ' A' ' 94' ' ' GLY . 63.6 mm-40 -62.0 -37.17 83.83 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.304 0.642 . . . . 0.0 109.857 174.34 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . 0.512 HG23 HG21 ' A' ' 60' ' ' ILE . 33.7 mt -79.75 -37.84 18.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.622 -178.413 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.689 ' HG2' ' HH ' ' A' ' 34' ' ' TYR . 32.2 mt-10 -60.17 -41.44 92.84 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.276 0.631 . . . . 0.0 110.974 178.191 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -74.55 -31.95 62.27 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 123.406 0.441 . . . . 0.0 110.988 -178.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 67.7 mtm -66.1 -37.95 87.02 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 122.562 0.345 . . . . 0.0 111.07 172.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.445 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 45.1 mt -69.89 -40.63 79.05 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.855 0 C-N-CA 123.161 0.584 . . . . 0.0 109.555 175.439 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.12 -18.61 64.68 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.503 0.721 . . . . 0.0 111.212 177.159 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 33.3 t -86.61 -41.48 14.23 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.421 0.688 . . . . 0.0 110.849 179.052 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.445 ' HG2' ' HA ' ' A' ' 103' ' ' ILE . 18.6 pt-20 -77.26 -28.4 53.54 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 122.828 0.451 . . . . 0.0 111.504 -176.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 79.1 mm-40 -87.99 -36.83 16.82 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 122.923 0.489 . . . . 0.0 111.044 -179.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 85.0 mm-40 . . . . . 0 N--CA 1.478 0.951 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 176.436 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.6 mtt . . . . . 0 N--CA 1.48 1.07 0 N-CA-C 110.484 -0.191 . . . . 0.0 110.484 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.8 t -64.08 99.6 0.27 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.789 0.836 . . . . 0.0 111.131 -177.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.576 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 17.1 pttt -106.08 176.73 5.07 Favored 'General case' 0 C--O 1.251 1.178 0 C-N-CA 123.514 0.726 . . . . 0.0 111.271 177.343 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.567 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.0 tmtp? -147.53 146.01 29.3 Favored 'General case' 0 CA--C 1.55 0.944 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.257 -172.104 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.417 ' N ' ' HD3' ' A' ' 4' ' ' LYS . 8.5 tt -132.8 135.74 45.86 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.608 1.163 . . . . 0.0 108.116 176.116 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 20.4 pt -125.51 162.8 27.77 Favored 'Isoleucine or valine' 0 C--O 1.242 0.682 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 170.134 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.527 ' HB1' HG12 ' A' ' 38' ' ' ILE . . . -150.81 170.54 19.01 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 122.986 0.514 . . . . 0.0 110.028 177.184 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.7 tt -143.91 121.92 12.1 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 107.489 -1.301 . . . . 0.0 107.489 -178.114 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.542 ' HA ' ' O ' ' A' ' 64' ' ' SER . 64.0 m -114.8 113.62 24.48 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.874 0.87 . . . . 0.0 108.984 178.274 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.416 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -126.88 117.83 23.38 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 -174.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.74 ' SG ' HD12 ' A' ' 85' ' ' LEU . 71.5 m -118.33 144.59 35.39 Favored Pre-proline 0 N--CA 1.481 1.095 0 C-N-CA 124.687 1.195 . . . . 0.0 110.039 176.5 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -80.81 -8.99 13.32 Favored 'Trans proline' 0 C--N 1.368 1.597 0 C-N-CA 122.658 2.239 . . . . 0.0 112.671 172.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 53.5 tpp -78.71 -66.7 0.83 Allowed 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.559 0.743 . . . . 0.0 109.873 176.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 179.92 -172.84 44.47 Favored Glycine 0 C--N 1.342 0.885 0 CA-C-N 115.569 -0.741 . . . . 0.0 112.24 -176.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 89.5 mt -82.39 -13.64 56.51 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.231 0.826 . . . . 0.0 113.231 -174.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.08 -49.92 75.24 Favored 'General case' 0 CA--C 1.556 1.207 0 CA-C-O 121.098 0.475 . . . . 0.0 112.163 -179.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.47 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 10.0 t-160 -67.88 -39.44 83.69 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.103 -178.915 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 30.9 p -65.56 -32.41 73.99 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.053 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 14.7 m-30 -73.76 -30.43 62.78 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.484 0.714 . . . . 0.0 112.109 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 67.8 mtm -70.18 -36.48 74.68 Favored 'General case' 0 N--CA 1.487 1.423 0 CA-C-O 120.674 0.274 . . . . 0.0 110.452 173.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.26 -38.13 75.07 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.754 173.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.84 -42.5 81.34 Favored 'General case' 0 C--O 1.214 -0.768 0 C-N-CA 123.735 0.814 . . . . 0.0 110.575 -179.157 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.461 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 20.2 tp60 -64.79 -44.49 89.8 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 122.949 0.499 . . . . 0.0 109.875 177.672 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.53 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -62.45 -51.79 66.1 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.836 -176.295 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 98.5 mt -67.48 -29.98 69.57 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.581 0.752 . . . . 0.0 111.511 178.402 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.479 ' HA ' HG21 ' A' ' 36' ' ' VAL . 32.1 tt0 -60.36 -58.54 8.07 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 123.713 0.633 . . . . 0.0 109.432 176.377 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 23' ' ' GLN . 12.1 mm-40 -51.31 -50.35 59.53 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 124.746 1.279 . . . . 0.0 110.736 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.407 ' HB1' ' HA ' ' A' ' 93' ' ' ALA . . . -55.82 -49.73 72.47 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.596 1.159 . . . . 0.0 112.153 -179.359 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.53 -29.83 70.52 Favored 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 176.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 26' ' ' GLU . 53.2 t -72.45 -36.65 55.17 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -179.54 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.445 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 14.1 mm-40 -71.37 -31.43 67.3 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.466 1.106 . . . . 0.0 110.801 177.549 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.77 -23.23 60.79 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.749 0.819 . . . . 0.0 111.616 175.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.13 23.21 27.86 Favored Glycine 0 C--N 1.348 1.2 0 N-CA-C 114.953 0.741 . . . . 0.0 114.953 166.003 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.576 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -118.29 178.03 4.59 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.294 0.638 . . . . 0.0 110.889 169.821 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.567 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 43.0 tt0 -74.51 147.47 41.83 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.432 178.124 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.479 HG21 ' HA ' ' A' ' 26' ' ' GLU . 15.0 p -127.12 139.33 52.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 122.756 0.422 . . . . 0.0 110.176 178.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.2 tptt -145.96 110.04 4.94 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 173.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.527 HG12 ' HB1' ' A' ' 7' ' ' ALA . 47.3 mt -115.07 111.33 35.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 C-N-CA 122.734 0.413 . . . . 0.0 111.338 -176.68 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.42 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 32.7 tt0 -73.51 145.66 45.44 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.448 0.699 . . . . 0.0 109.195 169.415 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.408 HG22 ' HB2' ' A' ' 9' ' ' CYS . 13.3 p -129.69 113.96 15.41 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 123.699 0.799 . . . . 0.0 108.877 -179.839 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.417 HE22 ' HB2' ' A' ' 70' ' ' GLU . 45.2 mt-30 -105.21 143.64 33.11 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.264 0.626 . . . . 0.0 110.223 179.441 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . 0.403 ' HA2' ' O ' ' A' ' 11' ' ' CYS . . . -162.17 163.05 34.7 Favored Glycine 0 C--N 1.336 0.544 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.928 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.51 -23.61 67.47 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.186 0.595 . . . . 0.0 110.924 173.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -73.52 -35.06 65.53 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 124.431 1.092 . . . . 0.0 111.278 175.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 160.4 -174.46 37.12 Favored Glycine 0 C--N 1.347 1.174 0 CA-C-N 116.135 -0.484 . . . . 0.0 112.332 -178.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 76.7 mt -123.36 134.9 64.95 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 123.439 0.696 . . . . 0.0 109.153 174.471 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -127.77 149.99 50.01 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.313 1.045 . . . . 0.0 109.675 -178.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 6.8 t30 61.7 40.13 13.5 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 124.504 1.122 . . . . 0.0 110.58 173.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 16.1 tpp180 -47.81 122.59 5.11 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 125.576 1.55 . . . . 0.0 112.603 -176.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.42 ' HG ' ' HB2' ' A' ' 39' ' ' GLU . 42.4 mt -69.39 133.6 47.99 Favored 'General case' 0 C--O 1.241 0.657 0 C-N-CA 124.419 1.088 . . . . 0.0 111.032 174.712 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 44.8 p -91.7 163.37 14.11 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 115.113 -0.948 . . . . 0.0 109.085 175.006 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.33 -26.46 66.59 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 122.527 0.331 . . . . 0.0 110.895 173.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.409 HE21 ' HG3' ' A' ' 57' ' ' GLU . 23.2 tp60 -70.0 -43.34 71.59 Favored 'General case' 0 C--N 1.355 0.834 0 C-N-CA 123.788 0.835 . . . . 0.0 110.634 177.039 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 45.0 m-20 -58.18 -43.21 87.39 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 122.807 0.443 . . . . 0.0 110.677 176.24 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 22.9 mt -70.24 -27.76 33.2 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 O-C-N 123.986 0.804 . . . . 0.0 110.614 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.47 -40.51 42.85 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.916 0.886 . . . . 0.0 111.817 179.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.409 ' HG3' HE21 ' A' ' 53' ' ' GLN . 46.6 mt-10 -74.4 -32.0 62.54 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.903 0.881 . . . . 0.0 111.117 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -52.75 99.37 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.658 0 O-C-N 124.747 1.279 . . . . 0.0 113.099 -171.177 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 26.1 m -62.42 -34.5 76.87 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 123.551 0.741 . . . . 0.0 109.163 167.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.476 HG22 HG23 ' A' ' 99' ' ' ILE . 76.7 mt -132.33 140.54 47.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.397 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.413 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 21.8 mt -130.38 139.06 52.3 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 172.072 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -126.81 128.95 71.38 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 173.631 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 13.5 m170 -103.54 86.97 2.73 Favored 'General case' 0 N--CA 1.489 1.49 0 CA-C-N 118.853 0.751 . . . . 0.0 109.486 169.457 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.542 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 19.6 m -82.86 82.4 8.17 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 124.653 1.181 . . . . 0.0 109.631 175.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 26.9 m -127.8 163.88 30.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-O 121.643 0.735 . . . . 0.0 111.719 -169.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -117.73 -14.9 10.15 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 114.322 -1.308 . . . . 0.0 109.594 174.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 15.2 m -132.07 177.99 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 125.283 1.433 . . . . 0.0 109.359 178.356 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 81.1 m -72.76 114.89 34.5 Favored Pre-proline 0 CA--C 1.545 0.767 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 167.235 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.616 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 33.3 Cg_endo -68.94 146.65 65.99 Favored 'Trans proline' 0 C--N 1.374 1.908 0 C-N-CA 121.788 1.659 . . . . 0.0 110.574 174.747 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.417 ' HB2' HE22 ' A' ' 41' ' ' GLN . 20.1 mm-40 -65.13 -33.7 76.65 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-O 121.387 0.613 . . . . 0.0 111.142 -172.668 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -96.85 9.8 40.81 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.778 -174.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.616 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 8.5 t30 -55.28 -34.98 64.57 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 124.112 0.965 . . . . 0.0 112.016 179.016 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -59.55 -22.91 62.37 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 124.993 1.317 . . . . 0.0 113.444 177.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 29.3 mtp180 -87.13 -18.71 29.82 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.877 0.871 . . . . 0.0 111.103 -178.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.427 ' HB3' HG21 ' A' ' 80' ' ' VAL . 70.6 m-85 -102.56 7.71 39.99 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 124.191 0.996 . . . . 0.0 110.745 178.31 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.8 tp10 -57.48 -51.01 71.17 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 124.696 1.198 . . . . 0.0 112.453 -172.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 56.6 p -86.94 -10.55 52.99 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.226 0.61 . . . . 0.0 112.145 -177.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 26.6 mmt180 -89.72 157.3 18.03 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.59 0.756 . . . . 0.0 110.998 -177.109 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -78.28 95.73 5.09 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.491 0.716 . . . . 0.0 110.946 -174.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.427 HG21 ' HB3' ' A' ' 75' ' ' PHE . 44.6 t -110.85 140.91 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 123.398 0.679 . . . . 0.0 110.784 -177.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -109.53 91.3 3.59 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 124.511 1.124 . . . . 0.0 108.95 176.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -76.78 133.0 39.55 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.128 -177.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.409 HG13 ' HA ' ' A' ' 64' ' ' SER . 31.5 pt -145.06 -173.25 0.46 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.838 0 C-N-CA 125.371 1.468 . . . . 0.0 108.438 176.168 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 35.5 p -86.78 153.54 21.6 Favored 'General case' 0 C--O 1.24 0.591 0 CA-C-O 121.211 0.529 . . . . 0.0 110.274 169.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.74 HD12 ' SG ' ' A' ' 11' ' ' CYS . 6.0 tt -66.27 -29.75 70.04 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.702 176.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -59.31 -45.93 89.97 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 123.884 0.874 . . . . 0.0 110.957 172.23 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -62.35 -33.35 74.55 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 123.894 0.746 . . . . 0.0 110.981 -179.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.476 ' HB2' ' HB3' ' A' ' 64' ' ' SER . . . -63.54 -31.51 72.7 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.79 0.836 . . . . 0.0 112.557 179.594 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 74.1 mt -79.21 -57.05 5.72 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.218 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.72 -47.43 53.95 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 115.865 -0.607 . . . . 0.0 112.167 -173.68 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -105.16 22.91 14.51 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.156 0.983 . . . . 0.0 110.962 -170.483 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.53 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -39.42 -61.98 0.73 Allowed 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 124.796 1.238 . . . . 0.0 113.985 -174.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.407 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . . . -68.65 -30.82 69.61 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 114.564 -1.198 . . . . 0.0 111.345 -178.242 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.54 -45.24 95.2 Favored Glycine 0 C--N 1.35 1.342 0 O-C-N 123.942 0.776 . . . . 0.0 111.939 179.251 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 13.5 mt -60.79 -56.05 20.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.338 1.055 . . . . 0.0 110.471 -179.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.7 mp -56.23 -49.76 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 O-C-N 123.781 0.675 . . . . 0.0 111.011 -178.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.62 -27.69 66.25 Favored 'General case' 0 N--CA 1.485 1.318 0 O-C-N 123.294 0.371 . . . . 0.0 111.342 -176.77 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -62.33 -42.03 99.05 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.418 0.687 . . . . 0.0 109.856 175.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . 0.476 HG23 HG22 ' A' ' 60' ' ' ILE . 25.9 mt -76.83 -36.46 26.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 -176.01 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -61.77 -44.14 97.47 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-N 114.539 -1.209 . . . . 0.0 111.794 176.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -76.4 -29.52 57.13 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 123.123 0.264 . . . . 0.0 110.904 -176.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 69.0 mtm -69.0 -54.12 16.92 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 122.749 0.42 . . . . 0.0 110.313 176.051 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 62.5 mt -60.36 -45.92 95.8 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 123.165 0.586 . . . . 0.0 110.263 178.529 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.486 ' O ' ' HG2' ' A' ' 108' ' ' GLN . . . -56.08 -48.5 75.97 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 122.869 0.467 . . . . 0.0 110.811 179.375 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 22.9 t -63.73 -43.01 97.8 Favored 'General case' 0 N--CA 1.48 1.038 0 O-C-N 123.785 0.678 . . . . 0.0 111.614 -171.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -74.54 -23.84 58.86 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.887 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -87.51 -19.05 28.48 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.655 0.382 . . . . 0.0 111.093 175.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' A' ' 104' ' ' ALA . 86.0 mm-40 . . . . . 0 C--O 1.253 1.264 0 C-N-CA 123.369 0.668 . . . . 0.0 109.236 173.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.45 ' N ' ' SD ' ' A' ' 1' ' ' MET . 3.3 mpp? . . . . . 0 N--CA 1.485 1.314 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.0 t -102.41 179.07 4.41 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.331 0.653 . . . . 0.0 109.596 173.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.555 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 5.8 pttt -138.18 -168.12 2.3 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.961 0.905 . . . . 0.0 110.178 -168.782 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.567 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.6 tmtp? -145.14 144.08 30.7 Favored 'General case' 0 CA--C 1.556 1.208 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 -178.319 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.45 ' N ' ' HD3' ' A' ' 4' ' ' LYS . 9.1 tt -130.04 136.56 49.51 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.03 1.332 . . . . 0.0 107.583 174.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.459 HG13 HG21 ' A' ' 61' ' ' ILE . 21.4 pt -126.76 159.67 36.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 170.658 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.558 ' HB2' HG12 ' A' ' 38' ' ' ILE . . . -149.23 166.33 29.21 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 123.001 0.52 . . . . 0.0 110.107 177.052 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.551 HD23 ' HG3' ' A' ' 41' ' ' GLN . 3.1 tt -139.3 112.16 7.91 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 -178.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.555 ' HA ' ' O ' ' A' ' 64' ' ' SER . 62.9 m -99.94 114.31 27.48 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.9 0.88 . . . . 0.0 109.39 175.151 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.447 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -131.04 122.82 27.44 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 122.768 0.427 . . . . 0.0 111.208 -179.165 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.752 ' SG ' HD12 ' A' ' 85' ' ' LEU . 1.2 m -134.88 148.15 65.84 Favored Pre-proline 0 N--CA 1.478 0.945 0 C-N-CA 123.844 0.858 . . . . 0.0 110.619 178.495 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -79.57 -12.49 13.8 Favored 'Trans proline' 0 C--N 1.373 1.856 0 C-N-CA 122.74 2.294 . . . . 0.0 111.243 173.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 45.7 mtt -65.51 -42.59 91.88 Favored 'General case' 0 C--N 1.352 0.68 0 C-N-CA 125.086 1.354 . . . . 0.0 109.746 177.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 141.94 -177.94 21.04 Favored Glycine 0 C--N 1.348 1.233 0 CA-C-N 115.483 -0.781 . . . . 0.0 111.962 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 29.9 mt -73.36 -25.04 60.43 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -177.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.66 -41.99 91.84 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-O 121.091 0.472 . . . . 0.0 111.049 179.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.527 ' ND1' HD21 ' A' ' 85' ' ' LEU . 12.9 t-80 -67.77 -42.64 81.41 Favored 'General case' 0 C--O 1.251 1.133 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.282 179.305 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.411 ' HA ' HD11 ' A' ' 85' ' ' LEU . 43.5 p -66.5 -30.4 70.72 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 115.085 -0.961 . . . . 0.0 111.214 -179.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 18.8 m-30 -71.12 -32.66 69.28 Favored 'General case' 0 C--N 1.351 0.639 0 C-N-CA 123.317 0.647 . . . . 0.0 110.967 179.027 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 47.6 mtm -65.65 -39.3 91.25 Favored 'General case' 0 N--CA 1.486 1.335 0 CA-C-O 120.74 0.305 . . . . 0.0 110.713 176.126 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.22 -37.65 72.02 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.417 174.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.54 -38.55 91.4 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.717 0.807 . . . . 0.0 110.816 179.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 7.6 tp-100 -68.98 -45.65 70.08 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.027 0.531 . . . . 0.0 110.173 179.042 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.43 ' HB1' ' HB1' ' A' ' 92' ' ' ALA . . . -59.93 -57.21 13.86 Favored 'General case' 0 C--O 1.242 0.675 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.298 -177.785 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.424 HD13 ' OG ' ' A' ' 64' ' ' SER . 94.7 mt -64.2 -32.0 73.41 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.005 0.522 . . . . 0.0 111.852 -178.58 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.501 ' HA ' HG21 ' A' ' 36' ' ' VAL . 32.4 tt0 -61.64 -56.39 20.35 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 110.121 -0.326 . . . . 0.0 110.121 -179.283 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.453 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 44.5 mm-40 -54.02 -49.07 69.73 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 124.584 1.177 . . . . 0.0 111.502 179.229 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.44 ' HB1' HD13 ' A' ' 96' ' ' ILE . . . -65.48 -36.19 83.14 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.438 0.695 . . . . 0.0 112.099 -176.603 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.93 -24.13 58.45 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.06 0.544 . . . . 0.0 111.896 177.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.489 HG21 ' O ' ' A' ' 26' ' ' GLU . 54.5 t -68.68 -41.34 82.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 174.34 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 10.0 mm-40 -70.33 -25.9 63.51 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 114.027 -1.442 . . . . 0.0 111.185 179.363 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -82.77 -2.17 53.68 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 123.474 0.71 . . . . 0.0 112.407 178.229 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 87.84 17.72 57.57 Favored Glycine 0 C--N 1.35 1.346 0 N-CA-C 115.675 1.03 . . . . 0.0 115.675 164.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.555 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -130.16 175.37 8.97 Favored 'General case' 0 N--CA 1.484 1.263 0 CA-C-N 117.908 0.854 . . . . 0.0 112.639 175.579 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.567 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 37.0 tt0 -72.21 149.29 44.75 Favored 'General case' 0 C--N 1.353 0.737 0 CA-C-N 114.675 -1.148 . . . . 0.0 108.95 175.435 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.501 HG21 ' HA ' ' A' ' 26' ' ' GLU . 8.1 p -133.16 135.52 56.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 122.65 0.38 . . . . 0.0 110.2 -179.553 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 49.6 tptt -142.4 113.9 7.86 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 175.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.558 HG12 ' HB2' ' A' ' 7' ' ' ALA . 43.1 mt -116.78 110.35 31.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 122.838 0.455 . . . . 0.0 111.699 -176.325 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -74.0 144.97 44.94 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.421 0.688 . . . . 0.0 109.192 172.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 10.6 p -128.9 113.89 15.8 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.772 0.829 . . . . 0.0 109.46 -177.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.551 ' HG3' HD23 ' A' ' 8' ' ' LEU . 8.1 mt-30 -109.82 141.42 42.52 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 177.611 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -165.35 -177.22 37.58 Favored Glycine 0 C--O 1.241 0.593 0 N-CA-C 111.836 -0.506 . . . . 0.0 111.836 179.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.02 -31.9 70.38 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.366 0.666 . . . . 0.0 111.271 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -66.33 -40.38 89.85 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.447 0.699 . . . . 0.0 110.951 177.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 150.27 -158.6 27.75 Favored Glycine 0 C--N 1.344 1.023 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.989 -176.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 66.1 mt -116.14 137.48 49.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 C-N-CA 123.578 0.751 . . . . 0.0 109.556 179.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -136.83 151.11 48.77 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.111 0.964 . . . . 0.0 109.308 -176.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 17.2 t30 60.61 36.27 19.77 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 124.105 0.962 . . . . 0.0 110.242 177.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 14.5 tpp180 -43.59 125.63 4.1 Favored 'General case' 0 C--N 1.362 1.109 0 C-N-CA 126.292 1.837 . . . . 0.0 113.269 -174.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 50.1 mt -77.61 128.46 34.16 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.724 171.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 45.2 p -96.15 165.51 12.19 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.313 -0.858 . . . . 0.0 108.843 176.057 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.95 -29.94 67.51 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 122.697 0.399 . . . . 0.0 111.463 178.081 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.411 HE21 ' HG3' ' A' ' 57' ' ' GLU . 26.5 tp60 -62.65 -41.47 99.06 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.839 0.856 . . . . 0.0 111.508 176.632 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.406 ' HB3' HG23 ' A' ' 6' ' ' ILE . 56.5 m-20 -63.81 -45.09 91.23 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 122.98 0.512 . . . . 0.0 110.545 176.835 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 10.5 mt -69.11 -28.54 39.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 O-C-N 123.836 0.71 . . . . 0.0 110.847 -178.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.68 -44.97 61.12 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.721 0.808 . . . . 0.0 111.216 -179.114 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.411 ' HG3' HE21 ' A' ' 53' ' ' GLN . 40.9 mt-10 -84.24 -11.19 56.89 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.303 0.641 . . . . 0.0 111.643 -179.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.44 100.67 0.19 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.107 0.563 . . . . 0.0 111.83 -177.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 32.5 m -61.9 -40.94 97.17 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.218 168.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.498 HG23 HG23 ' A' ' 99' ' ' ILE . 68.4 mt -128.47 140.19 49.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.239 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.459 HG21 HG13 ' A' ' 6' ' ' ILE . 20.4 mt -131.21 133.8 62.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 171.75 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.4 mp -120.7 136.05 58.96 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 173.374 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . 0.484 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 8.5 m170 -107.76 86.37 2.29 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 167.544 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.555 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 33.9 m -79.22 79.91 5.62 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 114.529 -1.214 . . . . 0.0 109.208 175.598 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 36.0 m -127.54 161.09 35.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 121.553 0.692 . . . . 0.0 112.034 -169.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -118.34 -17.19 9.53 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.33 1.452 . . . . 0.0 108.751 174.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 11.8 m -133.93 160.1 42.07 Favored 'Isoleucine or valine' 0 C--N 1.35 0.621 0 C-N-CA 125.399 1.48 . . . . 0.0 109.096 175.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 41.6 m -69.78 109.98 5.69 Favored Pre-proline 0 CA--C 1.554 1.115 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 174.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -67.13 149.36 82.02 Favored 'Trans proline' 0 C--N 1.379 2.14 0 C-N-CA 122.381 2.054 . . . . 0.0 111.455 -177.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -61.64 -31.64 71.75 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.223 0.609 . . . . 0.0 111.938 -171.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -104.14 21.24 16.85 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.482 0.713 . . . . 0.0 111.707 -175.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -60.66 -28.92 68.95 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.15 0.58 . . . . 0.0 111.841 -176.497 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -58.14 -32.59 68.32 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.164 0.985 . . . . 0.0 113.264 -179.103 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 74.4 mtt-85 -61.24 -38.53 87.01 Favored 'General case' 0 N--CA 1.483 1.224 0 CA-C-O 121.944 0.878 . . . . 0.0 110.52 177.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.418 ' HB3' HG21 ' A' ' 80' ' ' VAL . 41.0 m-85 -94.97 -19.83 19.89 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 113.794 -1.548 . . . . 0.0 111.001 -172.419 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -62.18 -30.08 70.81 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.171 0.988 . . . . 0.0 111.322 -176.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 22.6 t -81.53 -7.22 59.56 Favored 'General case' 0 CA--C 1.554 1.109 0 C-N-CA 123.824 0.849 . . . . 0.0 111.675 178.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 14.5 mmt85 -116.95 169.74 9.16 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.292 1.037 . . . . 0.0 110.24 -171.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -78.53 96.44 5.44 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.257 0.623 . . . . 0.0 110.801 -178.19 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.418 HG21 ' HB3' ' A' ' 75' ' ' PHE . 43.0 t -119.22 142.13 35.89 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 123.837 0.855 . . . . 0.0 110.674 -177.07 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 -108.8 94.01 4.82 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 177.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.484 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 38.8 mt-10 -83.06 114.17 21.11 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 115.267 -0.878 . . . . 0.0 110.956 -173.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.455 HD13 ' HG ' ' A' ' 64' ' ' SER . 45.6 pt -125.14 -173.84 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 124.74 1.216 . . . . 0.0 109.792 -179.017 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 20.3 p -83.55 149.14 26.78 Favored 'General case' 0 C--N 1.345 0.38 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.17 168.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.752 HD12 ' SG ' ' A' ' 11' ' ' CYS . 7.2 tt -63.68 -32.49 73.99 Favored 'General case' 0 N--CA 1.486 1.352 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.247 178.391 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.425 ' HG2' ' HE3' ' A' ' 90' ' ' LYS . 29.8 tt0 -61.22 -43.35 99.01 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.932 175.576 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -60.55 -31.31 70.42 Favored 'General case' 0 C--N 1.359 1.017 0 O-C-N 123.857 0.723 . . . . 0.0 110.825 179.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.49 -40.79 89.47 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.494 0.718 . . . . 0.0 111.908 177.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 63.0 mt -69.65 -42.01 80.33 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.899 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.57 -176.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.425 ' HE3' ' HG2' ' A' ' 86' ' ' GLN . 18.2 ptpt -87.56 -46.69 9.34 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 122.823 0.449 . . . . 0.0 112.191 -176.085 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -108.48 27.17 9.64 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 124.012 0.925 . . . . 0.0 110.946 -167.194 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.43 ' HB1' ' HB1' ' A' ' 24' ' ' ALA . . . -43.23 -57.96 2.73 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 124.383 1.073 . . . . 0.0 113.066 -177.448 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.37 -42.93 99.8 Favored 'General case' 0 C--N 1.344 0.357 0 CA-C-N 114.696 -1.138 . . . . 0.0 110.878 178.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -59.11 -47.6 89.99 Favored Glycine 0 C--N 1.352 1.462 0 O-C-N 124.269 0.98 . . . . 0.0 113.153 -176.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.402 ' O ' HG13 ' A' ' 99' ' ' ILE . 14.4 mt -62.84 -55.75 21.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 123.946 0.898 . . . . 0.0 109.647 -177.375 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.44 HD13 ' HB1' ' A' ' 28' ' ' ALA . 69.2 mt -58.92 -46.62 91.25 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 CA-C-N 114.139 -1.391 . . . . 0.0 111.357 -175.165 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.54 -31.49 69.74 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 122.63 0.372 . . . . 0.0 110.645 -178.481 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -58.48 -44.02 89.18 Favored 'General case' 0 C--N 1.366 1.303 0 C-N-CA 123.369 0.668 . . . . 0.0 109.542 173.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . 0.498 HG23 HG23 ' A' ' 60' ' ' ILE . 34.2 mt -76.41 -30.64 19.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.558 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 -174.598 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -62.5 -47.27 84.7 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.252 1.021 . . . . 0.0 111.772 175.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -74.35 -36.49 63.62 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 123.454 0.471 . . . . 0.0 110.624 -177.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 6.4 mtp -66.58 -52.83 41.12 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.179 0.991 . . . . 0.0 111.136 178.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.435 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 31.0 mt -66.33 -35.35 74.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.898 177.432 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.527 ' O ' ' HG2' ' A' ' 108' ' ' GLN . . . -58.61 -45.03 90.03 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 118.072 0.396 . . . . 0.0 110.377 174.662 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 22.7 t -67.56 -35.12 78.42 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.54 0.736 . . . . 0.0 111.312 -172.275 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.435 ' HG2' ' HA ' ' A' ' 103' ' ' ILE . 9.5 pt-20 -79.1 -28.45 43.01 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 116.763 -0.199 . . . . 0.0 111.307 177.171 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.416 ' HG2' ' O ' ' A' ' 103' ' ' ILE . 13.7 mm-40 -79.34 -11.35 59.93 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 122.541 0.336 . . . . 0.0 110.957 176.477 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.527 ' HG2' ' O ' ' A' ' 104' ' ' ALA . 80.4 mm-40 . . . . . 0 C--O 1.258 1.518 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 170.227 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.5 ttm . . . . . 0 N--CA 1.486 1.343 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 38.4 m -76.66 94.24 3.75 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 122.825 0.45 . . . . 0.0 110.199 178.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 40.6 pttt -74.34 167.16 22.2 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.53 179.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.549 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.6 tmtp? -144.06 131.82 21.34 Favored 'General case' 0 N--CA 1.486 1.338 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 -172.095 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.468 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 10.4 tt -126.09 138.47 53.7 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 178.498 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 20.4 pt -128.68 164.16 31.49 Favored 'Isoleucine or valine' 0 C--O 1.241 0.644 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 171.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.525 ' HB2' HG12 ' A' ' 38' ' ' ILE . . . -152.02 168.35 25.49 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.037 178.129 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.8 tt -141.15 114.93 9.03 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 107.058 -1.46 . . . . 0.0 107.058 -177.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.532 ' HA ' ' O ' ' A' ' 64' ' ' SER . 61.4 m -106.72 113.06 26.34 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 176.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.411 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -127.41 127.49 44.23 Favored 'General case' 0 N--CA 1.497 1.922 0 C-N-CA 122.482 0.313 . . . . 0.0 111.836 -175.696 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.778 ' SG ' HD11 ' A' ' 85' ' ' LEU . 50.1 m -125.21 144.78 48.47 Favored Pre-proline 0 N--CA 1.478 0.935 0 C-N-CA 124.48 1.112 . . . . 0.0 110.609 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -75.82 -14.65 19.35 Favored 'Trans proline' 0 C--N 1.37 1.695 0 C-N-CA 122.379 2.053 . . . . 0.0 112.244 173.055 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 54.8 tpp -83.46 -71.76 0.49 Allowed 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.277 0.631 . . . . 0.0 110.531 178.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -171.43 -175.37 39.77 Favored Glycine 0 C--N 1.347 1.178 0 C-N-CA 121.807 -0.235 . . . . 0.0 113.351 -176.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 60.7 mt -82.37 -17.68 44.74 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -173.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.0 -43.6 91.51 Favored 'General case' 0 N--CA 1.487 1.418 0 CA-C-N 119.074 0.852 . . . . 0.0 111.253 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.502 ' HA ' ' HE1' ' A' ' 20' ' ' MET . 18.2 t-160 -66.43 -43.04 86.75 Favored 'General case' 0 C--O 1.246 0.882 0 CA-C-N 115.015 -0.993 . . . . 0.0 110.199 178.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 31.8 p -66.42 -30.34 70.68 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 115.072 -0.967 . . . . 0.0 111.13 -178.22 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.1 m-30 -73.55 -32.11 64.01 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.328 0.651 . . . . 0.0 111.631 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' MET . . . . . 0.502 ' HE1' ' HA ' ' A' ' 17' ' ' HIS . 64.4 mtm -66.41 -38.98 88.68 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-O 120.788 0.328 . . . . 0.0 110.508 173.497 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.0 -40.58 82.99 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.89 174.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.36 -31.07 68.18 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.831 0.853 . . . . 0.0 110.963 -178.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 24.1 tp60 -67.8 -49.16 63.83 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.298 0.639 . . . . 0.0 109.404 177.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.475 ' HB3' ' HB1' ' A' ' 92' ' ' ALA . . . -66.3 -50.23 64.37 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-N 114.992 -1.004 . . . . 0.0 111.675 -174.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.408 HD11 ' OG ' ' A' ' 64' ' ' SER . 93.1 mt -64.46 -33.0 74.87 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.129 0.572 . . . . 0.0 111.643 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.422 ' O ' HG21 ' A' ' 30' ' ' VAL . 39.1 tt0 -58.3 -58.9 6.43 Favored 'General case' 0 C--N 1.353 0.747 0 O-C-N 123.838 0.711 . . . . 0.0 109.946 175.734 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -54.16 -47.37 72.03 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 124.602 1.189 . . . . 0.0 110.847 -177.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.13 -49.15 78.98 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.372 1.069 . . . . 0.0 111.991 -177.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.42 -21.4 61.99 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 113.329 0.862 . . . . 0.0 113.329 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.422 HG21 ' O ' ' A' ' 26' ' ' GLU . 54.1 t -77.6 -43.65 29.73 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.332 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 177.698 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -64.69 -32.44 74.12 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 114.902 -1.044 . . . . 0.0 110.36 174.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.24 -38.85 82.27 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.352 1.061 . . . . 0.0 111.344 175.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 109.32 22.17 6.93 Favored Glycine 0 C--N 1.342 0.908 0 CA-C-N 115.289 -0.869 . . . . 0.0 114.092 173.163 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.424 ' OH ' ' HG2' ' A' ' 100' ' ' GLU . 1.8 m-85 -95.63 162.95 13.4 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 117.974 0.887 . . . . 0.0 109.84 171.833 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.549 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 40.5 tt0 -75.98 122.82 24.76 Favored 'General case' 0 C--O 1.222 -0.361 0 N-CA-C 106.581 -1.637 . . . . 0.0 106.581 158.499 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.468 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 13.6 p -110.68 136.27 47.21 Favored 'Isoleucine or valine' 0 C--O 1.241 0.617 0 CA-C-N 118.173 0.442 . . . . 0.0 110.195 -173.16 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.1 tptt -143.77 113.84 7.3 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 178.003 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.525 HG12 ' HB2' ' A' ' 7' ' ' ALA . 38.1 mt -117.78 111.7 35.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 122.727 0.411 . . . . 0.0 111.488 -175.433 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -75.53 140.48 42.78 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.648 0.779 . . . . 0.0 109.193 169.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.8 p -123.38 121.94 37.05 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 123.642 0.777 . . . . 0.0 108.945 -179.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.441 HE22 ' HB2' ' A' ' 70' ' ' GLU . 41.1 mt-30 -116.18 151.96 34.66 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.396 0.679 . . . . 0.0 110.365 -178.565 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 179.74 178.33 48.39 Favored Glycine 0 C--N 1.336 0.547 0 CA-C-N 116.106 -0.497 . . . . 0.0 112.897 177.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.47 -25.87 68.46 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.53 0.732 . . . . 0.0 111.067 176.373 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -70.89 -36.08 72.59 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.821 0.848 . . . . 0.0 110.838 175.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 150.21 -162.47 29.24 Favored Glycine 0 C--N 1.349 1.26 0 CA-C-N 116.109 -0.496 . . . . 0.0 112.604 179.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 68.4 mt -120.87 136.86 56.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 124.009 0.924 . . . . 0.0 109.299 174.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -134.94 148.33 50.01 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.075 0.95 . . . . 0.0 109.244 -177.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 9.5 t30 61.92 42.75 9.9 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.501 1.12 . . . . 0.0 110.526 175.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -45.69 128.73 8.75 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 125.794 1.638 . . . . 0.0 113.686 -175.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 44.1 mt -80.47 136.86 36.4 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.583 1.153 . . . . 0.0 110.778 172.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 64.7 p -100.75 172.38 7.11 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.805 0.842 . . . . 0.0 110.375 179.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.75 -35.11 72.21 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.017 0.527 . . . . 0.0 111.201 174.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -58.94 -51.73 68.81 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.841 0.857 . . . . 0.0 111.112 175.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.447 ' O ' ' HB1' ' A' ' 58' ' ' ALA . 75.8 m-20 -59.9 -41.54 91.88 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.237 -175.499 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.433 HG21 ' HG3' ' A' ' 78' ' ' ARG . 50.6 mt -73.58 -42.96 55.52 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.243 0 C-N-CA 123.409 0.683 . . . . 0.0 111.676 -177.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.4 -39.4 71.18 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.215 0.606 . . . . 0.0 111.88 -173.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -93.02 -1.56 56.5 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.18 0.592 . . . . 0.0 111.549 -177.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.447 ' HB1' ' O ' ' A' ' 54' ' ' ASP . . . -64.45 110.11 2.17 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.056 0.542 . . . . 0.0 111.486 177.587 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 26.4 m -60.75 -37.77 82.91 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.083 0.953 . . . . 0.0 109.76 168.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.402 HD11 HD11 ' A' ' 5' ' ' LEU . 59.3 mt -134.47 144.65 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 C-N-CA 123.323 0.649 . . . . 0.0 110.857 177.208 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 21.6 mt -131.37 131.42 63.14 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 C-N-CA 124.07 0.948 . . . . 0.0 109.043 169.168 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -120.1 123.44 70.72 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 174.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . 0.52 ' HB2' ' HG3' ' A' ' 82' ' ' GLU . 18.1 m170 -97.62 84.06 3.33 Favored 'General case' 0 N--CA 1.488 1.457 0 CA-C-N 119.153 0.888 . . . . 0.0 109.736 170.75 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.532 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 28.4 m -79.25 82.83 5.36 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 114.649 -1.159 . . . . 0.0 109.535 175.15 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 32.1 m -127.43 158.1 38.87 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-O 121.379 0.609 . . . . 0.0 111.892 -170.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -103.86 -29.33 11.05 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.351 1.061 . . . . 0.0 109.037 174.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 13.6 m -131.62 169.11 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 125.066 1.346 . . . . 0.0 108.697 176.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 31.9 m -61.34 119.7 48.62 Favored Pre-proline 0 CA--C 1.551 1.014 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 174.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -68.23 151.53 76.65 Favored 'Trans proline' 0 C--N 1.373 1.829 0 C-N-CA 122.342 2.028 . . . . 0.0 110.643 173.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.441 ' HB2' HE22 ' A' ' 41' ' ' GLN . 10.2 mm-40 -63.46 -42.87 98.63 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-O 121.734 0.778 . . . . 0.0 109.84 -176.7 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.402 ' HB3' ' HG3' ' A' ' 74' ' ' ARG . 4.5 m-20 -91.01 21.97 3.94 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 114.809 -1.087 . . . . 0.0 112.402 -173.528 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.4 ' HA ' ' HE1' ' A' ' 63' ' ' HIS . 7.1 p30 -56.01 -33.22 64.67 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.037 0.935 . . . . 0.0 112.613 -177.166 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.96 -18.32 50.7 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.944 0.898 . . . . 0.0 112.64 -174.836 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.402 ' HG3' ' HB3' ' A' ' 71' ' ' ASP . 3.7 mtp85 -67.01 -28.99 68.7 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-O 121.419 0.628 . . . . 0.0 110.705 176.422 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 47.1 m-85 -97.99 -5.51 33.95 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.235 1.014 . . . . 0.0 111.488 -174.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -60.12 -33.68 72.47 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.937 0.895 . . . . 0.0 111.898 -175.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 34.5 p -70.96 -13.37 61.99 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.82 0.848 . . . . 0.0 112.621 179.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.433 ' HG3' HG21 ' A' ' 55' ' ' ILE . 31.5 mmt180 -117.61 177.99 4.55 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 124.074 0.95 . . . . 0.0 111.185 -174.392 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -89.16 100.95 13.63 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.918 0.887 . . . . 0.0 110.402 -177.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 38.4 t -106.97 149.78 10.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.054 -179.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -125.09 90.75 3.29 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 124.133 0.973 . . . . 0.0 108.46 178.082 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.52 ' HG3' ' HB2' ' A' ' 63' ' ' HIS . 1.8 mp0 -78.0 131.88 37.57 Favored 'General case' 0 C--N 1.355 0.847 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.651 -178.131 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.518 HD13 ' HB3' ' A' ' 87' ' ' ASP . 37.3 pt -141.45 -172.5 0.59 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.765 0 C-N-CA 125.58 1.552 . . . . 0.0 107.786 179.315 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 32.0 p -83.03 152.54 25.35 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 121.129 0.49 . . . . 0.0 110.077 168.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.778 HD11 ' SG ' ' A' ' 11' ' ' CYS . 6.7 tt -65.91 -29.37 69.78 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.192 177.281 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.424 ' O ' ' HG2' ' A' ' 90' ' ' LYS . 29.7 tt0 -64.79 -39.45 93.62 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.049 0.54 . . . . 0.0 110.581 174.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.518 ' HB3' HD13 ' A' ' 83' ' ' ILE . 7.5 t70 -59.47 -32.85 70.63 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 124.106 0.962 . . . . 0.0 110.797 178.729 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.427 ' HB1' ' HB3' ' A' ' 64' ' ' SER . . . -66.03 -39.36 90.14 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.417 0.687 . . . . 0.0 112.106 177.194 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 75.3 mt -70.7 -43.07 77.73 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.84 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.724 -177.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.424 ' HG2' ' O ' ' A' ' 86' ' ' GLN . 0.2 OUTLIER -91.68 -44.21 9.15 Favored 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -173.169 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -106.52 22.8 15.24 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.845 0.858 . . . . 0.0 110.829 -169.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.475 ' HB1' ' HB3' ' A' ' 24' ' ' ALA . . . -42.3 -60.93 1.31 Allowed 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 124.071 0.948 . . . . 0.0 112.991 -175.81 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.63 -38.32 84.38 Favored 'General case' 0 C--N 1.348 0.506 0 CA-C-N 115.201 -0.909 . . . . 0.0 111.005 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -61.84 -50.2 68.29 Favored Glycine 0 C--N 1.353 1.482 0 O-C-N 124.415 1.072 . . . . 0.0 112.803 -177.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 17.2 mt -54.4 -58.01 4.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 124.228 1.011 . . . . 0.0 110.415 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.462 ' O ' ' HG3' ' A' ' 100' ' ' GLU . 2.1 mp -57.36 -54.68 27.61 Favored 'Isoleucine or valine' 0 C--N 1.36 1.028 0 O-C-N 124.391 1.057 . . . . 0.0 110.81 -175.813 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.28 -29.86 70.72 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -175.203 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -67.41 -39.0 85.49 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.402 0.681 . . . . 0.0 110.355 177.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . 0.4 HG21 HG22 ' A' ' 60' ' ' ILE . 28.1 mt -75.71 -35.96 32.38 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.462 ' HG3' ' O ' ' A' ' 96' ' ' ILE . 28.4 mt-10 -60.31 -46.3 90.38 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.867 178.327 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -72.31 -31.02 65.33 Favored 'General case' 0 N--CA 1.48 1.03 0 O-C-N 123.594 0.559 . . . . 0.0 111.299 -177.039 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 71.0 mtm -64.4 -48.17 76.42 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-O 120.786 0.327 . . . . 0.0 110.584 173.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 63.9 mt -63.5 -46.17 95.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.038 176.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.24 -20.28 64.8 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.22 0.608 . . . . 0.0 111.627 -177.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 38.2 t -76.73 -41.33 45.49 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 122.65 0.38 . . . . 0.0 110.2 177.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -81.83 -21.59 37.53 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 122.925 0.49 . . . . 0.0 112.267 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 22.9 mm-40 -81.67 -47.66 12.7 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.311 0.644 . . . . 0.0 110.013 176.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 71.6 mm-40 . . . . . 0 C--O 1.251 1.16 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.988 -174.92 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.48 1.057 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.6 m -66.04 119.32 11.17 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 123.77 0.828 . . . . 0.0 111.482 -174.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 41.9 pttt -98.34 178.73 4.95 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.213 1.005 . . . . 0.0 111.298 -176.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.587 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.1 tmtp? -147.52 135.13 20.93 Favored 'General case' 0 CA--C 1.557 1.212 0 CA-C-O 121.291 0.567 . . . . 0.0 109.625 -173.647 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.457 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 10.1 tt -128.56 138.72 52.37 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.551 1.14 . . . . 0.0 108.339 178.007 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.509 HD11 HD13 ' A' ' 50' ' ' LEU . 20.2 pt -128.78 167.8 23.33 Favored 'Isoleucine or valine' 0 C--O 1.241 0.641 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 172.163 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.587 ' HB2' HG12 ' A' ' 38' ' ' ILE . . . -154.55 169.14 24.53 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.156 177.317 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.6 tt -140.23 116.45 10.55 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 177.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.518 ' HA ' ' O ' ' A' ' 64' ' ' SER . 77.9 m -106.18 115.08 29.6 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 177.347 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.421 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -129.65 116.77 19.33 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 122.819 0.448 . . . . 0.0 111.542 -175.652 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.704 ' SG ' HD13 ' A' ' 85' ' ' LEU . 1.7 m -124.84 143.14 42.89 Favored Pre-proline 0 N--CA 1.479 1.017 0 C-N-CA 124.495 1.118 . . . . 0.0 109.471 175.479 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -77.2 -7.08 16.99 Favored 'Trans proline' 0 C--N 1.375 1.947 0 C-N-CA 122.561 2.174 . . . . 0.0 112.486 -178.479 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 58.3 mtt -79.78 -49.19 12.37 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.353 1.061 . . . . 0.0 110.038 -178.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 162.03 -168.63 37.15 Favored Glycine 0 C--N 1.343 0.93 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.679 -178.038 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 60.4 mt -82.96 -17.72 42.53 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 113.364 0.876 . . . . 0.0 113.364 -176.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.28 -45.09 95.93 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-O 121.482 0.658 . . . . 0.0 111.205 -178.654 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.518 ' HA ' ' HE2' ' A' ' 20' ' ' MET . 1.9 t-80 -65.55 -40.87 93.33 Favored 'General case' 0 C--O 1.247 0.939 0 CA-C-N 114.646 -1.161 . . . . 0.0 110.214 -179.127 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 52.6 p -72.18 -31.79 66.25 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 114.402 -1.272 . . . . 0.0 111.027 -176.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 15.6 m-30 -68.92 -31.95 71.22 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.127 0.571 . . . . 0.0 111.043 178.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' MET . . . . . 0.518 ' HE2' ' HA ' ' A' ' 17' ' ' HIS . 54.5 mtm -67.76 -40.92 84.03 Favored 'General case' 0 N--CA 1.486 1.341 0 O-C-N 123.378 0.424 . . . . 0.0 110.883 174.872 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.97 -37.84 84.98 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.933 174.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.51 -38.98 81.41 Favored 'General case' 0 C--O 1.217 -0.653 0 C-N-CA 123.923 0.889 . . . . 0.0 110.797 179.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -63.69 -43.35 96.9 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.685 0.794 . . . . 0.0 110.158 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.606 ' HB1' ' HB3' ' A' ' 92' ' ' ALA . . . -61.05 -58.32 8.89 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 114.727 -1.124 . . . . 0.0 111.601 179.531 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 95.8 mt -66.92 -30.9 71.17 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.143 0.577 . . . . 0.0 112.164 -176.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.485 ' O ' HG22 ' A' ' 30' ' ' VAL . 36.7 tt0 -62.01 -61.29 2.59 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.062 0.545 . . . . 0.0 109.751 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.532 ' O ' ' HG3' ' A' ' 31' ' ' GLU . 16.5 mm-40 -51.01 -51.94 47.91 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 124.71 1.256 . . . . 0.0 111.661 179.754 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -62.85 -40.18 96.65 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.775 0.83 . . . . 0.0 112.572 -174.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.17 -27.91 61.05 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 122.895 0.478 . . . . 0.0 112.202 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.485 HG22 ' O ' ' A' ' 26' ' ' GLU . 77.7 t -64.1 -44.69 97.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 175.563 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.532 ' HG3' ' O ' ' A' ' 27' ' ' GLU . 18.9 mt-10 -70.23 -32.37 70.21 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 114.755 -1.111 . . . . 0.0 110.4 -179.555 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.78 -17.89 61.54 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.688 0.795 . . . . 0.0 111.636 176.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.81 22.17 11.34 Favored Glycine 0 C--N 1.346 1.114 0 N-CA-C 115.157 0.823 . . . . 0.0 115.157 165.018 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.418 ' CE2' HD12 ' A' ' 60' ' ' ILE . 0.0 OUTLIER -104.04 173.09 6.45 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-N 118.189 0.995 . . . . 0.0 110.522 172.159 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.587 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 43.2 tt0 -83.2 123.65 29.77 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 106.83 -1.544 . . . . 0.0 106.83 157.745 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.457 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 9.5 p -109.12 135.78 46.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 122.931 0.492 . . . . 0.0 110.247 -174.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 47.9 tptt -145.46 116.21 7.72 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 179.124 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.587 HG12 ' HB2' ' A' ' 7' ' ' ALA . 42.5 mt -120.19 110.92 30.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 122.896 0.478 . . . . 0.0 111.846 -172.587 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -79.38 118.89 21.69 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.401 0.68 . . . . 0.0 109.819 175.619 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 34.8 p -96.78 133.11 41.77 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.035 177.315 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.474 ' HG2' HG12 ' A' ' 46' ' ' ILE . 42.6 mt-30 -126.88 141.3 51.85 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.098 0.959 . . . . 0.0 109.537 178.307 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -173.33 177.97 45.49 Favored Glycine 0 C--N 1.335 0.524 0 CA-C-N 116.769 -0.196 . . . . 0.0 113.031 179.525 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.18 -25.94 67.37 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.899 0.88 . . . . 0.0 111.885 178.04 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -75.18 -33.54 61.47 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.74 0.816 . . . . 0.0 111.298 178.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 156.39 -160.52 30.25 Favored Glycine 0 C--N 1.348 1.207 0 O-C-N 123.371 0.42 . . . . 0.0 112.481 179.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.474 HG12 ' HG2' ' A' ' 41' ' ' GLN . 73.1 mt -127.12 135.27 64.04 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.244 0 C-N-CA 123.82 0.848 . . . . 0.0 108.885 172.178 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -136.95 155.0 50.29 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.205 0.602 . . . . 0.0 110.474 -175.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 20.4 t30 60.93 36.76 18.7 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.704 1.202 . . . . 0.0 110.15 177.144 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.45 ' NH1' HG22 ' A' ' 46' ' ' ILE . 19.1 tpp180 -48.66 123.23 6.5 Favored 'General case' 0 C--N 1.361 1.106 0 C-N-CA 125.157 1.383 . . . . 0.0 112.103 -174.747 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.509 HD13 HD11 ' A' ' 6' ' ' ILE . 39.8 mt -70.32 140.37 52.23 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 114.786 -1.097 . . . . 0.0 110.544 173.316 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.448 ' O ' HG13 ' A' ' 55' ' ' ILE . 52.9 p -94.84 161.04 14.33 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 172.557 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.11 -25.21 66.82 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 122.449 0.3 . . . . 0.0 110.813 174.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 25.3 tp60 -65.88 -45.61 81.42 Favored 'General case' 0 C--N 1.354 0.791 0 O-C-N 124.035 0.834 . . . . 0.0 110.485 173.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 -57.86 -44.55 86.65 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.181 0.592 . . . . 0.0 110.943 176.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.554 HD11 HH21 ' A' ' 74' ' ' ARG . 12.5 mt -71.91 -29.78 34.65 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 O-C-N 124.106 0.879 . . . . 0.0 110.738 -176.049 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.78 -46.24 46.78 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.345 0.658 . . . . 0.0 110.828 177.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -67.26 -27.67 67.4 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.855 0.862 . . . . 0.0 111.553 178.186 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -56.19 99.04 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.514 0 O-C-N 124.476 1.11 . . . . 0.0 112.255 -175.074 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 29.1 m -60.99 -37.94 84.26 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 114.553 -1.203 . . . . 0.0 109.237 168.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.418 HD12 ' CE2' ' A' ' 34' ' ' TYR . 83.9 mt -134.22 140.18 46.61 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 C-N-CA 123.854 0.862 . . . . 0.0 110.262 179.805 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.421 HG23 HG13 ' A' ' 6' ' ' ILE . 24.9 mt -129.02 137.18 57.86 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 175.512 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.8 mp -128.4 113.09 28.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 CA-C-N 118.567 0.621 . . . . 0.0 110.104 175.362 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 6.1 m170 -88.24 86.08 7.02 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 121.388 0.614 . . . . 0.0 109.781 173.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.518 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 19.0 m -78.71 79.48 5.13 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 114.67 -1.15 . . . . 0.0 109.52 175.824 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.421 ' O ' ' HA ' ' A' ' 84' ' ' THR . 35.9 m -124.98 157.07 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 CA-C-O 121.869 0.842 . . . . 0.0 111.858 -170.265 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -112.59 -16.42 12.84 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 114.318 -1.31 . . . . 0.0 109.053 173.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 19.2 m -130.4 168.55 23.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 125.604 1.561 . . . . 0.0 109.234 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 64.9 m -78.61 112.95 30.53 Favored Pre-proline 0 CA--C 1.546 0.824 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 170.327 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.442 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 37.6 Cg_endo -63.76 150.26 88.86 Favored 'Trans proline' 0 C--N 1.376 2.009 0 C-N-CA 122.757 2.305 . . . . 0.0 112.367 -177.657 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -67.11 -23.98 65.88 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.176 0.59 . . . . 0.0 110.858 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -102.58 15.6 28.79 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.268 -0.878 . . . . 0.0 112.202 -177.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.442 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 25.6 t30 -53.35 -38.7 63.51 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.742 0.817 . . . . 0.0 111.777 179.482 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.55 -30.29 71.2 Favored 'General case' 0 N--CA 1.482 1.156 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 -176.595 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.554 HH21 HD11 ' A' ' 55' ' ' ILE . 43.5 mtp180 -62.55 -39.36 93.38 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-O 121.385 0.612 . . . . 0.0 111.842 174.555 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -97.37 -8.46 29.49 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.392 -175.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -64.63 -33.32 75.67 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.257 1.023 . . . . 0.0 111.115 -177.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 64.2 p -75.15 -17.13 60.46 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.656 0.782 . . . . 0.0 111.847 177.079 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.429 ' HG3' HG21 ' A' ' 55' ' ' ILE . 25.2 mmt180 -104.03 160.17 15.06 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.092 0.957 . . . . 0.0 111.091 -170.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -77.01 101.41 6.01 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.137 0.575 . . . . 0.0 110.145 174.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 80.9 t -111.9 138.7 39.65 Favored 'Isoleucine or valine' 0 C--O 1.238 0.493 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.395 -179.405 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -98.98 89.46 4.29 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 172.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -82.3 128.09 33.87 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.221 -176.363 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.528 HD12 ' HB3' ' A' ' 87' ' ' ASP . 47.2 pt -133.13 -171.78 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 C-N-CA 124.674 1.19 . . . . 0.0 108.953 178.773 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.421 ' HA ' ' O ' ' A' ' 65' ' ' VAL . 18.0 p -86.55 151.43 23.48 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 122.638 0.375 . . . . 0.0 110.262 168.554 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.704 HD13 ' SG ' ' A' ' 11' ' ' CYS . 6.4 tt -63.59 -30.76 71.83 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.59 178.617 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.456 ' HG2' ' HE2' ' A' ' 90' ' ' LYS . 9.4 tt0 -63.44 -41.61 98.67 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.49 175.531 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.528 ' HB3' HD12 ' A' ' 83' ' ' ILE . 8.8 t70 -61.53 -31.43 71.45 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.713 0.805 . . . . 0.0 111.097 -178.874 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.2 -45.43 88.34 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.262 0.625 . . . . 0.0 111.259 175.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 74.1 mt -67.05 -43.09 89.12 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.959 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.936 -176.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.456 ' HE2' ' HG2' ' A' ' 86' ' ' GLN . 0.2 OUTLIER -86.55 -38.25 17.36 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -174.981 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -119.62 30.89 6.83 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 122.943 0.497 . . . . 0.0 110.856 -166.277 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.606 ' HB3' ' HB1' ' A' ' 24' ' ' ALA . . . -45.68 -61.22 1.8 Allowed 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 123.817 0.847 . . . . 0.0 113.015 -176.352 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -58.03 -46.36 85.45 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.464 175.199 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.441 ' O ' ' HG2' ' A' ' 98' ' ' GLU . . . -54.97 -45.27 81.83 Favored Glycine 0 C--N 1.356 1.639 0 O-C-N 124.662 1.226 . . . . 0.0 113.931 -174.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 14.1 mt -62.61 -57.42 12.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 123.813 0.845 . . . . 0.0 109.378 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 96.5 mt -59.95 -44.85 95.43 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 CA-C-N 114.031 -1.44 . . . . 0.0 111.415 -172.759 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.69 -31.56 71.61 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.058 0.543 . . . . 0.0 111.936 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.441 ' HG2' ' O ' ' A' ' 94' ' ' GLY . 51.4 mm-40 -63.85 -36.78 85.03 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 123.471 0.482 . . . . 0.0 110.2 176.138 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 16.0 mt -81.07 -32.39 12.42 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 -178.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -57.63 -50.89 71.65 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.448 1.099 . . . . 0.0 111.151 173.466 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -72.71 -35.09 67.52 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 123.647 0.592 . . . . 0.0 111.028 -176.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 64.4 mtm -63.47 -46.0 88.2 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 122.544 0.338 . . . . 0.0 110.43 177.549 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.44 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 19.7 mt -67.17 -40.85 86.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 O-C-N 123.631 0.582 . . . . 0.0 110.199 177.048 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.91 -24.72 67.61 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 122.933 0.493 . . . . 0.0 111.785 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 22.3 t -91.11 -33.43 15.46 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.087 0.555 . . . . 0.0 110.784 -176.111 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 0.44 ' HG2' ' HA ' ' A' ' 103' ' ' ILE . 13.2 pt-20 -81.42 -28.78 34.11 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 122.775 0.43 . . . . 0.0 110.876 -179.489 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 87.0 mm-40 -79.76 -36.46 37.17 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.031 0.533 . . . . 0.0 110.157 175.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 65.7 mm-40 . . . . . 0 CA--C 1.552 1.045 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 178.42 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.6 ttt . . . . . 0 N--CA 1.483 1.196 0 CA-C-O 120.686 0.279 . . . . 0.0 110.254 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.4 p -78.06 90.81 4.23 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 121.629 0.728 . . . . 0.0 109.535 178.188 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -89.72 -177.9 5.38 Favored 'General case' 0 C--O 1.252 1.209 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.423 -175.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.548 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.1 tmtp? -145.51 137.29 25.34 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 -178.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.408 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.4 tt -122.88 135.2 54.43 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.651 1.18 . . . . 0.0 108.064 175.139 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.484 HG23 ' HB3' ' A' ' 54' ' ' ASP . 18.9 pt -125.92 160.96 32.08 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 170.283 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.566 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -149.68 164.47 35.13 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.934 176.681 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.5 tt -138.0 110.35 7.42 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 107.439 -1.319 . . . . 0.0 107.439 -177.335 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.516 ' HA ' ' O ' ' A' ' 64' ' ' SER . 60.2 m -99.18 107.5 19.86 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.065 0.946 . . . . 0.0 109.568 176.227 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -121.78 124.43 44.18 Favored 'General case' 0 N--CA 1.492 1.657 0 C-N-CA 122.566 0.346 . . . . 0.0 111.455 -177.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.777 ' SG ' HD12 ' A' ' 85' ' ' LEU . 36.9 m -127.76 146.27 58.17 Favored Pre-proline 0 N--CA 1.48 1.033 0 C-N-CA 123.847 0.859 . . . . 0.0 111.172 177.222 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -86.92 -13.78 4.49 Favored 'Trans proline' 0 C--N 1.369 1.629 0 C-N-CA 122.971 2.447 . . . . 0.0 111.984 168.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 23.0 mmt -79.54 -58.41 3.21 Favored 'General case' 0 C--N 1.355 0.813 0 C-N-CA 124.11 0.964 . . . . 0.0 110.298 -175.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -179.12 162.35 29.17 Favored Glycine 0 C--N 1.347 1.194 0 CA-C-N 115.564 -0.744 . . . . 0.0 112.77 -178.228 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 37.2 mt -70.81 -18.35 62.74 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.81 0.844 . . . . 0.0 111.714 178.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.42 -43.89 79.83 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-O 121.036 0.446 . . . . 0.0 110.903 174.375 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.469 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 3.9 t-160 -67.87 -41.7 82.45 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.234 -178.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.406 ' HA ' HD11 ' A' ' 85' ' ' LEU . 42.7 p -67.1 -36.33 81.72 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.429 -177.854 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.3 m-30 -72.45 -35.02 68.17 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.091 0.556 . . . . 0.0 111.394 -177.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' MET . . . . . 0.457 ' HE1' ' HA ' ' A' ' 17' ' ' HIS . 60.3 mtm -67.96 -35.82 79.03 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-O 120.592 0.234 . . . . 0.0 110.601 176.265 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -69.82 -41.56 74.82 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.386 0.674 . . . . 0.0 111.198 173.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.35 -39.76 89.38 Favored 'General case' 0 C--O 1.218 -0.571 0 C-N-CA 123.81 0.844 . . . . 0.0 110.899 -177.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.3 tp60 -70.55 -41.49 72.41 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 123.624 0.578 . . . . 0.0 109.903 -179.369 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.481 ' HB1' ' HB3' ' A' ' 92' ' ' ALA . . . -62.89 -52.24 63.84 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.434 -178.919 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 82.9 mt -65.1 -33.42 75.98 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.319 0.647 . . . . 0.0 111.501 178.283 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.449 ' O ' HG23 ' A' ' 30' ' ' VAL . 40.1 tt0 -60.42 -58.39 8.72 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 123.973 0.796 . . . . 0.0 110.587 179.55 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.518 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 29.8 mm-40 -53.65 -48.38 69.45 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 124.387 1.055 . . . . 0.0 111.119 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -57.68 -46.6 84.06 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 124.043 0.839 . . . . 0.0 111.789 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.56 -28.56 67.06 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 123.721 0.808 . . . . 0.0 113.08 178.051 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 26' ' ' GLU . 42.9 t -70.2 -40.15 77.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.83 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.518 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 8.0 mm-40 -70.85 -24.59 62.55 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 114.635 -1.166 . . . . 0.0 111.297 178.816 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -77.77 -7.33 56.41 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.36 0.664 . . . . 0.0 111.964 177.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 83.69 24.69 49.0 Favored Glycine 0 C--N 1.351 1.389 0 N-CA-C 114.668 0.627 . . . . 0.0 114.668 165.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -128.96 178.76 6.16 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-N 117.328 0.564 . . . . 0.0 111.311 173.107 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.548 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 41.2 tt0 -78.5 140.36 38.59 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.325 178.746 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.408 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 13.9 p -120.33 143.63 31.61 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 122.88 0.472 . . . . 0.0 110.204 178.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 49.3 tptt -149.3 115.86 5.87 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 173.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.566 HG12 ' HB3' ' A' ' 7' ' ' ALA . 51.0 mt -121.03 114.57 43.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -176.832 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -75.71 143.22 42.21 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.089 0.956 . . . . 0.0 109.167 171.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.472 HG21 ' HB2' ' A' ' 9' ' ' CYS . 1.9 p -127.93 103.54 7.31 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.087 0.555 . . . . 0.0 110.2 -179.132 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -94.56 137.56 33.53 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 122.852 0.461 . . . . 0.0 110.373 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -156.2 169.13 33.69 Favored Glycine 0 C--N 1.337 0.592 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.467 176.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.03 -29.36 69.67 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.545 0.738 . . . . 0.0 111.614 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -71.91 -39.35 69.58 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.036 0.935 . . . . 0.0 110.535 177.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 161.28 -177.55 37.57 Favored Glycine 0 C--N 1.345 1.066 0 CA-C-N 115.949 -0.569 . . . . 0.0 112.643 -178.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 73.6 mt -111.52 122.44 65.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 123.783 0.833 . . . . 0.0 110.08 179.175 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.45 ' HB3' ' OG1' ' A' ' 40' ' ' THR . 6.5 tp-100 -105.47 147.01 28.77 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.476 1.11 . . . . 0.0 110.688 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 17.8 t30 79.06 -51.92 0.44 Allowed 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 126.734 2.014 . . . . 0.0 111.582 172.455 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 21.6 tpp180 63.57 121.63 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.686 1.594 . . . . 0.0 113.549 173.088 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 45.1 mt -82.25 127.96 33.71 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.458 172.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.4 ' O ' HG13 ' A' ' 55' ' ' ILE . 43.8 p -90.2 160.74 16.06 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.039 176.475 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.24 -27.03 66.88 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 122.848 0.459 . . . . 0.0 111.481 177.088 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -69.29 -40.15 77.89 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.73 0.812 . . . . 0.0 111.113 175.16 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.484 ' HB3' HG23 ' A' ' 6' ' ' ILE . 53.7 m-20 -58.32 -47.75 82.72 Favored 'General case' 0 N--CA 1.483 1.212 0 O-C-N 123.35 0.406 . . . . 0.0 110.249 174.421 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.507 HG22 ' HG3' ' A' ' 78' ' ' ARG . 24.8 mt -68.47 -29.64 44.76 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.069 0 O-C-N 124.618 1.199 . . . . 0.0 111.024 -177.684 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.41 ' HA ' HH21 ' A' ' 78' ' ' ARG . . . -71.68 -49.05 43.2 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.68 0.792 . . . . 0.0 111.552 179.458 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -84.82 -12.54 53.37 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.421 0.688 . . . . 0.0 112.157 -175.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.9 99.0 0.11 Allowed 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.546 0.739 . . . . 0.0 111.834 -178.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 25.2 m -61.59 -34.86 76.35 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 124.268 1.027 . . . . 0.0 109.797 170.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.503 HG21 HG21 ' A' ' 99' ' ' ILE . 81.5 mt -130.45 138.14 54.51 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 C-N-CA 124.416 1.087 . . . . 0.0 109.61 179.55 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.8 mt -133.06 132.27 58.81 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.358 0 C-N-CA 123.721 0.809 . . . . 0.0 108.821 174.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -121.14 117.01 51.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 174.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 9.9 m170 -90.84 84.52 5.83 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-N 118.879 0.763 . . . . 0.0 108.972 170.01 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.516 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 20.7 p -83.22 81.83 8.53 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 114.674 -1.148 . . . . 0.0 108.763 176.905 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 34.8 m -128.57 158.31 40.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 CA-C-O 121.699 0.762 . . . . 0.0 111.957 -168.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -111.71 -11.9 13.93 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.013 1.325 . . . . 0.0 109.363 172.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 11.5 m -135.47 151.73 30.59 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 125.397 1.479 . . . . 0.0 108.909 178.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 25.6 m -65.3 110.79 4.77 Favored Pre-proline 0 CA--C 1.55 0.976 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 173.087 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.404 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 28.1 Cg_endo -62.66 153.3 72.91 Favored 'Trans proline' 0 C--N 1.379 2.137 0 C-N-CA 122.342 2.028 . . . . 0.0 112.912 -174.005 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -76.58 -25.4 53.93 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.444 0.698 . . . . 0.0 111.001 -177.236 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -96.02 10.43 37.48 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.813 0.845 . . . . 0.0 111.252 179.127 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.404 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 0.3 OUTLIER -58.5 -32.95 69.29 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 124.074 0.95 . . . . 0.0 111.354 -174.984 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.407 ' HA ' ' HB2' ' A' ' 76' ' ' GLU . 0.4 OUTLIER -65.66 -24.87 67.12 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.154 0.581 . . . . 0.0 112.359 178.777 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 77.3 mtt180 -70.5 -23.37 62.65 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.254 0.622 . . . . 0.0 111.646 173.194 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.403 ' HB3' HG23 ' A' ' 80' ' ' VAL . 56.8 m-85 -105.37 2.43 28.77 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.148 0.979 . . . . 0.0 111.301 -179.501 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.407 ' HB2' ' HA ' ' A' ' 73' ' ' GLU . 29.2 tt0 -61.61 -50.39 72.77 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.876 0.87 . . . . 0.0 111.909 -172.446 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 69.7 p -82.71 0.26 44.22 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.054 0.541 . . . . 0.0 111.841 -178.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.507 ' HG3' HG22 ' A' ' 55' ' ' ILE . 15.8 mmt180 -102.4 149.32 24.48 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.634 0.774 . . . . 0.0 110.71 176.343 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -79.37 92.28 5.17 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.712 0.805 . . . . 0.0 110.624 -178.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.403 HG23 ' HB3' ' A' ' 75' ' ' PHE . 45.1 t -98.49 144.79 10.98 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.788 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.096 -179.728 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 -102.45 92.2 4.58 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.82 1.248 . . . . 0.0 107.858 174.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -83.16 121.62 27.31 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.579 0.752 . . . . 0.0 110.708 -175.306 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.481 HG13 ' HA ' ' A' ' 64' ' ' SER . 43.9 pt -130.55 -177.59 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 124.675 1.19 . . . . 0.0 109.25 177.391 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 18.5 p -83.79 149.28 26.53 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 167.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.777 HD12 ' SG ' ' A' ' 11' ' ' CYS . 7.7 tt -63.09 -29.22 70.63 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.358 0.663 . . . . 0.0 111.816 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.541 ' HG2' ' HE3' ' A' ' 90' ' ' LYS . 29.4 tt0 -60.22 -41.78 93.79 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.445 0.698 . . . . 0.0 110.755 175.072 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.446 ' HB3' HD12 ' A' ' 83' ' ' ILE . 24.1 t70 -63.18 -32.46 73.86 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.674 0.79 . . . . 0.0 110.728 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.74 -29.9 71.06 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.749 0.82 . . . . 0.0 112.697 179.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 65.8 mt -83.54 -54.0 10.08 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 C-N-CA 123.603 0.761 . . . . 0.0 110.062 -178.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.541 ' HE3' ' HG2' ' A' ' 86' ' ' GLN . 18.5 ptpt -72.8 -45.4 58.68 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.117 0.567 . . . . 0.0 112.33 -175.256 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -108.61 24.07 13.6 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.185 0.994 . . . . 0.0 110.594 -169.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.481 ' HB3' ' HB1' ' A' ' 24' ' ' ALA . . . -41.73 -62.2 0.94 Allowed 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.286 1.034 . . . . 0.0 113.672 -175.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.35 -36.29 83.2 Favored 'General case' 0 C--N 1.34 0.179 0 CA-C-N 114.922 -1.036 . . . . 0.0 110.806 179.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -61.07 -48.06 88.0 Favored Glycine 0 C--N 1.354 1.546 0 O-C-N 124.703 1.252 . . . . 0.0 112.526 -178.3 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 35.9 mt -56.99 -57.89 8.03 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 C-N-CA 124.597 1.159 . . . . 0.0 110.31 -179.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.9 mp -56.31 -51.65 61.15 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.912 0 O-C-N 124.257 0.973 . . . . 0.0 111.296 -177.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.31 -31.16 72.15 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 -176.758 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -67.19 -36.96 82.84 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 122.877 0.471 . . . . 0.0 110.217 177.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . 0.503 HG21 HG21 ' A' ' 60' ' ' ILE . 56.4 mt -76.47 -37.49 30.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -177.847 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -57.55 -52.66 64.51 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 114.191 -1.368 . . . . 0.0 111.257 176.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -69.96 -33.51 72.19 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 123.632 0.582 . . . . 0.0 111.534 -177.794 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 67.7 mtm -65.0 -56.9 10.44 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 122.386 0.274 . . . . 0.0 110.817 178.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 48.2 mt -64.35 -39.72 86.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 O-C-N 123.677 0.61 . . . . 0.0 111.037 -179.231 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.429 ' HA ' ' HG2' ' A' ' 107' ' ' GLN . . . -67.55 -37.4 82.64 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.659 0.384 . . . . 0.0 111.433 179.729 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 33.9 t -68.48 -39.1 81.49 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 122.351 0.26 . . . . 0.0 110.848 -175.365 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -79.98 -29.67 39.57 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 116.106 -0.497 . . . . 0.0 112.173 -178.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.429 ' HG2' ' HA ' ' A' ' 104' ' ' ALA . 3.0 pt20 -85.08 -28.78 25.39 Favored 'General case' 0 N--CA 1.487 1.418 0 CA-C-N 117.991 0.359 . . . . 0.0 111.203 -178.78 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 . . . . . 0 C--O 1.249 1.034 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 179.037 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.405 ' N ' ' SD ' ' A' ' 1' ' ' MET . 1.5 mpt? . . . . . 0 N--CA 1.479 1.009 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.9 t -84.28 126.35 33.1 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 171.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.8 pttm -73.36 161.98 29.85 Favored 'General case' 0 C--O 1.242 0.693 0 C-N-CA 123.187 0.595 . . . . 0.0 110.617 178.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.599 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.4 tmtp? -144.37 140.24 28.94 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 -169.736 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.516 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.9 tt -132.26 136.68 47.13 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 178.431 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.499 HD12 HD12 ' A' ' 50' ' ' LEU . 15.8 pt -128.15 161.14 37.1 Favored 'Isoleucine or valine' 0 C--O 1.244 0.769 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 173.715 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.542 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -147.21 168.16 22.39 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.99 177.854 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.0 tt -142.07 113.62 7.8 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 -178.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.51 ' HA ' ' O ' ' A' ' 64' ' ' SER . 56.0 m -103.28 111.42 23.81 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.696 0.798 . . . . 0.0 108.851 177.16 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.452 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -123.31 127.29 48.33 Favored 'General case' 0 N--CA 1.497 1.919 0 C-N-CA 122.521 0.328 . . . . 0.0 111.44 -177.663 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.756 ' SG ' HD11 ' A' ' 85' ' ' LEU . 56.0 m -130.79 145.45 57.74 Favored Pre-proline 0 N--CA 1.481 1.087 0 C-N-CA 123.866 0.866 . . . . 0.0 111.768 -178.915 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -79.37 -28.16 3.82 Favored 'Trans proline' 0 C--N 1.375 1.929 0 C-N-CA 122.866 2.377 . . . . 0.0 111.466 167.513 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 12.2 tpt -69.74 -50.77 40.27 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.012 0.925 . . . . 0.0 110.744 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 155.68 -176.79 33.11 Favored Glycine 0 C--N 1.345 1.053 0 N-CA-C 114.178 0.431 . . . . 0.0 114.178 175.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 71.0 mt -73.62 -20.18 60.66 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.974 0.909 . . . . 0.0 113.393 -172.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.82 -42.66 89.74 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-N 118.574 0.625 . . . . 0.0 110.619 176.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.485 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 7.2 t-160 -67.1 -43.27 82.93 Favored 'General case' 0 C--O 1.246 0.919 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.866 178.28 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 34.7 p -65.8 -31.26 72.13 Favored 'General case' 0 C--N 1.353 0.76 0 CA-C-N 115.509 -0.769 . . . . 0.0 111.558 -177.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -74.15 -33.42 63.5 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 119.028 -0.51 . . . . 0.0 111.192 -178.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 64.6 mtm -65.05 -35.82 82.37 Favored 'General case' 0 N--CA 1.492 1.66 0 CA-C-O 120.961 0.41 . . . . 0.0 110.87 173.275 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.48 -48.67 54.66 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.999 177.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.68 -36.13 82.82 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 124.32 1.048 . . . . 0.0 110.946 -177.301 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.4 ' O ' ' HG3' ' A' ' 27' ' ' GLU . 11.4 pt20 -71.04 -41.11 71.24 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 -176.533 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -72.97 -38.95 66.5 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.919 -178.166 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 76.5 mt -71.68 -33.41 68.81 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.079 0.552 . . . . 0.0 110.784 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.423 ' O ' HG21 ' A' ' 30' ' ' VAL . 37.4 tt0 -61.29 -55.86 27.11 Favored 'General case' 0 C--N 1.35 0.599 0 O-C-N 124.019 0.824 . . . . 0.0 109.209 177.721 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.419 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 44.8 mt-10 -56.22 -48.25 76.82 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 124.36 1.037 . . . . 0.0 110.717 -178.414 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.47 -47.46 79.15 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.119 0.968 . . . . 0.0 111.548 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.03 -22.18 62.18 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.186 0.994 . . . . 0.0 113.537 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.423 HG21 ' O ' ' A' ' 26' ' ' GLU . 37.6 t -79.93 -41.55 21.55 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 -179.425 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 6.9 mm-40 -72.21 -21.72 61.37 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 114.465 -1.243 . . . . 0.0 110.102 175.422 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.61 -31.25 59.83 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 114.726 -1.125 . . . . 0.0 111.436 173.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 98.77 22.79 12.93 Favored Glycine 0 C--N 1.344 1.019 0 CA-C-N 115.833 -0.621 . . . . 0.0 114.095 171.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -99.75 163.51 12.44 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 171.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.599 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 35.1 tt0 -74.33 130.42 39.65 Favored 'General case' 0 C--O 1.217 -0.646 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 159.636 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.516 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 9.3 p -119.28 134.46 62.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 CA-C-N 119.133 0.879 . . . . 0.0 110.9 -173.648 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 45.2 tptt -141.0 120.45 13.16 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.542 HG12 ' HB3' ' A' ' 7' ' ' ALA . 43.1 mt -122.28 122.94 67.64 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 C-N-CA 122.712 0.405 . . . . 0.0 112.08 -175.325 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 76.9 tt0 -88.53 116.0 26.46 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.493 1.117 . . . . 0.0 109.904 175.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.625 ' HG1' ' HB3' ' A' ' 47' ' ' GLN . 24.3 p -100.85 104.96 16.2 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 122.521 0.328 . . . . 0.0 110.366 177.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.452 ' O ' ' HA ' ' A' ' 10' ' ' ALA . 13.9 mt-30 -96.66 144.0 27.1 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.237 0.615 . . . . 0.0 109.45 175.802 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -167.98 177.47 42.19 Favored Glycine 0 C--N 1.335 0.49 0 C-N-CA 121.716 -0.278 . . . . 0.0 112.568 179.419 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.79 -29.27 69.34 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.535 0.734 . . . . 0.0 111.958 179.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -67.53 -42.32 82.93 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.407 0.683 . . . . 0.0 110.205 174.037 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 153.77 -173.01 32.51 Favored Glycine 0 C--N 1.341 0.811 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.93 -176.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 72.6 mt -101.59 135.57 37.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 176.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.625 ' HB3' ' HG1' ' A' ' 40' ' ' THR . 9.1 tp-100 -132.16 144.78 50.91 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.386 0.674 . . . . 0.0 110.383 -172.786 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 42.2 t30 74.39 -64.87 0.37 Allowed 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 126.43 1.892 . . . . 0.0 108.855 -177.618 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 22.6 ttt-85 63.73 129.19 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 127.048 2.139 . . . . 0.0 113.947 172.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.499 HD12 HD12 ' A' ' 6' ' ' ILE . 26.9 mt -77.76 148.63 34.74 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 113.837 -1.529 . . . . 0.0 110.272 175.884 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 58.5 p -113.72 170.14 8.47 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.505 176.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -57.19 -33.41 67.46 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.382 0.673 . . . . 0.0 111.222 -179.211 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.402 ' O ' ' HG3' ' A' ' 57' ' ' GLU . 16.6 tt0 -61.17 -54.95 37.95 Favored 'General case' 0 C--N 1.35 0.608 0 O-C-N 124.256 0.972 . . . . 0.0 109.667 175.31 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 53.1 m-20 -54.56 -41.82 70.26 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 123.966 0.906 . . . . 0.0 112.239 -176.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.642 HD11 HH21 ' A' ' 74' ' ' ARG . 40.4 mt -71.11 -33.47 51.39 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 O-C-N 123.874 0.734 . . . . 0.0 110.604 -176.39 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.23 -39.63 65.34 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.475 0.71 . . . . 0.0 111.299 176.203 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.402 ' HG3' ' O ' ' A' ' 53' ' ' GLN . 52.6 mt-10 -69.25 -32.28 71.37 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.881 0.872 . . . . 0.0 110.95 179.425 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -56.57 101.88 0.07 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.884 1.274 . . . . 0.0 113.216 -172.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 27.4 m -61.11 -39.59 90.55 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.759 0.824 . . . . 0.0 109.12 165.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.49 HG21 HG21 ' A' ' 99' ' ' ILE . 53.0 mt -127.22 144.37 37.51 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 C-N-CA 123.746 0.818 . . . . 0.0 110.581 179.149 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 28.1 mt -134.42 120.28 32.75 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 C-N-CA 124.014 0.926 . . . . 0.0 108.839 172.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.6 mp -109.46 119.77 59.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 175.167 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . 0.424 ' HB2' ' HG3' ' A' ' 82' ' ' GLU . 12.6 m170 -92.44 83.92 5.05 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-O 121.747 0.784 . . . . 0.0 108.944 168.61 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.51 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 24.8 p -80.45 83.58 6.24 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 114.236 -1.347 . . . . 0.0 109.072 175.551 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 33.7 m -128.29 156.58 40.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 CA-C-O 121.872 0.844 . . . . 0.0 112.29 -169.126 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -109.3 -21.44 12.54 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 113.633 -1.622 . . . . 0.0 109.002 173.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 6.2 m -137.13 148.48 26.29 Favored 'Isoleucine or valine' 0 C--N 1.35 0.613 0 C-N-CA 125.519 1.528 . . . . 0.0 108.015 175.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 67.6 m -59.27 116.18 15.1 Favored Pre-proline 0 CA--C 1.548 0.899 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 176.075 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.402 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 39.9 Cg_endo -64.29 151.46 85.32 Favored 'Trans proline' 0 C--N 1.381 2.241 0 C-N-CA 122.86 2.373 . . . . 0.0 111.475 -176.514 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -64.62 -36.72 85.15 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-O 121.619 0.723 . . . . 0.0 110.408 -178.34 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.51 ' HB3' ' HD3' ' A' ' 74' ' ' ARG . 2.2 m-20 -91.49 13.21 18.33 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.486 1.115 . . . . 0.0 111.919 -173.764 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.402 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 4.8 p30 -56.15 -30.3 61.98 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 124.372 1.069 . . . . 0.0 112.154 -177.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -61.08 -33.61 73.62 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.67 1.188 . . . . 0.0 112.457 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.642 HH21 HD11 ' A' ' 55' ' ' ILE . 27.3 mtp180 -65.11 -29.34 70.2 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.436 1.094 . . . . 0.0 112.007 177.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -100.24 -11.74 20.12 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 114.913 -1.04 . . . . 0.0 111.84 -175.213 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -56.86 -35.27 68.68 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.373 1.069 . . . . 0.0 111.92 -177.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 34.7 t -73.53 -19.01 61.02 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.852 0.861 . . . . 0.0 112.507 -178.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.564 ' HG3' HG22 ' A' ' 55' ' ' ILE . 32.3 mmt180 -111.44 173.59 6.27 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.531 0.733 . . . . 0.0 111.781 -171.209 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -84.33 97.68 9.59 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.758 0.823 . . . . 0.0 110.387 -177.289 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 39.3 t -105.87 153.14 7.39 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 CA-C-N 114.966 -1.016 . . . . 0.0 110.255 -179.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 -124.36 91.39 3.44 Favored 'General case' 0 C--O 1.243 0.72 0 C-N-CA 124.815 1.246 . . . . 0.0 107.895 179.197 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.424 ' HG3' ' HB2' ' A' ' 63' ' ' HIS . 2.2 mp0 -77.08 126.86 31.65 Favored 'General case' 0 C--N 1.353 0.746 0 C-N-CA 122.916 0.486 . . . . 0.0 110.714 -177.613 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.429 HG13 ' HA ' ' A' ' 64' ' ' SER . 43.4 pt -136.46 -178.58 2.43 Favored 'Isoleucine or valine' 0 C--O 1.246 0.911 0 C-N-CA 125.327 1.451 . . . . 0.0 108.317 177.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 23.5 p -83.39 147.44 27.89 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.102 0.477 . . . . 0.0 109.825 169.118 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.756 HD11 ' SG ' ' A' ' 11' ' ' CYS . 8.1 tt -65.85 -28.29 68.86 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.929 179.404 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.424 ' O ' ' HG2' ' A' ' 90' ' ' LYS . 28.6 tt0 -62.6 -44.96 95.01 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.555 0.742 . . . . 0.0 110.428 174.107 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -60.82 -30.95 70.4 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.758 0.823 . . . . 0.0 110.609 179.253 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.7 -21.57 63.48 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.956 0.902 . . . . 0.0 113.318 178.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 65.5 mt -89.27 -41.82 14.1 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 C-N-CA 123.622 0.769 . . . . 0.0 110.36 -179.163 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.424 ' HG2' ' O ' ' A' ' 86' ' ' GLN . 16.2 ptpt -92.68 -47.44 7.09 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.016 0.526 . . . . 0.0 112.172 -174.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -99.48 18.55 17.58 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 123.746 0.818 . . . . 0.0 111.477 -173.296 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.461 ' HA ' HD11 ' A' ' 95' ' ' ILE . . . -45.66 -57.98 3.8 Favored 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 124.158 0.983 . . . . 0.0 113.527 -171.522 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.48 -38.77 81.68 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.39 0.676 . . . . 0.0 111.014 179.041 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -61.77 -46.48 94.09 Favored Glycine 0 C--N 1.352 1.454 0 O-C-N 124.462 1.101 . . . . 0.0 112.696 -179.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.461 HD11 ' HA ' ' A' ' 92' ' ' ALA . 16.8 mt -57.72 -57.95 8.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 124.137 0.975 . . . . 0.0 110.22 -179.752 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.468 ' O ' ' HG3' ' A' ' 100' ' ' GLU . 2.2 mp -57.52 -51.98 62.9 Favored 'Isoleucine or valine' 0 C--N 1.357 0.926 0 O-C-N 124.131 0.894 . . . . 0.0 110.647 -176.51 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -32.14 71.98 Favored 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -175.412 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -65.01 -37.52 87.93 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 123.806 0.691 . . . . 0.0 110.137 176.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . 0.49 HG21 HG21 ' A' ' 60' ' ' ILE . 25.8 mt -79.93 -31.94 13.79 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.834 -178.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.468 ' HG3' ' O ' ' A' ' 96' ' ' ILE . 36.2 mt-10 -59.71 -50.59 73.26 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.396 0.678 . . . . 0.0 110.621 177.319 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -68.99 -36.99 78.47 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 123.835 0.71 . . . . 0.0 111.083 -177.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 71.4 mtm -60.43 -54.04 50.34 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 122.421 0.289 . . . . 0.0 110.323 176.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.47 HD12 HG12 ' A' ' 60' ' ' ILE . 39.7 mt -67.3 -35.71 74.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 123.288 0.635 . . . . 0.0 111.523 -178.358 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.73 -36.72 83.12 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.041 0.537 . . . . 0.0 110.47 178.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 70.0 m -79.49 -27.08 41.5 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 122.918 0.487 . . . . 0.0 111.383 -174.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -85.79 -33.44 21.38 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 122.377 0.271 . . . . 0.0 111.639 177.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.462 ' HG3' HE21 ' A' ' 108' ' ' GLN . 4.4 pt20 -80.47 -30.16 37.44 Favored 'General case' 0 N--CA 1.487 1.416 0 CA-C-N 118.086 0.403 . . . . 0.0 111.186 -179.273 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.462 HE21 ' HG3' ' A' ' 107' ' ' GLN . 23.5 mm-40 . . . . . 0 C--O 1.248 1.015 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 175.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.0 mtt . . . . . 0 N--CA 1.484 1.239 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.6 t -76.67 94.88 3.86 Favored 'General case' 0 C--N 1.348 0.522 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 171.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.407 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 3.3 pttt -102.3 178.92 4.46 Favored 'General case' 0 C--O 1.251 1.139 0 C-N-CA 123.985 0.914 . . . . 0.0 110.348 179.777 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.547 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.2 tmtp? -143.69 140.38 30.01 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.615 -0.721 . . . . 0.0 109.163 -175.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.482 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 8.8 tt -126.25 137.19 53.5 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 176.718 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.429 HD11 HD11 ' A' ' 50' ' ' LEU . 16.4 pt -128.88 161.75 37.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 172.447 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.565 ' HB2' HG12 ' A' ' 38' ' ' ILE . . . -147.63 168.06 22.99 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.111 0.481 . . . . 0.0 109.86 176.427 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.6 tt -138.65 114.34 9.86 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.508 ' HA ' ' O ' ' A' ' 64' ' ' SER . 80.5 m -106.4 107.65 18.77 Favored 'General case' 0 C--O 1.218 -0.583 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 177.957 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.424 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -125.97 122.95 37.39 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.025 0.53 . . . . 0.0 110.939 -177.346 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.794 ' SG ' HD11 ' A' ' 85' ' ' LEU . 2.9 m -140.42 146.78 46.8 Favored Pre-proline 0 N--CA 1.477 0.901 0 C-N-CA 123.682 0.793 . . . . 0.0 111.113 178.194 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -85.49 0.78 8.5 Favored 'Trans proline' 0 C--N 1.377 2.069 0 C-N-CA 123.596 2.864 . . . . 0.0 112.19 -179.469 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.411 ' HE1' ' HA ' ' A' ' 13' ' ' MET . 27.0 mmt -88.38 -26.01 22.41 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.24 1.016 . . . . 0.0 110.644 179.819 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 135.93 177.04 14.69 Favored Glycine 0 C--N 1.344 0.992 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.809 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 47.0 mt -75.53 -13.88 60.38 Favored 'General case' 0 C--N 1.352 0.678 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -179.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.23 -46.49 89.57 Favored 'General case' 0 C--O 1.249 1.053 0 CA-C-O 121.168 0.509 . . . . 0.0 110.877 177.2 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.462 ' HA ' ' HE2' ' A' ' 20' ' ' MET . 12.3 t-160 -65.38 -43.53 90.45 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.742 179.591 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 31.2 p -65.71 -36.0 82.36 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.471 -176.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.0 m-30 -70.41 -32.56 70.23 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.381 0.672 . . . . 0.0 111.342 -179.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' MET . . . . . 0.462 ' HE2' ' HA ' ' A' ' 17' ' ' HIS . 65.2 mtm -67.15 -37.96 84.69 Favored 'General case' 0 N--CA 1.484 1.275 0 CA-C-O 120.888 0.375 . . . . 0.0 110.762 175.333 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.38 -39.32 81.77 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.989 173.58 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.06 -40.57 91.02 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.668 0.787 . . . . 0.0 110.662 -178.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -61.4 -51.36 69.06 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.604 0.762 . . . . 0.0 109.616 177.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.52 -48.44 75.09 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 114.765 -1.107 . . . . 0.0 112.502 -174.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 91.4 mt -66.12 -33.0 74.79 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.421 0.689 . . . . 0.0 111.69 179.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.468 ' HA ' HG21 ' A' ' 36' ' ' VAL . 32.4 tt0 -64.03 -52.21 60.52 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 123.584 0.552 . . . . 0.0 110.02 178.816 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -54.42 -48.63 71.42 Favored 'General case' 0 N--CA 1.481 1.079 0 O-C-N 124.213 0.945 . . . . 0.0 110.572 179.322 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.407 ' HB1' ' HA ' ' A' ' 93' ' ' ALA . . . -59.9 -47.37 86.03 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.603 1.161 . . . . 0.0 111.955 -178.035 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.42 -28.29 67.78 Favored 'General case' 0 N--CA 1.476 0.866 0 CA-C-N 115.068 -0.969 . . . . 0.0 112.842 178.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.409 HG22 ' O ' ' A' ' 26' ' ' GLU . 41.1 t -72.0 -38.11 62.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 178.296 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -67.88 -25.21 65.4 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.578 1.151 . . . . 0.0 111.317 176.394 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -80.88 -9.39 59.83 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 123.847 0.859 . . . . 0.0 112.075 177.298 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.62 2.81 67.09 Favored Glycine 0 C--N 1.347 1.167 0 N-CA-C 115.442 0.937 . . . . 0.0 115.442 166.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.407 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.1 OUTLIER -113.92 178.66 4.2 Favored 'General case' 0 N--CA 1.49 1.527 0 CA-C-N 117.746 0.773 . . . . 0.0 111.751 179.849 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.547 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 38.9 tt0 -76.47 153.73 35.33 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 123.926 0.766 . . . . 0.0 109.366 178.154 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.482 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 7.2 p -136.49 138.83 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 123.073 0.549 . . . . 0.0 110.284 178.493 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 43.7 tptt -146.8 122.1 10.25 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 175.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.565 HG12 ' HB2' ' A' ' 7' ' ' ALA . 45.7 mt -122.69 113.0 36.46 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 123.098 0.559 . . . . 0.0 111.788 -173.433 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 68.8 tt0 -81.25 107.46 14.06 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.669 0.788 . . . . 0.0 109.667 174.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.437 HG22 ' HB2' ' A' ' 9' ' ' CYS . 22.3 p -88.72 109.31 20.04 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.233 0.613 . . . . 0.0 110.15 175.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.428 HE22 ' HB2' ' A' ' 70' ' ' GLU . 42.0 mt-30 -103.6 155.42 18.56 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.685 0.755 . . . . 0.0 111.542 178.182 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 178.52 167.95 37.08 Favored Glycine 0 C--O 1.24 0.474 0 CA-C-N 114.529 -1.214 . . . . 0.0 110.406 172.285 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.12 -19.49 65.63 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-N 116.944 0.372 . . . . 0.0 110.2 173.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -64.63 -40.74 96.01 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 124.548 1.139 . . . . 0.0 110.856 171.178 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 162.47 -176.68 38.8 Favored Glycine 0 C--N 1.344 1.003 0 CA-C-N 115.43 -0.805 . . . . 0.0 112.176 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.514 HD11 ' NH2' ' A' ' 49' ' ' ARG . 85.0 mt -129.25 134.24 64.22 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 C-N-CA 123.972 0.909 . . . . 0.0 108.789 176.123 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 9.7 tp-100 -140.8 149.65 42.31 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.013 0.925 . . . . 0.0 110.398 -172.141 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.453 ' HB3' ' O ' ' A' ' 38' ' ' ILE . 33.8 t30 57.22 34.42 24.77 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 125.275 1.43 . . . . 0.0 110.392 177.377 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.514 ' NH2' HD11 ' A' ' 46' ' ' ILE . 20.4 ttm180 -57.39 131.51 50.31 Favored 'General case' 0 C--N 1.351 0.664 0 C-N-CA 124.695 1.198 . . . . 0.0 112.737 -171.209 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.576 ' HB2' HH22 ' A' ' 74' ' ' ARG . 27.8 mt -72.95 149.04 43.7 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 113.871 -1.513 . . . . 0.0 110.961 177.246 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.433 ' O ' HG13 ' A' ' 55' ' ' ILE . 42.7 p -103.38 174.3 5.93 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.287 173.409 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.72 -31.42 71.58 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 122.716 0.406 . . . . 0.0 110.631 173.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -66.23 -42.36 88.79 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.883 0.873 . . . . 0.0 110.686 178.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -57.19 -48.92 77.55 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.423 0.689 . . . . 0.0 111.035 175.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.653 HD13 HH21 ' A' ' 74' ' ' ARG . 23.1 mt -69.21 -36.39 72.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 O-C-N 124.143 0.902 . . . . 0.0 111.24 -175.292 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.75 -46.16 69.58 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.831 0.853 . . . . 0.0 111.451 -178.156 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -84.96 -10.73 56.75 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.248 0.619 . . . . 0.0 111.557 -178.061 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.95 106.93 1.12 Allowed 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.339 0.656 . . . . 0.0 110.761 178.165 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 13.7 m -63.35 -36.0 82.26 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.27 1.028 . . . . 0.0 109.831 169.495 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.479 HG21 HG22 ' A' ' 99' ' ' ILE . 75.8 mt -132.07 140.83 46.98 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 124.193 0.997 . . . . 0.0 110.082 -177.716 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 32.4 mt -135.96 125.43 39.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 C-N-CA 123.746 0.818 . . . . 0.0 108.964 174.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.3 mp -112.28 127.96 69.18 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 175.394 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 5.7 m170 -99.82 86.15 3.24 Favored 'General case' 0 N--CA 1.486 1.353 0 CA-C-O 121.773 0.797 . . . . 0.0 109.111 169.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.532 ' HG ' HD11 ' A' ' 83' ' ' ILE . 19.7 m -81.09 81.63 7.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 114.254 -1.339 . . . . 0.0 109.173 175.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.413 ' O ' ' HA ' ' A' ' 84' ' ' THR . 34.9 m -128.5 159.68 39.74 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.413 0 CA-C-O 121.741 0.782 . . . . 0.0 111.608 -171.208 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -110.43 -25.4 10.08 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 114.494 -1.23 . . . . 0.0 108.994 172.411 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 14.6 m -135.96 164.39 32.18 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 C-N-CA 125.523 1.529 . . . . 0.0 108.868 -178.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 96.2 m -68.53 114.1 19.89 Favored Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 122.999 0.52 . . . . 0.0 110.272 -179.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.575 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 46.1 Cg_endo -68.45 152.97 74.87 Favored 'Trans proline' 0 C--N 1.382 2.323 0 C-N-CA 122.445 2.097 . . . . 0.0 112.489 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.428 ' HB2' HE22 ' A' ' 41' ' ' GLN . 40.1 mm-40 -67.29 -29.31 68.88 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.368 0.667 . . . . 0.0 111.637 -175.581 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.493 ' HB3' ' HD3' ' A' ' 74' ' ' ARG . 2.1 m-20 -104.32 18.69 21.64 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.607 -175.251 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.575 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 41.7 t30 -57.62 -35.46 70.5 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.166 0.986 . . . . 0.0 112.341 -177.654 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.53 -31.37 72.51 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 123.385 0.674 . . . . 0.0 112.632 -179.745 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . 0.653 HH21 HD13 ' A' ' 55' ' ' ILE . 35.5 mtp180 -59.26 -33.79 71.47 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.87 0.868 . . . . 0.0 112.416 175.821 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -98.95 -16.49 18.74 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 115.083 -0.962 . . . . 0.0 111.448 -175.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -54.97 -33.43 62.44 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 124.14 0.976 . . . . 0.0 112.39 -176.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 40.4 p -78.75 -6.39 55.76 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.793 0.837 . . . . 0.0 112.909 -177.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.55 ' HG3' HG23 ' A' ' 55' ' ' ILE . 25.2 mmt180 -120.24 171.13 8.72 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.909 0.884 . . . . 0.0 111.343 -172.58 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -78.37 92.69 4.59 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.361 0.665 . . . . 0.0 110.014 -177.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 43.6 t -109.05 139.48 31.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 123.169 0.588 . . . . 0.0 110.946 -177.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -108.11 91.01 3.47 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.981 1.312 . . . . 0.0 107.92 -179.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -78.41 128.89 34.27 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.526 -177.016 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.532 HD11 ' HG ' ' A' ' 64' ' ' SER . 40.9 pt -141.87 -174.85 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 C-N-CA 125.433 1.493 . . . . 0.0 108.819 -179.408 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.413 ' HA ' ' O ' ' A' ' 65' ' ' VAL . 25.5 p -83.34 148.83 27.11 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.033 0.444 . . . . 0.0 109.956 167.523 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.794 HD11 ' SG ' ' A' ' 11' ' ' CYS . 7.8 tt -63.68 -29.91 71.08 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.285 177.098 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.514 ' HG2' ' HE3' ' A' ' 90' ' ' LYS . 27.6 tt0 -70.15 -36.27 74.63 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.954 178.323 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -60.64 -33.23 72.48 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.703 0.801 . . . . 0.0 110.367 173.491 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.1 -20.63 64.94 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.827 0.851 . . . . 0.0 113.274 178.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 68.4 mt -87.32 -55.26 6.69 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 123.189 0.595 . . . . 0.0 109.654 178.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.514 ' HE3' ' HG2' ' A' ' 86' ' ' GLN . 18.0 ptpt -77.78 -43.84 29.42 Favored 'General case' 0 N--CA 1.482 1.174 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.626 -173.552 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -105.51 20.46 18.86 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.032 0.933 . . . . 0.0 110.522 -173.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -44.03 -58.99 2.51 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 124.007 0.923 . . . . 0.0 113.052 -175.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.407 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . . . -60.07 -41.15 91.77 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.032 -0.986 . . . . 0.0 110.785 178.317 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -58.21 -46.02 93.34 Favored Glycine 0 C--N 1.352 1.459 0 O-C-N 124.493 1.121 . . . . 0.0 112.539 -179.189 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 26.8 mt -59.74 -57.42 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 124.516 1.127 . . . . 0.0 109.625 -178.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.8 mp -55.31 -50.97 60.87 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.99 0 O-C-N 124.302 1.002 . . . . 0.0 111.027 -177.225 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.95 -29.27 68.28 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 122.897 0.479 . . . . 0.0 112.097 -175.774 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -68.74 -33.72 74.39 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 123.493 0.496 . . . . 0.0 110.16 176.589 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . 0.479 HG22 HG21 ' A' ' 60' ' ' ILE . 66.4 mt -75.82 -41.2 39.81 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 -179.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -58.03 -45.09 87.53 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 114.194 -1.366 . . . . 0.0 111.965 177.403 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -74.45 -30.29 61.82 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 123.208 0.317 . . . . 0.0 111.232 -178.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 69.9 mtm -66.99 -49.93 63.83 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 122.368 0.267 . . . . 0.0 110.404 175.335 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 50.4 mt -62.5 -36.74 76.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 123.364 0.666 . . . . 0.0 110.233 176.182 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.52 -38.95 91.15 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.118 0.567 . . . . 0.0 110.867 176.62 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 26.5 t -68.61 -33.52 74.19 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.43 0.692 . . . . 0.0 111.312 -174.441 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -85.67 -29.3 24.1 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-N 116.096 -0.502 . . . . 0.0 112.255 179.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -86.7 -30.02 22.0 Favored 'General case' 0 N--CA 1.492 1.67 0 CA-C-N 118.333 0.515 . . . . 0.0 111.593 -174.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 . . . . . 0 N--CA 1.48 1.056 0 C-N-CA 123.422 0.689 . . . . 0.0 110.8 179.825 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.0 mtt . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.253 0.073 . . . . 0.0 111.083 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.7 t -81.48 106.36 13.37 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.11 0.564 . . . . 0.0 110.203 -178.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.64 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 15.0 pttt -79.86 -169.25 1.91 Allowed 'General case' 0 N--CA 1.481 1.117 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.195 169.315 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.539 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.4 tmtp? -145.22 143.25 30.17 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-O 121.377 0.608 . . . . 0.0 110.501 -174.3 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.436 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 8.4 tt -131.47 138.56 49.07 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.542 1.137 . . . . 0.0 108.075 174.491 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.474 HG21 ' HB3' ' A' ' 54' ' ' ASP . 17.4 pt -129.01 163.91 32.78 Favored 'Isoleucine or valine' 0 C--O 1.24 0.588 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 170.41 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.541 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -152.39 168.47 25.35 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 120.95 0.405 . . . . 0.0 110.074 178.683 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.7 tt -141.12 120.8 13.37 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 107.513 -1.291 . . . . 0.0 107.513 -177.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.536 ' HA ' ' O ' ' A' ' 64' ' ' SER . 60.0 m -110.73 113.78 26.65 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.664 0.786 . . . . 0.0 108.913 175.285 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -125.64 112.61 16.35 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 122.78 0.432 . . . . 0.0 110.925 -175.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.548 ' SG ' ' HB2' ' A' ' 13' ' ' MET . 44.0 t -121.27 136.61 25.92 Favored Pre-proline 0 N--CA 1.47 0.537 0 C-N-CA 123.928 0.891 . . . . 0.0 110.183 -179.589 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -69.58 -23.26 31.8 Favored 'Trans proline' 0 C--N 1.37 1.682 0 C-N-CA 122.781 2.321 . . . . 0.0 112.477 175.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.548 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 0.3 OUTLIER -71.65 -43.15 66.58 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.596 0.758 . . . . 0.0 111.209 -178.097 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 156.8 -172.06 34.39 Favored Glycine 0 C--N 1.345 1.055 0 CA-C-N 116.381 -0.372 . . . . 0.0 113.265 179.343 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 65.4 mt -82.6 -18.94 39.44 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 -175.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.85 -42.33 99.71 Favored 'General case' 0 N--CA 1.485 1.295 0 CA-C-N 118.818 0.736 . . . . 0.0 111.234 -177.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.438 ' CD2' HD22 ' A' ' 85' ' ' LEU . 16.4 t60 -65.76 -42.22 91.15 Favored 'General case' 0 C--O 1.247 0.966 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.124 177.417 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.45 HG23 HD13 ' A' ' 85' ' ' LEU . 35.3 p -67.38 -32.61 73.65 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.238 -178.517 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -74.47 -31.37 62.2 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.357 0.663 . . . . 0.0 111.738 -178.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 56.3 mtm -64.8 -41.27 95.94 Favored 'General case' 0 N--CA 1.485 1.316 0 CA-C-O 120.921 0.391 . . . . 0.0 110.234 172.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.35 -38.4 84.76 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.324 174.541 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.84 -32.79 72.73 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.401 0.68 . . . . 0.0 111.059 -179.334 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 25.2 tp60 -74.22 -42.77 59.22 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 122.944 0.498 . . . . 0.0 109.832 177.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.37 -51.01 61.5 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.489 -176.469 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.407 HD11 ' OG ' ' A' ' 64' ' ' SER . 94.3 mt -63.55 -34.26 77.41 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.502 0.721 . . . . 0.0 111.374 177.799 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.531 ' HA ' HG21 ' A' ' 36' ' ' VAL . 31.0 tt0 -56.38 -56.83 16.21 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 123.916 0.76 . . . . 0.0 110.455 174.686 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.455 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 44.8 mt-10 -52.79 -48.81 66.62 Favored 'General case' 0 N--CA 1.478 0.966 0 O-C-N 124.535 1.147 . . . . 0.0 111.238 -179.785 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.94 -49.14 78.96 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.303 1.041 . . . . 0.0 112.199 -177.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.26 -26.3 67.28 Favored 'General case' 0 CA--C 1.546 0.81 0 CA-C-N 115.372 -0.831 . . . . 0.0 112.863 178.519 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.456 HG23 ' O ' ' A' ' 26' ' ' GLU . 55.4 t -72.31 -38.3 61.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 178.21 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 8.4 mm-40 -71.54 -22.64 61.74 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 114.836 -1.074 . . . . 0.0 111.051 178.313 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -82.43 -20.19 37.5 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.318 0.647 . . . . 0.0 111.105 174.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 113.48 -37.56 3.55 Favored Glycine 0 C--N 1.348 1.225 0 N-CA-C 113.951 0.34 . . . . 0.0 113.951 167.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.64 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -76.0 174.39 10.05 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 -175.07 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.539 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 12.4 tp10 -72.56 151.65 42.29 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 113.935 -1.484 . . . . 0.0 109.507 178.515 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.531 HG21 ' HA ' ' A' ' 26' ' ' GLU . 9.6 p -136.05 128.71 46.26 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 C-N-CA 123.045 0.538 . . . . 0.0 110.753 -179.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 48.5 tptt -138.03 114.97 10.78 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.654 0.782 . . . . 0.0 109.071 176.276 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.541 HG12 ' HB3' ' A' ' 7' ' ' ALA . 43.2 mt -118.69 111.01 31.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -174.098 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -72.9 148.11 44.67 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 171.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.8 p -133.69 122.21 23.07 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.863 0.865 . . . . 0.0 109.182 -177.577 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -114.52 134.27 55.15 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -162.25 179.74 37.38 Favored Glycine 0 C--N 1.341 0.807 0 N-CA-C 112.699 -0.16 . . . . 0.0 112.699 -176.459 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.35 -24.19 67.21 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.943 0.897 . . . . 0.0 112.123 179.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -75.61 -36.3 60.3 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.598 0.759 . . . . 0.0 110.548 176.511 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 147.36 -156.52 27.02 Favored Glycine 0 C--N 1.346 1.099 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.417 -177.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 77.5 mt -113.12 141.5 28.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 174.198 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -135.54 150.25 49.68 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.258 1.023 . . . . 0.0 109.145 179.17 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 8.8 t30 64.3 39.29 7.37 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.533 1.133 . . . . 0.0 110.085 174.366 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 22.8 tpp180 -42.03 125.69 3.04 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 125.961 1.704 . . . . 0.0 113.31 -178.176 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 42.7 mt -82.48 126.95 32.82 Favored 'General case' 0 C--O 1.242 0.663 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.221 174.074 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.418 ' O ' HG13 ' A' ' 55' ' ' ILE . 60.2 p -96.64 164.35 12.63 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.932 -178.062 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.87 -29.92 63.37 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.462 0.705 . . . . 0.0 111.247 177.299 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.418 ' O ' ' HG3' ' A' ' 57' ' ' GLU . 47.7 tt0 -57.54 -61.14 2.72 Favored 'General case' 0 C--N 1.354 0.763 0 C-N-CA 123.783 0.833 . . . . 0.0 110.104 170.807 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.474 ' HB3' HG21 ' A' ' 6' ' ' ILE . 38.9 m-20 -52.02 -44.11 64.03 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 124.134 0.973 . . . . 0.0 112.343 -176.555 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.51 HG23 ' HG3' ' A' ' 78' ' ' ARG . 29.4 mt -67.4 -38.11 80.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 O-C-N 124.285 0.991 . . . . 0.0 111.742 -175.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -79.88 -28.69 39.9 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.218 179.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.418 ' HG3' ' O ' ' A' ' 53' ' ' GLN . 53.0 mt-10 -71.07 -35.97 72.09 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.534 0.734 . . . . 0.0 110.274 173.751 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -58.53 108.01 0.58 Allowed 'General case' 0 C--N 1.348 0.521 0 CA-C-N 114.643 -1.162 . . . . 0.0 111.997 -171.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 37.3 m -62.68 -40.43 97.06 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 115.046 -0.979 . . . . 0.0 109.041 165.01 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 80.4 mt -129.27 140.26 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.317 -178.194 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.464 HG23 HG13 ' A' ' 6' ' ' ILE . 20.2 mt -130.31 135.0 61.63 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 171.595 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -119.42 133.98 64.47 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 173.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . 0.43 ' HB2' ' HG3' ' A' ' 82' ' ' GLU . 13.2 m170 -107.46 84.35 1.95 Allowed 'General case' 0 N--CA 1.484 1.232 0 CA-C-O 121.481 0.658 . . . . 0.0 109.648 170.421 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.536 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 20.4 m -78.54 80.59 4.92 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 124.659 1.184 . . . . 0.0 110.344 177.014 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 34.7 m -125.37 160.0 31.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 CA-C-O 121.665 0.745 . . . . 0.0 112.175 -169.567 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -110.59 -23.13 11.27 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 114.589 -1.187 . . . . 0.0 109.071 173.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 17.0 m -130.86 165.87 30.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 C-N-CA 125.545 1.538 . . . . 0.0 108.638 178.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 88.8 m -62.29 117.17 27.75 Favored Pre-proline 0 CA--C 1.547 0.848 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 175.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.616 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 38.5 Cg_endo -63.92 142.91 83.89 Favored 'Trans proline' 0 C--N 1.376 2.002 0 C-N-CA 122.06 1.84 . . . . 0.0 111.544 177.907 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -68.61 -37.49 79.82 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.45 0.7 . . . . 0.0 110.715 -174.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -97.6 25.06 6.07 Favored 'General case' 0 C--O 1.219 -0.503 0 CA-C-N 115.21 -0.905 . . . . 0.0 110.683 -177.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.616 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 38.6 t30 -55.11 -37.35 66.77 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.148 0.579 . . . . 0.0 111.407 177.285 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.65 -22.1 66.89 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.613 0.765 . . . . 0.0 112.778 -179.181 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.6 mmp_? -66.71 -33.09 74.86 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.146 0.578 . . . . 0.0 111.455 174.097 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -107.62 -29.48 9.14 Favored 'General case' 0 N--CA 1.485 1.298 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -168.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -54.94 -27.43 43.4 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 -165.403 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 20.9 t -84.8 7.19 21.6 Favored 'General case' 0 CA--C 1.56 1.352 0 C-N-CA 123.638 0.775 . . . . 0.0 112.204 -179.412 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.51 ' HG3' HG23 ' A' ' 55' ' ' ILE . 34.9 mmt180 -121.28 -177.03 3.42 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 124.595 1.158 . . . . 0.0 110.036 179.511 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -79.5 86.79 5.14 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.062 0.545 . . . . 0.0 110.893 178.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 22.5 t -108.68 146.64 14.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 123.75 0.82 . . . . 0.0 109.877 179.184 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -125.73 96.04 4.64 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.819 0.848 . . . . 0.0 109.737 177.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.43 ' HG3' ' HB2' ' A' ' 63' ' ' HIS . 1.8 mp0 -72.3 129.1 37.62 Favored 'General case' 0 C--N 1.352 0.696 0 CA-C-O 121.233 0.54 . . . . 0.0 110.404 178.261 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.479 HG13 ' HA ' ' A' ' 64' ' ' SER . 45.8 pt -138.45 -176.48 1.35 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.83 0 C-N-CA 125.231 1.412 . . . . 0.0 108.386 177.271 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 13.1 p -83.63 147.44 27.71 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 122.63 0.372 . . . . 0.0 110.158 170.42 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.509 HD11 ' HB2' ' A' ' 11' ' ' CYS . 4.8 tt -63.26 -30.23 71.41 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.341 0.656 . . . . 0.0 111.153 178.074 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -61.38 -43.76 98.32 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.39 0.676 . . . . 0.0 110.946 173.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.42 ' HB3' HD12 ' A' ' 83' ' ' ILE . 9.6 t70 -59.77 -32.99 71.11 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.628 0.771 . . . . 0.0 110.901 179.427 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . 0.499 ' HB2' ' HB3' ' A' ' 64' ' ' SER . . . -65.46 -23.59 66.96 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.837 0.855 . . . . 0.0 113.244 179.112 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 34.9 mt -93.89 -51.12 11.51 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 123.091 0.556 . . . . 0.0 109.895 -179.187 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 58.1 pttt -75.62 -29.73 59.28 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.329 0.652 . . . . 0.0 112.297 -174.759 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -126.45 18.75 7.5 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 122.989 0.516 . . . . 0.0 110.886 -168.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -44.98 -57.35 3.88 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -174.671 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.27 -36.07 79.01 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.024 -0.989 . . . . 0.0 111.491 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -62.48 -56.55 20.97 Favored Glycine 0 C--N 1.351 1.365 0 O-C-N 124.152 0.908 . . . . 0.0 111.554 179.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.414 ' O ' HG13 ' A' ' 99' ' ' ILE . 33.7 mt -47.05 -57.76 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 125.039 1.336 . . . . 0.0 111.09 -179.383 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.9 mp -57.48 -53.49 43.48 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 O-C-N 124.244 0.965 . . . . 0.0 111.212 -176.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -27.26 67.64 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -176.567 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 24.3 mm-40 -69.33 -36.4 76.89 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.762 0.825 . . . . 0.0 109.744 178.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 95' ' ' ILE . 30.3 mt -77.99 -38.94 25.01 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -55.71 -47.84 76.17 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 114.22 -1.355 . . . . 0.0 111.489 176.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -74.56 -33.76 62.77 Favored 'General case' 0 C--N 1.349 0.557 0 O-C-N 123.566 0.541 . . . . 0.0 111.278 -177.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 70.3 mtm -60.46 -51.41 69.6 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 176.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 60.2 mt -65.76 -45.27 92.2 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.916 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.562 178.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.73 -31.53 72.24 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -175.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 66.1 m -84.2 -24.74 29.97 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -176.004 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -84.46 -31.8 24.38 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 122.002 0.121 . . . . 0.0 110.973 174.131 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -84.08 -33.32 24.41 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 122.847 0.459 . . . . 0.0 111.248 -178.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 27.3 mm-40 . . . . . 0 C--O 1.251 1.183 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 177.293 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.622 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 17.1 pttt . . . . . 0 N--CA 1.48 1.038 0 CA-C-O 121.302 0.573 . . . . 0.0 110.847 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.54 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.0 tmtp? -146.34 143.61 29.22 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -170.374 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.486 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.2 tt -132.29 141.9 49.17 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 175.924 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.496 HD13 ' HA ' ' A' ' 55' ' ' ILE . 21.0 pt -132.57 169.79 21.26 Favored 'Isoleucine or valine' 0 C--O 1.241 0.653 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 170.501 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.615 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -153.64 169.74 22.53 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.354 175.636 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.1 tt -143.03 113.5 7.38 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 178.12 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 64' ' ' SER . 56.3 m -101.05 113.53 26.63 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 175.956 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.474 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -126.8 119.0 25.79 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 122.626 0.37 . . . . 0.0 110.405 -178.035 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.514 ' SG ' ' HB2' ' A' ' 13' ' ' MET . 51.7 t -125.26 138.53 31.86 Favored Pre-proline 0 N--CA 1.472 0.64 0 C-N-CA 123.339 0.656 . . . . 0.0 111.185 -172.635 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -68.38 -20.42 42.27 Favored 'Trans proline' 0 C--N 1.378 2.109 0 C-N-CA 123.096 2.531 . . . . 0.0 112.606 172.319 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.514 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 60.5 mtt -75.91 -46.36 30.38 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.635 0.774 . . . . 0.0 110.01 178.674 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 141.92 -161.49 27.13 Favored Glycine 0 C--N 1.346 1.138 0 CA-C-N 116.038 -0.528 . . . . 0.0 113.307 176.492 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 52.9 mt -74.2 -26.61 60.37 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 -170.806 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.73 -43.34 94.25 Favored 'General case' 0 N--CA 1.485 1.32 0 CA-C-O 121.498 0.666 . . . . 0.0 110.971 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 8.6 t-160 -71.56 -38.1 71.0 Favored 'General case' 0 C--O 1.247 0.935 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.385 -178.353 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 51.6 p -66.45 -32.02 73.14 Favored 'General case' 0 C--N 1.35 0.604 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.869 178.647 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 18.6 m-30 -72.14 -30.35 64.95 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.049 0.54 . . . . 0.0 111.694 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 41.0 mtm -67.28 -40.19 86.09 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 120.758 0.313 . . . . 0.0 110.456 173.178 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.46 -36.6 74.01 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.363 176.383 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.56 -50.38 58.78 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.828 0.851 . . . . 0.0 110.301 -178.449 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.484 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 8.7 tp-100 -58.32 -43.94 88.4 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.737 0.815 . . . . 0.0 110.44 179.098 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.48 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -62.73 -54.39 39.88 Favored 'General case' 0 CA--C 1.55 0.96 0 CA-C-N 115.66 -0.7 . . . . 0.0 112.052 -178.204 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 92.1 mt -64.69 -29.61 70.61 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.196 0.598 . . . . 0.0 111.536 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.503 ' O ' HG23 ' A' ' 30' ' ' VAL . 32.9 tt0 -65.91 -55.27 17.78 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.812 0.695 . . . . 0.0 110.012 -179.385 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.51 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 27.5 mm-40 -52.44 -47.5 66.37 Favored 'General case' 0 N--CA 1.484 1.261 0 O-C-N 124.359 1.037 . . . . 0.0 110.432 178.88 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.49 -51.68 67.59 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.502 1.121 . . . . 0.0 111.925 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.55 -23.39 65.42 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 115.332 -0.849 . . . . 0.0 113.184 178.885 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.503 HG23 ' O ' ' A' ' 26' ' ' GLU . 53.9 t -74.88 -37.6 42.13 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 178.942 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.51 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 17.4 mm-40 -72.75 -21.48 61.01 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.745 177.393 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -80.64 -13.76 58.76 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.532 0.733 . . . . 0.0 111.76 174.044 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 105.0 -37.79 3.62 Favored Glycine 0 C--N 1.347 1.191 0 N-CA-C 114.278 0.471 . . . . 0.0 114.278 167.012 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.622 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -76.75 -179.4 5.35 Favored 'General case' 0 N--CA 1.483 1.207 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -175.897 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.54 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 8.8 tp10 -73.05 153.06 41.01 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 114.453 -1.248 . . . . 0.0 110.31 176.496 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.486 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 6.7 p -142.46 128.06 17.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 123.273 0.629 . . . . 0.0 110.595 176.961 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 49.7 tptt -136.39 114.51 11.48 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 177.649 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.615 HG12 ' HB3' ' A' ' 7' ' ' ALA . 59.2 mt -117.39 111.31 34.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.925 0 C-N-CA 122.6 0.36 . . . . 0.0 111.877 -174.327 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -77.99 141.79 38.7 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.614 0.766 . . . . 0.0 109.099 171.449 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.417 HG22 ' HB2' ' A' ' 9' ' ' CYS . 17.4 p -124.64 117.51 24.44 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.53 0.732 . . . . 0.0 109.294 -177.666 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.474 ' O ' ' HA ' ' A' ' 10' ' ' ALA . 42.1 mt-30 -109.81 135.79 50.16 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.578 0.751 . . . . 0.0 110.146 178.44 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -161.68 179.59 36.97 Favored Glycine 0 C--N 1.336 0.57 0 N-CA-C 111.929 -0.468 . . . . 0.0 111.929 178.38 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.24 -14.51 63.0 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.127 0.571 . . . . 0.0 111.998 -179.271 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -84.78 -27.37 26.91 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.468 0.707 . . . . 0.0 111.347 176.238 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 147.19 -157.67 27.48 Favored Glycine 0 C--N 1.344 0.986 0 CA-C-N 116.413 -0.358 . . . . 0.0 112.545 -179.597 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.418 HG12 ' HG2' ' A' ' 41' ' ' GLN . 70.2 mt -127.48 132.35 69.39 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 C-N-CA 123.711 0.804 . . . . 0.0 109.995 178.829 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.408 ' HB3' ' OG1' ' A' ' 40' ' ' THR . 8.2 tp-100 -126.91 150.25 49.4 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.198 0.999 . . . . 0.0 110.586 -178.143 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 19.7 t30 61.43 41.5 12.69 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 124.966 1.306 . . . . 0.0 110.219 174.84 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 22.6 tpp180 -48.35 122.34 5.27 Favored 'General case' 0 C--N 1.356 0.873 0 C-N-CA 125.277 1.431 . . . . 0.0 112.544 -176.278 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.43 ' HB2' HH22 ' A' ' 74' ' ' ARG . 36.9 mt -66.73 148.99 51.18 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 114.605 -1.179 . . . . 0.0 110.621 170.107 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 34.4 p -104.45 167.81 9.5 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 172.24 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.61 -34.49 71.19 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-O 121.019 0.438 . . . . 0.0 110.461 175.52 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -63.76 -48.64 76.12 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.847 175.288 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -54.18 -42.35 69.57 Favored 'General case' 0 N--CA 1.496 1.873 0 C-N-CA 123.321 0.648 . . . . 0.0 111.791 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.617 HG22 ' HG3' ' A' ' 78' ' ' ARG . 43.2 mt -75.28 -27.96 19.97 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.939 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.041 -176.205 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -75.51 -45.9 35.49 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.485 0.714 . . . . 0.0 111.117 176.624 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -61.38 -35.3 77.1 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.342 1.057 . . . . 0.0 110.77 178.513 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -53.15 100.49 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.579 0 O-C-N 125.001 1.438 . . . . 0.0 112.582 -174.071 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 30.2 m -63.94 -36.45 84.0 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 114.673 -1.149 . . . . 0.0 109.067 167.858 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.5 HG23 HG21 ' A' ' 99' ' ' ILE . 80.0 mt -129.05 140.45 49.2 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 CA-C-N 114.769 -1.105 . . . . 0.0 109.794 178.944 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.529 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 35.1 mt -129.89 141.37 46.6 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 171.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.6 mp -127.02 112.55 29.22 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 CA-C-N 118.344 0.52 . . . . 0.0 109.632 172.657 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 8.6 m170 -89.17 83.95 6.52 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-O 121.745 0.783 . . . . 0.0 109.322 170.862 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.462 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 20.6 p -80.32 79.86 6.85 Favored 'General case' 0 C--O 1.24 0.567 0 CA-C-N 114.361 -1.29 . . . . 0.0 109.312 176.509 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 27.6 m -126.21 161.52 31.79 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 CA-C-O 121.685 0.755 . . . . 0.0 111.943 -170.375 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -123.08 -17.24 6.75 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 114.491 -1.231 . . . . 0.0 109.592 175.187 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 6.7 m -131.92 159.22 43.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 124.699 1.2 . . . . 0.0 108.401 173.666 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 79.0 m -64.45 111.83 6.46 Favored Pre-proline 0 CA--C 1.544 0.714 0 O-C-N 123.8 0.688 . . . . 0.0 109.663 177.348 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.512 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 55.8 Cg_endo -68.14 142.23 55.17 Favored 'Trans proline' 0 C--N 1.376 2.01 0 C-N-CA 122.175 1.916 . . . . 0.0 110.651 -179.157 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.425 ' HB2' HE22 ' A' ' 41' ' ' GLN . 18.4 mm-40 -65.36 -21.87 66.74 Favored 'General case' 0 N--CA 1.482 1.141 0 CA-C-O 121.327 0.584 . . . . 0.0 111.63 -173.496 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.838 ' HB3' HH11 ' A' ' 74' ' ' ARG . 4.0 m-20 -104.46 12.61 33.1 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.201 1.0 . . . . 0.0 112.737 -174.511 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.512 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 5.6 p30 -60.06 -24.95 64.98 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.558 0.743 . . . . 0.0 112.384 -176.044 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -60.89 -32.4 71.86 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.887 1.275 . . . . 0.0 113.08 -179.561 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.838 HH11 ' HB3' ' A' ' 71' ' ' ASP . 40.1 mtp180 -68.36 -25.32 65.02 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 124.338 1.055 . . . . 0.0 111.569 -179.418 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.433 ' HB3' HG21 ' A' ' 80' ' ' VAL . 33.0 m-85 -103.07 -2.21 27.87 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 114.139 -1.392 . . . . 0.0 111.277 -175.511 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -54.79 -42.76 72.16 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 124.639 1.176 . . . . 0.0 111.933 -179.136 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 58.5 p -82.86 -13.69 55.68 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.642 0.777 . . . . 0.0 112.358 -177.087 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.617 ' HG3' HG22 ' A' ' 55' ' ' ILE . 33.3 mmt180 -103.64 164.54 11.6 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.706 0.802 . . . . 0.0 111.63 -169.01 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -83.38 99.35 10.0 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 123.748 0.819 . . . . 0.0 110.146 -177.249 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.529 ' HA ' ' HB ' ' A' ' 61' ' ' ILE . 51.4 t -112.28 135.68 50.87 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 C-N-CA 123.643 0.777 . . . . 0.0 110.514 -174.926 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 73.6 m-85 -104.26 88.58 3.02 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 107.367 -1.345 . . . . 0.0 107.367 175.074 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -86.92 116.13 24.79 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 114.619 -1.173 . . . . 0.0 109.676 -172.203 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.439 HG13 ' HA ' ' A' ' 64' ' ' SER . 43.6 pt -126.24 -172.58 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 124.693 1.197 . . . . 0.0 110.106 -179.459 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 15.9 p -82.79 147.34 28.45 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.728 169.675 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.444 HD13 ' HB2' ' A' ' 11' ' ' CYS . 6.5 tt -62.85 -27.69 69.51 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.381 176.924 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.659 ' HG2' ' HE2' ' A' ' 90' ' ' LYS . 10.1 tt0 -71.11 -40.52 71.42 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 122.725 0.41 . . . . 0.0 111.113 177.016 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.43 ' HB3' HD12 ' A' ' 83' ' ' ILE . 24.5 t70 -59.86 -33.54 71.94 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.101 0.561 . . . . 0.0 110.195 176.695 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.54 -28.44 69.86 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.881 0.872 . . . . 0.0 112.739 177.896 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 63.9 mt -88.03 -49.04 14.77 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.992 0 C-N-CA 123.287 0.635 . . . . 0.0 110.273 -179.372 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.659 ' HE2' ' HG2' ' A' ' 86' ' ' GLN . 0.1 OUTLIER -79.46 -30.69 42.24 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 -173.599 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -123.31 16.8 9.81 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.148 0.579 . . . . 0.0 110.851 -170.088 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.48 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -40.22 -59.01 1.36 Allowed 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 124.304 1.042 . . . . 0.0 113.584 -173.111 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.56 -39.5 94.55 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 114.919 -1.037 . . . . 0.0 111.165 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -60.6 -46.78 93.76 Favored Glycine 0 C--N 1.354 1.553 0 O-C-N 124.304 1.003 . . . . 0.0 112.055 -178.386 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.428 HD12 ' HA ' ' A' ' 92' ' ' ALA . 34.1 mt -53.53 -62.21 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 124.893 1.277 . . . . 0.0 110.219 177.478 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.7 mp -55.04 -53.8 30.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 O-C-N 124.178 0.924 . . . . 0.0 111.227 -174.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.16 -28.93 69.15 Favored 'General case' 0 N--CA 1.485 1.302 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -175.072 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 50.5 mm-40 -71.93 -36.76 70.02 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 122.572 0.349 . . . . 0.0 110.418 176.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.5 HG21 HG23 ' A' ' 60' ' ' ILE . 55.3 mt -71.82 -35.59 55.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 179.403 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -59.05 -49.46 77.8 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-N 114.337 -1.301 . . . . 0.0 111.13 177.226 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -79.5 -25.96 41.69 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -175.861 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 65.2 mtm -69.04 -53.68 19.17 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 122.575 0.35 . . . . 0.0 110.393 174.772 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 26.6 mt -61.44 -49.22 85.36 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.281 177.296 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.524 ' O ' ' HG2' ' A' ' 108' ' ' GLN . . . -56.02 -39.97 72.73 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 122.961 0.505 . . . . 0.0 111.55 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 30.6 t -62.28 -45.84 91.46 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 123.981 0.8 . . . . 0.0 110.652 -177.187 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -78.82 -19.8 51.22 Favored 'General case' 0 N--CA 1.483 1.193 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 179.143 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 20.3 mm-40 -85.25 -12.62 52.06 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 122.84 0.456 . . . . 0.0 111.841 178.259 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.524 ' HG2' ' O ' ' A' ' 104' ' ' ALA . 76.8 mm-40 . . . . . 0 CA--C 1.556 1.21 0 CA-C-O 119.214 -0.422 . . . . 0.0 110.129 175.057 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.456 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 3.2 pttt . . . . . 0 N--CA 1.482 1.132 0 CA-C-O 120.963 0.411 . . . . 0.0 110.229 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.431 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 3.6 tmtp? -143.86 139.56 29.31 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 -172.863 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.472 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 8.6 tt -128.86 140.15 51.82 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 176.45 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 23.1 pt -128.87 158.4 41.44 Favored 'Isoleucine or valine' 0 C--O 1.24 0.594 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 170.381 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.636 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -147.19 169.53 19.14 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 177.386 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.443 HD21 ' OE1' ' A' ' 41' ' ' GLN . 5.4 tt -143.68 117.9 9.56 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 -179.144 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.511 ' HA ' ' O ' ' A' ' 64' ' ' SER . 61.5 m -108.39 108.41 19.36 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.88 0.872 . . . . 0.0 109.364 176.883 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -123.3 124.11 42.25 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 122.783 0.433 . . . . 0.0 110.697 -179.18 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.772 ' SG ' HD13 ' A' ' 85' ' ' LEU . 1.3 m -142.67 144.61 30.74 Favored Pre-proline 0 N--CA 1.483 1.209 0 C-N-CA 123.218 0.607 . . . . 0.0 111.766 -179.493 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -83.65 -14.57 7.74 Favored 'Trans proline' 0 C--N 1.373 1.868 0 C-N-CA 123.496 2.797 . . . . 0.0 112.447 174.424 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 23.1 ttt -60.38 -53.23 60.14 Favored 'General case' 0 C--N 1.357 0.908 0 C-N-CA 123.411 0.684 . . . . 0.0 109.671 174.062 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 157.48 175.26 28.21 Favored Glycine 0 C--O 1.246 0.87 0 CA-C-N 115.136 -0.938 . . . . 0.0 112.047 -179.115 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 29.9 mt -67.37 -20.61 65.59 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 122.925 0.49 . . . . 0.0 111.877 177.438 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.9 -45.53 82.54 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-O 121.008 0.433 . . . . 0.0 110.792 174.439 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.474 ' HD1' ' HG ' ' A' ' 11' ' ' CYS . 12.1 t-160 -68.48 -44.8 73.97 Favored 'General case' 0 C--O 1.242 0.666 0 CA-C-N 115.366 -0.833 . . . . 0.0 109.86 -179.174 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.491 ' HA ' HD11 ' A' ' 85' ' ' LEU . 47.5 p -64.7 -37.99 89.48 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.413 -176.942 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.479 ' HZ ' ' HG2' ' A' ' 47' ' ' GLN . 13.2 m-85 -74.25 -28.2 61.11 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.191 0.596 . . . . 0.0 112.0 -178.044 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 67.5 mtm -69.63 -36.7 76.36 Favored 'General case' 0 N--CA 1.483 1.222 0 CA-C-N 118.024 0.375 . . . . 0.0 110.483 173.885 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.02 -40.2 71.92 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.95 174.302 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.32 -42.75 83.11 Favored 'General case' 0 C--O 1.217 -0.613 0 C-N-CA 123.715 0.806 . . . . 0.0 110.334 -178.508 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.476 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 8.9 tp-100 -61.7 -47.23 86.23 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.463 0.705 . . . . 0.0 109.503 178.556 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.563 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -62.03 -52.8 62.51 Favored 'General case' 0 CA--C 1.552 1.038 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.698 -177.799 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 75.6 mt -64.54 -32.63 74.35 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.535 0.734 . . . . 0.0 111.635 -179.193 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.58 ' HA ' HG21 ' A' ' 36' ' ' VAL . 30.6 tt0 -65.89 -55.7 15.6 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 123.688 0.617 . . . . 0.0 110.141 -179.129 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.558 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 19.9 mm-40 -55.82 -44.36 77.8 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 124.456 1.097 . . . . 0.0 110.255 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -57.01 -50.44 72.72 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.162 0.985 . . . . 0.0 111.66 177.745 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.62 -22.88 65.32 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 123.671 0.788 . . . . 0.0 113.096 178.879 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 26' ' ' GLU . 55.1 t -75.97 -40.16 37.81 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.715 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.558 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 7.1 mm-40 -72.67 -18.53 61.55 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.513 177.845 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -80.93 -12.28 59.43 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.112 0.965 . . . . 0.0 111.302 173.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 82.77 23.43 55.88 Favored Glycine 0 C--N 1.349 1.298 0 N-CA-C 114.764 0.666 . . . . 0.0 114.764 167.732 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.456 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.1 OUTLIER -129.55 176.96 7.57 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.283 0.633 . . . . 0.0 111.089 173.138 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.431 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 11.7 tp10 -72.86 153.39 41.06 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.131 178.865 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.58 HG21 ' HA ' ' A' ' 26' ' ' GLU . 6.4 p -141.5 128.96 21.36 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 C-N-CA 123.426 0.69 . . . . 0.0 110.637 179.603 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 47.7 tptt -135.78 111.13 9.08 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.521 0.728 . . . . 0.0 109.568 179.289 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.636 HG12 ' HB3' ' A' ' 7' ' ' ALA . 48.4 mt -116.15 113.45 43.23 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.235 0 N-CA-C 112.767 0.654 . . . . 0.0 112.767 -172.604 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -79.22 117.65 20.43 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 123.933 0.893 . . . . 0.0 110.047 176.257 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.437 ' OG1' ' HB3' ' A' ' 47' ' ' GLN . 3.3 p -103.51 103.93 13.95 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.237 0.615 . . . . 0.0 110.623 -179.612 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.443 ' OE1' HD21 ' A' ' 8' ' ' LEU . 31.3 mt-30 -98.62 132.17 44.23 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 -179.576 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -148.29 179.85 24.82 Favored Glycine 0 C--O 1.241 0.588 0 N-CA-C 111.483 -0.647 . . . . 0.0 111.483 177.419 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.78 -23.75 67.49 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.46 0.704 . . . . 0.0 111.348 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -67.76 -44.47 77.44 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.819 1.247 . . . . 0.0 110.173 174.051 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 150.61 -175.79 29.47 Favored Glycine 0 C--N 1.336 0.54 0 CA-C-N 114.822 -1.081 . . . . 0.0 111.482 -175.292 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.467 HG21 ' NH1' ' A' ' 49' ' ' ARG . 67.6 mt -98.86 111.66 29.03 Favored 'Isoleucine or valine' 0 C--O 1.24 0.587 0 C-N-CA 123.685 0.794 . . . . 0.0 109.78 -179.412 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.479 ' HG2' ' HZ ' ' A' ' 19' ' ' PHE . 64.1 tp60 -96.33 148.48 22.71 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.104 0.962 . . . . 0.0 110.084 177.931 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 25.8 t30 79.82 -54.21 0.39 Allowed 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 126.264 1.826 . . . . 0.0 111.571 173.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.467 ' NH1' HG21 ' A' ' 46' ' ' ILE . 17.7 tpp180 65.32 144.63 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.238 0 C-N-CA 125.347 1.459 . . . . 0.0 112.918 176.781 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 37.8 mt -112.29 129.9 56.12 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.391 1.077 . . . . 0.0 109.86 173.864 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 39.7 p -95.92 165.34 12.32 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.931 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.53 -30.46 63.08 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.479 0.712 . . . . 0.0 111.317 177.221 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -67.79 -47.34 69.4 Favored 'General case' 0 C--N 1.353 0.731 0 C-N-CA 123.699 0.8 . . . . 0.0 110.959 176.763 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -56.33 -44.42 79.98 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.386 0.674 . . . . 0.0 110.902 178.685 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.503 HG22 ' HG3' ' A' ' 78' ' ' ARG . 33.1 mt -72.39 -36.85 56.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 O-C-N 124.483 1.115 . . . . 0.0 111.277 -175.898 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.42 -44.01 68.79 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.385 0.674 . . . . 0.0 111.124 -178.676 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -86.31 -8.1 57.97 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.305 0.642 . . . . 0.0 111.998 -177.006 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.69 108.45 1.72 Allowed 'General case' 0 N--CA 1.473 0.71 0 O-C-N 123.709 0.63 . . . . 0.0 111.053 178.646 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 17.3 m -62.1 -37.22 84.28 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.429 167.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.584 HG23 HG21 ' A' ' 99' ' ' ILE . 76.5 mt -132.25 141.89 44.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 C-N-CA 124.363 1.065 . . . . 0.0 110.346 -176.543 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 27.2 mt -131.85 132.2 61.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 C-N-CA 123.916 0.887 . . . . 0.0 108.812 172.747 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.4 mp -119.23 133.25 66.67 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 172.126 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' HIS . . . . . 0.523 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 11.7 m170 -109.58 84.96 2.01 Favored 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 167.868 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.511 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 28.0 p -81.31 85.39 6.41 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 114.514 -1.221 . . . . 0.0 108.995 174.095 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 35.9 m -126.85 160.59 35.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-O 121.783 0.802 . . . . 0.0 111.982 -171.34 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -118.2 -19.01 9.18 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 114.007 -1.452 . . . . 0.0 109.116 176.016 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 5.8 m -132.19 160.49 42.45 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 C-N-CA 125.533 1.533 . . . . 0.0 108.037 176.844 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 63.8 m -59.47 116.78 17.77 Favored Pre-proline 0 C--O 1.244 0.766 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 174.243 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.524 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 37.9 Cg_endo -63.27 140.15 75.7 Favored 'Trans proline' 0 C--N 1.372 1.792 0 C-N-CA 121.949 1.766 . . . . 0.0 110.702 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -59.34 -38.11 79.51 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 123.92 0.762 . . . . 0.0 110.551 -174.708 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.435 ' HB3' ' HG3' ' A' ' 74' ' ' ARG . 4.4 m-20 -104.12 30.45 5.21 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 114.51 -1.223 . . . . 0.0 111.385 -174.13 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.524 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 7.2 p30 -59.89 -27.82 67.03 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.413 0.685 . . . . 0.0 110.858 177.582 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -60.04 -32.83 71.27 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.258 1.423 . . . . 0.0 112.262 176.397 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.435 ' HG3' ' HB3' ' A' ' 71' ' ' ASP . 12.1 mmp_? -66.26 -30.82 71.33 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 124.202 1.001 . . . . 0.0 111.715 -176.654 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -108.29 -2.06 19.56 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.962 -169.865 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -62.3 -35.27 78.52 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.265 0.626 . . . . 0.0 112.204 -172.824 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 69.8 p -75.74 -15.43 60.28 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.412 0.685 . . . . 0.0 112.014 -179.075 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.503 ' HG3' HG22 ' A' ' 55' ' ' ILE . 38.0 mmt180 -109.32 163.22 13.59 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.751 0.82 . . . . 0.0 111.153 -173.872 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 33.2 m-20 -76.42 109.25 9.98 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.463 0.705 . . . . 0.0 110.357 177.461 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 44.3 t -113.69 137.58 46.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 123.437 0.695 . . . . 0.0 109.918 179.339 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 79.7 m-85 -101.75 89.82 3.81 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 176.756 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.523 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 42.5 mt-10 -83.19 125.54 31.66 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.725 -174.631 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.509 HG13 ' HA ' ' A' ' 64' ' ' SER . 42.1 pt -136.09 -174.35 1.08 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 C-N-CA 124.928 1.291 . . . . 0.0 108.84 -179.558 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 22.0 p -87.45 152.3 22.34 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 120.911 0.386 . . . . 0.0 110.02 169.097 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.772 HD13 ' SG ' ' A' ' 11' ' ' CYS . 8.0 tt -66.26 -27.34 67.87 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.905 178.843 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.594 ' HG2' ' HE3' ' A' ' 90' ' ' LYS . 35.6 tt0 -63.76 -43.45 96.39 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.461 0.705 . . . . 0.0 110.719 173.782 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -61.61 -31.64 71.72 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.577 0.751 . . . . 0.0 110.818 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.02 -33.17 75.4 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.664 0.785 . . . . 0.0 112.433 177.159 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 86.0 mt -79.03 -46.79 23.44 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.846 0 C-N-CA 123.634 0.773 . . . . 0.0 110.524 -177.741 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.594 ' HE3' ' HG2' ' A' ' 86' ' ' GLN . 18.6 ptpt -81.9 -43.04 18.69 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.114 0.566 . . . . 0.0 111.994 -174.9 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 62.9 t30 -113.77 28.49 8.72 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.762 0.825 . . . . 0.0 110.907 -169.022 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.563 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -45.02 -62.1 1.37 Allowed 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -175.562 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.56 -36.51 82.9 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.056 -0.974 . . . . 0.0 110.913 -179.322 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -61.1 -48.54 85.45 Favored Glycine 0 C--N 1.354 1.569 0 O-C-N 124.616 1.198 . . . . 0.0 112.752 -178.668 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 22.5 mt -55.74 -56.77 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.169 0.988 . . . . 0.0 110.245 178.841 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.425 HG23 ' OH ' ' A' ' 34' ' ' TYR . 1.7 mp -55.75 -50.91 64.85 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.048 0 O-C-N 124.247 0.967 . . . . 0.0 111.71 -177.342 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -32.19 73.14 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 112.041 0.386 . . . . 0.0 112.041 -176.577 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -64.81 -39.02 92.9 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 123.7 0.625 . . . . 0.0 109.734 178.234 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.584 HG21 HG23 ' A' ' 60' ' ' ILE . 53.2 mt -73.14 -39.07 56.32 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.983 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -56.7 -48.99 76.47 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.973 0.909 . . . . 0.0 111.243 178.666 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -74.66 -32.35 62.21 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 123.631 0.582 . . . . 0.0 111.483 -175.282 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 69.3 mtm -66.02 -47.75 73.39 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 122.582 0.353 . . . . 0.0 110.688 175.805 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 30.5 mt -68.02 -39.18 81.09 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.411 179.103 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.15 -28.65 69.56 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.045 0.538 . . . . 0.0 111.083 177.724 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 18.2 t -74.15 -43.27 58.05 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 123.155 0.582 . . . . 0.0 110.949 -178.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -76.63 -34.88 58.32 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 122.93 0.492 . . . . 0.0 111.513 -179.144 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -75.85 -24.1 55.76 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 122.966 0.507 . . . . 0.0 111.574 -178.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 32.3 mm-40 . . . . . 0 N--CA 1.478 0.964 0 CA-C-O 118.458 -0.782 . . . . 0.0 109.789 177.608 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 43.9 pttt . . . . . 0 N--CA 1.471 0.577 0 CA-C-O 120.676 0.275 . . . . 0.0 110.607 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.596 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.1 tmtp? -141.25 137.37 32.49 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 -170.187 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.477 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 10.2 tt -130.01 130.32 44.84 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 178.381 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.5 HD12 HD13 ' A' ' 50' ' ' LEU . 14.2 pt -121.34 165.61 16.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 172.589 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.599 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -152.09 169.15 23.11 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.641 176.51 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.9 tt -141.45 115.46 9.25 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.528 ' HA ' ' O ' ' A' ' 64' ' ' SER . 62.1 m -107.24 111.61 24.09 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 177.68 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.449 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -125.69 112.66 16.37 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 122.474 0.31 . . . . 0.0 111.106 -175.181 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.521 ' HB2' HD13 ' A' ' 85' ' ' LEU . 36.0 t -127.43 136.2 28.58 Favored Pre-proline 0 N--CA 1.473 0.693 0 C-N-CA 123.791 0.836 . . . . 0.0 110.442 -179.261 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -76.07 -19.48 15.65 Favored 'Trans proline' 0 C--N 1.365 1.447 0 C-N-CA 122.972 2.448 . . . . 0.0 112.791 177.15 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.447 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 21.7 mmt -71.89 -31.94 66.93 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.513 0.725 . . . . 0.0 110.663 -178.91 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 149.24 175.67 21.82 Favored Glycine 0 C--N 1.348 1.216 0 CA-C-N 115.789 -0.642 . . . . 0.0 112.675 177.198 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.6 mt -73.67 -19.57 60.79 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.582 0.753 . . . . 0.0 112.509 -179.395 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.04 -44.09 87.2 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-O 121.189 0.518 . . . . 0.0 111.325 177.884 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 11.9 t-160 -66.69 -41.51 87.93 Favored 'General case' 0 C--O 1.247 0.923 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.275 179.075 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 34.2 p -66.77 -32.78 74.29 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.99 -178.595 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.6 m-30 -69.49 -31.63 70.01 Favored 'General case' 0 C--N 1.354 0.772 0 C-N-CA 123.246 0.618 . . . . 0.0 111.25 178.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 64.5 mtm -67.01 -41.15 87.14 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-O 120.639 0.257 . . . . 0.0 110.901 175.7 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.14 -44.55 83.88 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.065 174.416 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.13 -41.28 97.27 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.954 0.901 . . . . 0.0 110.895 -177.415 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -57.17 -54.75 43.21 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.981 0.912 . . . . 0.0 109.949 177.73 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.06 -42.87 93.79 Favored 'General case' 0 CA--C 1.553 1.06 0 CA-C-N 114.953 -1.021 . . . . 0.0 111.99 -174.279 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.424 HD11 ' OG ' ' A' ' 64' ' ' SER . 89.2 mt -68.11 -35.77 78.68 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 123.13 0.572 . . . . 0.0 111.265 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.558 ' HA ' HG21 ' A' ' 36' ' ' VAL . 35.6 tt0 -62.19 -53.0 61.56 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 123.837 0.71 . . . . 0.0 109.725 -178.455 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.447 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 45.3 mt-10 -54.59 -46.77 73.82 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 114.547 -1.206 . . . . 0.0 110.402 179.442 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.58 -52.12 67.03 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.323 1.049 . . . . 0.0 111.729 -178.488 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.94 -24.31 67.48 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 178.703 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 26' ' ' GLU . 50.5 t -77.09 -42.35 31.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.414 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 19.6 mm-40 -66.67 -28.39 68.42 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 114.604 -1.18 . . . . 0.0 110.344 175.24 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -80.18 -25.08 39.89 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.211 1.005 . . . . 0.0 111.923 176.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.96 32.74 7.74 Favored Glycine 0 C--N 1.344 0.999 0 N-CA-C 114.264 0.466 . . . . 0.0 114.264 170.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -102.4 163.48 12.21 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 117.36 0.58 . . . . 0.0 109.592 168.5 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.596 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 41.0 tt0 -73.66 124.97 26.99 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 106.502 -1.666 . . . . 0.0 106.502 158.509 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.558 HG21 ' HA ' ' A' ' 26' ' ' GLU . 13.5 p -111.27 137.32 44.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 CA-C-N 118.635 0.652 . . . . 0.0 110.72 -174.335 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 45.0 tptt -148.21 111.77 5.02 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 178.741 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.599 HG12 ' HB3' ' A' ' 7' ' ' ALA . 48.9 mt -116.94 110.63 31.98 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 122.602 0.361 . . . . 0.0 111.891 -173.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -77.92 115.25 17.52 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 123.238 0.615 . . . . 0.0 109.658 176.267 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 7.0 p -95.76 108.09 20.38 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.938 177.605 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.54 ' HG2' HG12 ' A' ' 46' ' ' ILE . 42.2 mt-30 -100.97 154.02 19.04 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.256 0.623 . . . . 0.0 110.679 176.2 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -171.08 -178.39 41.56 Favored Glycine 0 C--O 1.238 0.379 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.617 178.177 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.34 -26.05 66.3 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.089 0.556 . . . . 0.0 111.327 178.348 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -65.8 -39.41 90.91 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.495 0.718 . . . . 0.0 110.117 171.584 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 142.18 -151.99 23.32 Favored Glycine 0 C--N 1.341 0.852 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.969 -178.426 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.54 HG12 ' HG2' ' A' ' 41' ' ' GLN . 65.2 mt -113.21 145.25 19.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 123.683 0.793 . . . . 0.0 110.067 -174.112 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -140.01 149.28 43.02 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.865 0.866 . . . . 0.0 110.137 -179.267 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 44.1 t30 79.1 -49.94 0.43 Allowed 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 126.487 1.915 . . . . 0.0 110.043 178.848 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 21.7 tpp180 66.86 122.82 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.869 1.667 . . . . 0.0 113.339 169.722 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.5 HD13 HD12 ' A' ' 6' ' ' ILE . 39.4 mt -92.31 146.41 23.72 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 114.772 -1.104 . . . . 0.0 110.55 172.481 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.42 ' O ' HG13 ' A' ' 55' ' ' ILE . 66.4 p -105.12 166.63 10.26 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.744 0.818 . . . . 0.0 109.693 176.478 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.06 -29.49 69.77 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 122.931 0.492 . . . . 0.0 110.562 176.752 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -72.27 -41.14 67.06 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.43 177.671 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -59.5 -43.49 93.34 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 122.836 0.454 . . . . 0.0 110.927 177.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.663 HG22 ' HG3' ' A' ' 78' ' ' ARG . 23.1 mt -74.38 -32.32 30.62 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 O-C-N 123.961 0.788 . . . . 0.0 110.891 -176.692 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.57 -41.5 62.83 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.434 0.694 . . . . 0.0 111.619 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -91.27 -3.04 57.26 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.554 0.742 . . . . 0.0 111.398 -177.78 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.55 106.22 1.11 Allowed 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 122.948 0.499 . . . . 0.0 110.437 176.239 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 27.7 m -60.26 -36.92 78.9 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.846 0.858 . . . . 0.0 109.44 169.755 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 72.8 mt -137.27 143.35 34.68 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 123.904 0.882 . . . . 0.0 110.315 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.498 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 26.3 mt -127.81 135.64 62.48 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 171.46 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -124.12 111.16 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 CA-C-N 118.405 0.548 . . . . 0.0 109.526 173.442 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 12.1 m170 -88.24 85.28 6.89 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-O 121.586 0.708 . . . . 0.0 109.524 174.35 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.528 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 25.0 m -81.01 82.64 6.92 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.542 176.767 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 29.5 m -125.93 155.78 35.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 CA-C-O 121.965 0.888 . . . . 0.0 112.209 -170.563 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -107.87 -25.07 11.39 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 113.91 -1.496 . . . . 0.0 109.365 175.751 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 15.0 m -131.4 171.15 18.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 125.328 1.451 . . . . 0.0 108.664 176.67 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 22.1 m -64.72 116.87 32.85 Favored Pre-proline 0 CA--C 1.55 0.974 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 171.533 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.43 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 37.0 Cg_endo -66.71 145.56 75.91 Favored 'Trans proline' 0 C--N 1.372 1.773 0 C-N-CA 121.506 1.471 . . . . 0.0 110.388 174.393 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.451 ' HB2' HE22 ' A' ' 41' ' ' GLN . 42.2 mm-40 -64.52 -28.98 70.02 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.241 0.616 . . . . 0.0 111.406 -176.138 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.601 ' HB3' HH11 ' A' ' 74' ' ' ARG . 0.9 OUTLIER -103.17 18.24 22.19 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.468 1.107 . . . . 0.0 111.616 -173.901 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.43 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 6.7 p30 -56.65 -32.4 65.32 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 124.385 1.074 . . . . 0.0 113.018 -175.274 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.46 ' HA ' ' HB2' ' A' ' 76' ' ' GLU . 2.1 pp20? -76.38 -18.16 59.01 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.704 0.802 . . . . 0.0 112.515 -171.17 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.601 HH11 ' HB3' ' A' ' 71' ' ' ASP . 41.0 mtp180 -67.4 -26.68 66.55 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.018 0.927 . . . . 0.0 111.312 174.063 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -104.01 -4.36 23.43 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 114.463 -1.244 . . . . 0.0 111.017 -176.042 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.46 ' HB2' ' HA ' ' A' ' 73' ' ' GLU . 37.9 tt0 -61.96 -32.2 72.61 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 124.579 1.152 . . . . 0.0 112.474 -173.692 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 32.0 t -92.13 3.91 54.29 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.392 0.677 . . . . 0.0 111.836 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.663 ' HG3' HG22 ' A' ' 55' ' ' ILE . 39.8 mmt180 -117.61 166.3 12.56 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.718 0.807 . . . . 0.0 111.446 -177.036 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -79.35 94.24 5.46 Favored 'General case' 0 C--O 1.244 0.789 0 C-N-CA 123.675 0.79 . . . . 0.0 110.673 -177.245 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.498 ' HA ' ' HB ' ' A' ' 61' ' ' ILE . 60.8 t -104.97 141.35 20.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 124.151 0.98 . . . . 0.0 110.727 -178.369 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -114.52 88.71 2.92 Favored 'General case' 0 C--O 1.24 0.553 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 174.436 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -84.59 120.97 26.97 Favored 'General case' 0 C--N 1.346 0.442 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.363 -174.523 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.434 HD12 ' HB3' ' A' ' 87' ' ' ASP . 48.5 pt -125.24 -179.33 2.35 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 124.434 1.094 . . . . 0.0 109.466 177.491 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 24.1 p -76.83 148.22 36.68 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.533 168.464 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.521 HD13 ' HB2' ' A' ' 11' ' ' CYS . 4.7 tt -62.51 -28.64 69.98 Favored 'General case' 0 N--CA 1.481 1.098 0 O-C-N 124.046 0.841 . . . . 0.0 111.27 179.47 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -64.3 -44.92 90.14 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.285 0.634 . . . . 0.0 111.266 176.26 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.434 ' HB3' HD12 ' A' ' 83' ' ' ILE . 24.3 t70 -59.98 -31.47 69.94 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.542 0.737 . . . . 0.0 110.649 -177.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.19 -26.61 64.92 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.943 0.897 . . . . 0.0 112.922 179.482 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 57.0 mt -85.24 -40.1 14.55 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.964 0 C-N-CA 123.111 0.564 . . . . 0.0 110.459 -179.11 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.44 -56.1 3.45 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 122.793 0.437 . . . . 0.0 111.795 -176.625 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -95.46 20.53 9.35 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.843 0.857 . . . . 0.0 110.959 -170.296 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.508 ' HA ' HD12 ' A' ' 95' ' ' ILE . . . -43.22 -62.34 1.08 Allowed 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 124.607 1.163 . . . . 0.0 114.132 -172.575 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.21 -34.59 75.35 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.028 178.806 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.07 -43.04 99.38 Favored Glycine 0 C--N 1.351 1.407 0 O-C-N 124.495 1.122 . . . . 0.0 112.758 178.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.508 HD12 ' HA ' ' A' ' 92' ' ' ALA . 22.2 mt -62.37 -57.96 9.71 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 C-N-CA 124.185 0.994 . . . . 0.0 109.973 -177.951 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.43 HG13 HD11 ' A' ' 5' ' ' LEU . 2.0 mp -58.4 -45.71 89.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 O-C-N 124.093 0.87 . . . . 0.0 110.608 -175.947 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 2.5 pptp? -69.72 -27.62 65.13 Favored 'General case' 0 N--CA 1.48 1.047 0 O-C-N 123.605 0.565 . . . . 0.0 111.556 -177.368 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 38.9 mm-40 -62.91 -42.55 99.83 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 174.347 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 13.1 mt -78.43 -33.36 17.22 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.387 -175.194 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -54.79 -53.69 51.87 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.604 1.162 . . . . 0.0 111.281 171.619 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -72.16 -33.77 67.97 Favored 'General case' 0 N--CA 1.48 1.064 0 O-C-N 123.594 0.559 . . . . 0.0 111.25 -175.337 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 71.1 mtm -64.29 -49.3 72.34 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 122.937 0.495 . . . . 0.0 110.592 177.134 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 36.8 mt -67.05 -42.16 88.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 C-N-CA 123.232 0.613 . . . . 0.0 110.302 177.865 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.88 -12.56 61.61 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 122.925 0.49 . . . . 0.0 111.843 -179.082 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 29.9 t -92.4 -39.71 11.28 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 122.609 0.364 . . . . 0.0 110.804 176.688 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -78.71 -28.18 45.07 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.757 0.423 . . . . 0.0 111.458 -177.311 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.7 mm-40 -84.35 -41.33 16.87 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.175 0.59 . . . . 0.0 109.876 178.454 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 76.3 mm-40 . . . . . 0 C--O 1.255 1.35 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.632 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.63 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 13.4 pttt . . . . . 0 C--O 1.247 0.962 0 CA-C-O 121.291 0.567 . . . . 0.0 111.179 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.514 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.2 tmtp? -142.96 142.48 31.66 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 121.102 0.477 . . . . 0.0 109.81 -171.995 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.474 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.0 tt -131.34 136.17 47.86 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 176.084 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.411 HG22 ' HE2' ' A' ' 4' ' ' LYS . 17.1 pt -126.72 159.1 36.76 Favored 'Isoleucine or valine' 0 C--O 1.239 0.509 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 170.306 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.619 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -145.28 168.91 19.32 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 176.534 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.427 HD21 ' OE1' ' A' ' 41' ' ' GLN . 4.3 tt -144.88 112.09 6.02 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 -176.915 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.522 ' HA ' ' O ' ' A' ' 64' ' ' SER . 49.9 m -101.25 109.65 21.54 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.068 0.947 . . . . 0.0 109.12 176.385 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.42 ' HB3' HG12 ' A' ' 65' ' ' VAL . . . -127.47 115.81 19.46 Favored 'General case' 0 N--CA 1.489 1.513 0 CA-C-O 120.839 0.352 . . . . 0.0 110.674 -178.459 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.559 ' HB2' HD13 ' A' ' 85' ' ' LEU . 44.0 t -123.43 142.93 40.06 Favored Pre-proline 0 N--CA 1.476 0.855 0 C-N-CA 123.926 0.89 . . . . 0.0 110.247 -176.501 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -72.58 -16.64 26.97 Favored 'Trans proline' 0 C--N 1.37 1.687 0 C-N-CA 122.938 2.425 . . . . 0.0 113.093 174.404 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 82.8 mtp -72.67 -54.91 7.72 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.393 0.677 . . . . 0.0 111.078 -179.172 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.413 ' HA2' ' H ' ' A' ' 43' ' ' ALA . . . 161.3 -177.76 37.5 Favored Glycine 0 C--N 1.342 0.875 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.845 -175.713 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 39.9 mt -75.19 -14.44 60.54 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -177.399 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.41 -49.73 76.42 Favored 'General case' 0 C--O 1.249 1.066 0 CA-C-O 121.337 0.589 . . . . 0.0 111.086 177.168 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.402 ' ND1' HD22 ' A' ' 85' ' ' LEU . 5.8 t-160 -64.98 -40.24 94.67 Favored 'General case' 0 C--O 1.248 1.004 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.224 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 32.7 p -67.3 -36.43 81.49 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.307 -178.329 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.8 m-30 -69.26 -32.84 72.31 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.127 0.571 . . . . 0.0 111.453 -178.338 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 62.5 mtm -67.93 -38.2 82.58 Favored 'General case' 0 N--CA 1.483 1.175 0 O-C-N 123.175 0.297 . . . . 0.0 110.81 175.76 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -69.7 -40.53 76.26 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.364 174.856 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.7 -37.1 81.81 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.899 0.88 . . . . 0.0 110.562 -178.517 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.477 ' O ' ' HG3' ' A' ' 27' ' ' GLU . 32.6 tt0 -62.52 -53.01 61.14 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.846 175.661 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.45 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -64.75 -47.5 77.98 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 115.587 -0.733 . . . . 0.0 112.183 -173.074 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 85.1 mt -64.43 -34.46 78.25 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.07 0.548 . . . . 0.0 111.431 178.543 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.505 ' O ' HG23 ' A' ' 30' ' ' VAL . 38.3 tt0 -61.92 -54.76 37.5 Favored 'General case' 0 C--N 1.349 0.578 0 O-C-N 123.686 0.616 . . . . 0.0 109.894 177.618 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.567 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 44.9 mt-10 -49.42 -52.12 30.78 Favored 'General case' 0 N--CA 1.48 1.048 0 O-C-N 124.632 1.207 . . . . 0.0 110.73 179.54 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.417 ' HB1' ' HA ' ' A' ' 93' ' ' ALA . . . -56.18 -52.05 65.81 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.807 1.243 . . . . 0.0 112.098 -179.664 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.38 -22.52 66.25 Favored 'General case' 0 CA--C 1.55 0.947 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 179.505 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 26' ' ' GLU . 55.8 t -76.25 -37.5 32.08 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.256 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 178.597 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.567 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 16.2 mm-40 -76.48 -19.89 57.55 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 114.725 -1.125 . . . . 0.0 110.475 178.802 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -78.44 -19.0 54.11 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.672 0.789 . . . . 0.0 111.198 172.705 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 97.01 1.24 59.75 Favored Glycine 0 C--N 1.349 1.263 0 N-CA-C 115.2 0.84 . . . . 0.0 115.2 165.799 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.63 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -108.24 173.58 6.26 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-N 117.85 0.825 . . . . 0.0 112.089 176.255 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.514 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 34.2 tt0 -71.07 145.91 49.6 Favored 'General case' 0 C--N 1.35 0.612 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.656 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.493 HG21 ' HA ' ' A' ' 26' ' ' GLU . 7.4 p -135.34 128.64 48.72 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 122.741 0.416 . . . . 0.0 111.165 -179.566 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.5 tptt -135.75 115.55 13.02 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 176.44 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.619 HG12 ' HB3' ' A' ' 7' ' ' ALA . 49.3 mt -117.09 113.42 42.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 N-CA-C 111.995 0.369 . . . . 0.0 111.995 -176.16 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -75.62 147.81 39.25 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.894 0.878 . . . . 0.0 109.221 171.177 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.443 HG22 ' HB2' ' A' ' 9' ' ' CYS . 13.6 p -134.57 123.93 24.65 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.156 0.983 . . . . 0.0 109.208 -176.852 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.469 ' HG2' HG23 ' A' ' 46' ' ' ILE . 23.7 mt-30 -125.62 136.5 53.33 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 -176.928 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -163.59 -160.42 11.58 Favored Glycine 0 N--CA 1.465 0.605 0 C-N-CA 121.851 -0.214 . . . . 0.0 112.677 -179.1 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.413 ' H ' ' HA2' ' A' ' 14' ' ' GLY . . . -60.91 -28.77 69.16 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.957 0.903 . . . . 0.0 111.787 177.235 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -86.27 2.35 47.54 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.021 0.928 . . . . 0.0 111.51 -178.759 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 94.22 -157.48 22.65 Favored Glycine 0 C--N 1.34 0.773 0 N-CA-C 112.134 -0.386 . . . . 0.0 112.134 -176.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.469 HG23 ' HG2' ' A' ' 41' ' ' GLN . 40.8 mt -106.44 144.86 14.94 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 C-N-CA 123.601 0.76 . . . . 0.0 110.306 -172.944 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -143.02 148.12 36.23 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.005 1.322 . . . . 0.0 108.822 -174.175 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 10.1 t30 58.86 40.96 22.14 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 124.362 1.065 . . . . 0.0 110.517 175.9 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 9.5 tpp180 -47.35 133.28 12.62 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.763 1.625 . . . . 0.0 113.069 -172.476 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 47.5 mt -83.35 126.75 33.03 Favored 'General case' 0 C--O 1.242 0.693 0 C-N-CA 123.879 0.872 . . . . 0.0 110.383 173.292 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.408 ' O ' HG13 ' A' ' 55' ' ' ILE . 37.0 p -88.79 164.5 15.21 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.664 178.323 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.74 -30.37 67.45 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.148 0.579 . . . . 0.0 110.963 175.628 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.405 ' O ' ' HG3' ' A' ' 57' ' ' GLU . 29.2 tt0 -66.91 -48.48 68.57 Favored 'General case' 0 C--N 1.355 0.819 0 C-N-CA 122.972 0.509 . . . . 0.0 110.57 175.36 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -50.84 -44.96 59.47 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 123.504 0.721 . . . . 0.0 111.355 177.75 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.408 HG13 ' O ' ' A' ' 51' ' ' THR . 26.4 mt -72.5 -35.68 51.99 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.051 0 CA-C-N 114.449 -1.25 . . . . 0.0 111.107 -177.152 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.45 -37.17 77.22 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.49 0.716 . . . . 0.0 111.172 179.41 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.405 ' HG3' ' O ' ' A' ' 53' ' ' GLN . 57.6 mt-10 -75.13 -33.46 61.57 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.746 0.818 . . . . 0.0 110.773 177.723 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -54.93 99.81 0.03 OUTLIER 'General case' 0 C--N 1.355 0.81 0 O-C-N 124.699 1.249 . . . . 0.0 112.315 -172.315 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 23.8 m -63.19 -32.9 74.4 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-N 114.531 -1.213 . . . . 0.0 109.241 168.602 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.481 HG23 HG21 ' A' ' 99' ' ' ILE . 81.5 mt -133.71 139.04 49.6 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 C-N-CA 124.367 1.067 . . . . 0.0 109.827 -179.265 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.6 mt -131.39 130.55 62.94 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 173.847 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.3 mp -116.25 126.09 73.58 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 172.89 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 14.8 m170 -99.98 86.09 3.19 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 167.271 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.522 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 20.0 p -80.41 81.87 6.57 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 114.633 -1.167 . . . . 0.0 108.94 174.363 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.42 HG12 ' HB3' ' A' ' 10' ' ' ALA . 29.8 m -129.87 165.05 30.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.225 -170.377 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -121.98 -14.83 7.95 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.445 1.098 . . . . 0.0 109.318 170.567 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 9.4 m -127.97 177.05 6.45 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 125.013 1.325 . . . . 0.0 109.516 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 37.2 m -75.9 118.47 71.34 Favored Pre-proline 0 CA--C 1.545 0.75 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 173.353 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.54 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 48.4 Cg_endo -65.97 146.81 83.63 Favored 'Trans proline' 0 C--N 1.373 1.82 0 C-N-CA 122.141 1.894 . . . . 0.0 111.18 175.239 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -65.33 -41.06 94.36 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.341 0.657 . . . . 0.0 110.624 -177.264 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -88.39 15.2 8.14 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 115.349 -0.841 . . . . 0.0 112.146 -175.536 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.54 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 6.0 p30 -55.69 -28.62 56.56 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 123.859 0.864 . . . . 0.0 112.041 -177.144 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.563 ' HG3' ' HG3' ' A' ' 74' ' ' ARG . 8.9 pt-20 -56.53 -37.22 70.18 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 124.694 1.198 . . . . 0.0 112.343 175.907 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.563 ' HG3' ' HG3' ' A' ' 73' ' ' GLU . 81.4 mtt85 -80.11 -17.05 53.61 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.815 1.246 . . . . 0.0 112.079 -176.713 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.517 ' HB3' HG21 ' A' ' 80' ' ' VAL . 66.6 m-85 -107.4 -2.68 20.31 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.574 0.749 . . . . 0.0 110.999 178.041 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -55.06 -49.04 72.62 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.494 1.118 . . . . 0.0 112.663 -172.528 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 81.0 p -91.6 0.51 57.49 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.127 0.571 . . . . 0.0 112.379 -176.536 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -104.62 161.52 14.06 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.276 0.63 . . . . 0.0 111.202 -170.347 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 -72.67 93.57 1.65 Allowed 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.355 0.662 . . . . 0.0 110.929 -175.74 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.517 HG21 ' HB3' ' A' ' 75' ' ' PHE . 44.2 t -116.85 133.01 64.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 123.206 0.602 . . . . 0.0 110.86 -175.077 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 66.1 m-85 -105.84 91.3 3.69 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.776 1.23 . . . . 0.0 108.553 177.125 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -78.88 110.12 13.78 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.611 0.764 . . . . 0.0 110.87 -175.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.445 HG13 ' HA ' ' A' ' 64' ' ' SER . 42.1 pt -117.31 -173.78 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 124.471 1.109 . . . . 0.0 109.561 176.043 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 40.4 p -86.8 149.73 24.64 Favored 'General case' 0 C--O 1.239 0.539 0 CA-C-O 121.071 0.462 . . . . 0.0 110.376 170.449 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.559 HD13 ' HB2' ' A' ' 11' ' ' CYS . 7.2 tt -64.52 -30.61 71.64 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.779 177.149 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -64.47 -43.79 93.1 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.879 176.289 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -63.74 -28.84 70.16 Favored 'General case' 0 N--CA 1.479 1.015 0 O-C-N 123.516 0.51 . . . . 0.0 110.629 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.1 -32.89 74.82 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.739 0.816 . . . . 0.0 112.292 177.866 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 64.6 mt -79.96 -42.69 22.28 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.835 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.414 -177.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -85.85 -47.34 9.77 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -175.086 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -106.15 25.45 10.98 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 124.081 0.952 . . . . 0.0 110.736 -170.199 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.45 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -41.92 -60.79 1.29 Allowed 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 124.253 1.021 . . . . 0.0 113.372 -175.144 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.417 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . . . -65.0 -34.1 77.64 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.602 -178.97 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.69 -45.8 93.6 Favored Glycine 0 C--N 1.346 1.103 0 O-C-N 124.183 0.927 . . . . 0.0 112.253 -178.62 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 22.6 mt -60.1 -57.09 13.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 124.445 1.098 . . . . 0.0 110.266 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.9 mp -56.42 -50.05 74.24 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 O-C-N 123.945 0.778 . . . . 0.0 110.846 -178.39 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.87 -27.98 67.14 Favored 'General case' 0 N--CA 1.485 1.298 0 O-C-N 123.389 0.431 . . . . 0.0 111.304 -176.245 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.419 ' O ' ' HG3' ' A' ' 102' ' ' MET . 48.4 mm-40 -65.65 -40.78 92.82 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.316 0.646 . . . . 0.0 109.896 175.365 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.481 HG21 HG23 ' A' ' 60' ' ' ILE . 32.7 mt -75.83 -34.05 27.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 N-CA-C 109.152 -0.685 . . . . 0.0 109.152 -176.815 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -60.54 -50.34 73.92 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 114.419 -1.264 . . . . 0.0 111.147 174.249 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -72.19 -33.3 67.55 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 122.751 0.42 . . . . 0.0 110.969 -176.47 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.419 ' HG3' ' O ' ' A' ' 98' ' ' GLU . 69.3 mtm -63.63 -58.2 7.69 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 122.751 0.42 . . . . 0.0 110.148 177.689 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 63.4 mt -62.38 -41.29 91.17 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.929 0 O-C-N 123.893 0.746 . . . . 0.0 110.587 -179.385 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.22 -32.52 74.24 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 122.541 0.337 . . . . 0.0 111.562 179.703 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 38.5 t -73.52 -37.43 65.65 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-O 120.887 0.375 . . . . 0.0 110.717 -176.561 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -85.16 -25.77 27.23 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.808 -177.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -85.6 -40.17 16.53 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 122.811 0.444 . . . . 0.0 111.516 178.799 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 81.8 mm-40 . . . . . 0 CA--C 1.55 0.978 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 174.943 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.6 pttt . . . . . 0 N--CA 1.484 1.251 0 CA-C-O 121.078 0.466 . . . . 0.0 110.782 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.534 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 3.8 tmtp? -144.03 143.67 31.29 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -173.749 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.483 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.0 tt -134.56 142.18 46.9 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 177.851 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.416 HD13 ' HA ' ' A' ' 55' ' ' ILE . 21.6 pt -133.39 168.43 24.13 Favored 'Isoleucine or valine' 0 C--O 1.243 0.742 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 170.773 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.622 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -152.3 169.99 21.15 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.342 175.384 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.4 tt -140.24 112.19 7.57 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 106.811 -1.551 . . . . 0.0 106.811 178.096 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.529 ' HB2' HG22 ' A' ' 40' ' ' THR . 68.9 m -102.05 109.35 21.04 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 177.263 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.447 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -128.71 113.79 15.81 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 122.759 0.424 . . . . 0.0 111.273 -176.915 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.74 ' SG ' HD13 ' A' ' 85' ' ' LEU . 2.2 m -130.98 146.61 62.9 Favored Pre-proline 0 N--CA 1.474 0.727 0 C-N-CA 123.481 0.712 . . . . 0.0 110.111 174.038 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -88.39 15.76 2.01 Favored 'Trans proline' 0 C--N 1.37 1.694 0 C-N-CA 123.331 2.688 . . . . 0.0 111.427 175.246 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 16.9 tpt -138.27 76.13 1.56 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.455 1.102 . . . . 0.0 109.16 178.426 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.77 132.31 4.25 Favored Glycine 0 C--N 1.34 0.802 0 CA-C-N 115.123 -0.944 . . . . 0.0 114.186 167.25 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 22.4 mt -66.39 -22.45 66.24 Favored 'General case' 0 C--O 1.216 -0.707 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 163.608 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.21 -40.09 73.48 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.316 0.646 . . . . 0.0 110.921 171.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.496 ' ND1' HD22 ' A' ' 85' ' ' LEU . 4.5 t-80 -68.99 -45.13 71.39 Favored 'General case' 0 C--O 1.245 0.865 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 178.39 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 35.5 p -66.19 -30.0 70.38 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.798 -178.511 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -80.12 -27.21 39.18 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.181 0.593 . . . . 0.0 111.418 -178.175 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 66.6 mtm -66.7 -38.72 87.32 Favored 'General case' 0 N--CA 1.482 1.142 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 171.098 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -72.55 -40.15 66.92 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.518 176.917 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.61 -51.58 58.54 Favored 'General case' 0 C--O 1.217 -0.635 0 C-N-CA 123.851 0.86 . . . . 0.0 109.979 -177.333 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.421 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 6.8 tp-100 -62.81 -38.89 92.49 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 123.766 0.666 . . . . 0.0 110.52 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.584 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -62.42 -53.43 54.94 Favored 'General case' 0 CA--C 1.551 1.013 0 O-C-N 123.642 0.589 . . . . 0.0 111.419 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 93.4 mt -66.47 -29.86 70.07 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 123.491 0.716 . . . . 0.0 111.295 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.557 ' HA ' HG21 ' A' ' 36' ' ' VAL . 38.4 tt0 -64.84 -54.73 26.51 Favored 'General case' 0 C--N 1.346 0.449 0 C-N-CA 123.581 0.753 . . . . 0.0 109.807 -179.559 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.492 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 12.7 mm-40 -55.21 -49.09 72.82 Favored 'General case' 0 N--CA 1.479 1.025 0 O-C-N 124.505 1.128 . . . . 0.0 110.355 178.64 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.78 -46.68 81.35 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.656 1.183 . . . . 0.0 111.795 -178.102 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.78 -28.96 68.05 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 115.147 -0.933 . . . . 0.0 112.681 177.073 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 26' ' ' GLU . 56.1 t -72.86 -37.35 54.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 179.148 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 9.1 mm-40 -72.21 -26.98 62.26 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.641 178.616 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.45 -32.85 72.05 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.294 0.638 . . . . 0.0 110.902 172.801 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 104.33 18.8 12.42 Favored Glycine 0 C--N 1.346 1.121 0 N-CA-C 114.606 0.602 . . . . 0.0 114.606 169.359 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -122.19 -179.85 4.3 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.174 0.59 . . . . 0.0 111.334 175.51 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.534 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 12.2 tp10 -73.31 152.53 40.91 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.093 178.448 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.557 HG21 ' HA ' ' A' ' 26' ' ' GLU . 7.3 p -142.45 128.41 17.81 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 C-N-CA 123.296 0.638 . . . . 0.0 110.796 178.897 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.8 tptt -136.87 114.82 11.4 Favored 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 176.994 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.622 HG12 ' HB3' ' A' ' 7' ' ' ALA . 50.6 mt -119.17 116.39 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 122.746 0.418 . . . . 0.0 111.786 -173.992 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -87.08 119.81 27.69 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.894 0.877 . . . . 0.0 110.024 175.467 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.529 HG22 ' HB2' ' A' ' 9' ' ' CYS . 26.7 p -99.71 109.21 21.68 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.679 0.792 . . . . 0.0 111.144 178.606 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.447 ' O ' ' HA ' ' A' ' 10' ' ' ALA . 46.4 mt-30 -96.93 139.4 33.02 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.425 0.69 . . . . 0.0 110.095 173.908 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -164.89 175.73 40.78 Favored Glycine 0 C--N 1.341 0.806 0 N-CA-C 111.882 -0.487 . . . . 0.0 111.882 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.85 -12.33 60.35 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 122.625 0.37 . . . . 0.0 111.504 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -77.71 -28.22 50.85 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.27 0.628 . . . . 0.0 110.147 171.11 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 143.26 -169.79 25.68 Favored Glycine 0 C--N 1.346 1.137 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.391 -177.62 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 64.5 mt -113.29 145.5 19.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 123.123 0.569 . . . . 0.0 109.465 176.34 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -142.86 151.31 40.94 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.349 0.659 . . . . 0.0 110.197 -176.305 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ASN . . . . . 0.432 ' HB3' ' O ' ' A' ' 38' ' ' ILE . 10.4 t30 58.74 45.88 15.05 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 125.017 1.327 . . . . 0.0 110.075 178.173 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.6 tpp180 -52.21 120.77 5.83 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.111 1.364 . . . . 0.0 112.16 -175.002 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 37.5 mt -64.11 146.12 54.75 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.276 1.03 . . . . 0.0 110.979 172.619 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 67.2 p -104.29 167.3 9.84 Favored 'General case' 0 C--O 1.244 0.77 0 C-N-CA 123.304 0.642 . . . . 0.0 110.145 175.631 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.99 -35.27 74.66 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.049 0.54 . . . . 0.0 110.321 174.67 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 -60.98 -51.84 67.54 Favored 'General case' 0 CA--C 1.546 0.81 0 CA-C-N 114.393 -1.276 . . . . 0.0 110.53 174.792 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 31.3 m-20 -53.67 -46.28 70.59 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 123.633 0.773 . . . . 0.0 112.261 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.556 HG22 ' HG3' ' A' ' 78' ' ' ARG . 23.0 mt -73.2 -31.01 32.81 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.078 0 O-C-N 123.834 0.708 . . . . 0.0 110.974 -175.708 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.64 -37.57 70.84 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.229 0.612 . . . . 0.0 111.103 177.247 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -77.33 -26.42 52.12 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.032 0.933 . . . . 0.0 111.118 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -56.93 99.65 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.063 0.945 . . . . 0.0 112.431 -175.002 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 27.4 m -63.56 -37.9 89.09 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 115.156 -0.929 . . . . 0.0 108.901 168.895 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.533 HG23 HG21 ' A' ' 99' ' ' ILE . 80.5 mt -128.45 140.71 48.48 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.767 179.369 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.447 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 33.2 mt -131.3 137.23 56.02 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 173.006 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.2 mp -123.29 112.84 35.2 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 173.048 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 9.9 m170 -89.91 84.03 6.19 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-O 121.815 0.817 . . . . 0.0 108.972 171.646 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.454 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 23.4 p -83.27 84.58 7.44 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 114.302 -1.317 . . . . 0.0 108.926 177.907 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.418 HG12 ' HB3' ' A' ' 10' ' ' ALA . 34.6 m -127.88 163.61 31.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 121.535 0.684 . . . . 0.0 111.988 -170.908 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -113.67 -28.78 7.34 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.761 1.224 . . . . 0.0 108.98 174.455 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 12.9 m -124.18 162.67 25.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 125.18 1.392 . . . . 0.0 108.591 176.73 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 55.4 m -68.67 116.52 41.56 Favored Pre-proline 0 CA--C 1.549 0.912 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 174.329 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.536 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 31.1 Cg_endo -64.35 150.43 88.29 Favored 'Trans proline' 0 C--N 1.375 1.97 0 C-N-CA 122.466 2.111 . . . . 0.0 112.081 178.346 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -67.45 -30.95 70.81 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.589 0.756 . . . . 0.0 110.261 178.691 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.508 ' HB3' ' HD3' ' A' ' 74' ' ' ARG . 3.8 m-20 -94.13 12.73 25.51 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 114.42 -1.264 . . . . 0.0 112.162 -174.907 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.536 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 59.5 t30 -60.22 -35.29 75.1 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.097 0.959 . . . . 0.0 112.471 -174.695 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.96 -17.86 62.04 Favored 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -175.651 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.508 ' HD3' ' HB3' ' A' ' 71' ' ' ASP . 58.3 mtp180 -64.41 -25.96 68.25 Favored 'General case' 0 N--CA 1.485 1.304 0 CA-C-O 121.427 0.632 . . . . 0.0 111.631 174.525 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -100.69 17.85 20.84 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.652 1.181 . . . . 0.0 110.556 -175.829 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -50.18 -52.09 38.39 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 125.356 1.462 . . . . 0.0 113.105 -174.223 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 21.6 t -99.41 5.62 46.27 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.409 0.683 . . . . 0.0 112.082 -171.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.556 ' HG3' HG22 ' A' ' 55' ' ' ILE . 34.7 mmt180 -106.18 145.78 31.09 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.473 0.709 . . . . 0.0 111.063 -173.34 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -68.65 99.58 1.02 Allowed 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.718 0.807 . . . . 0.0 110.923 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.447 ' HA ' ' HB ' ' A' ' 61' ' ' ILE . 57.5 t -109.69 128.25 65.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 123.515 0.726 . . . . 0.0 110.322 -178.75 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 73.3 m-85 -98.25 92.51 5.75 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 124.423 1.089 . . . . 0.0 108.16 174.363 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -85.76 129.86 34.71 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.473 -175.687 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.436 HG13 ' HA ' ' A' ' 64' ' ' SER . 41.7 pt -137.45 -172.78 0.78 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.844 0 C-N-CA 124.926 1.29 . . . . 0.0 108.86 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 26.2 p -84.98 149.98 25.23 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.061 0.458 . . . . 0.0 109.969 167.531 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.74 HD13 ' SG ' ' A' ' 11' ' ' CYS . 8.2 tt -65.42 -29.04 69.68 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.578 177.639 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.488 ' HG2' ' HE3' ' A' ' 90' ' ' LYS . 35.7 tt0 -59.99 -46.06 90.71 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.638 173.703 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -62.41 -32.67 73.54 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.327 0.651 . . . . 0.0 110.633 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.37 -32.64 74.12 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.584 0.754 . . . . 0.0 112.365 176.679 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 94.3 mt -78.21 -50.72 18.93 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 123.491 0.716 . . . . 0.0 110.713 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.488 ' HE3' ' HG2' ' A' ' 86' ' ' GLN . 18.6 ptpt -82.56 -33.36 28.14 Favored 'General case' 0 N--CA 1.484 1.26 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -172.126 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -120.5 22.99 11.06 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.896 0.879 . . . . 0.0 110.442 -168.317 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.584 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -42.33 -60.28 1.54 Allowed 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 124.353 1.061 . . . . 0.0 113.428 -174.575 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.42 -36.96 85.45 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.072 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -62.13 -47.55 89.06 Favored Glycine 0 C--N 1.355 1.618 0 O-C-N 124.479 1.112 . . . . 0.0 112.078 -177.41 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.402 ' O ' HG13 ' A' ' 99' ' ' ILE . 23.2 mt -55.79 -58.66 4.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 124.598 1.159 . . . . 0.0 110.333 177.809 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.8 mp -55.25 -51.3 57.14 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 O-C-N 124.246 0.966 . . . . 0.0 111.043 -177.227 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.74 -29.53 68.78 Favored 'General case' 0 N--CA 1.486 1.357 0 O-C-N 123.417 0.448 . . . . 0.0 112.163 -175.357 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 59.7 mm-40 -71.25 -32.41 68.72 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.153 0.581 . . . . 0.0 110.381 177.785 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.533 HG21 HG23 ' A' ' 60' ' ' ILE . 48.0 mt -78.22 -36.23 20.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.33 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -57.86 -48.48 79.66 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 114.446 -1.252 . . . . 0.0 111.275 177.47 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -74.22 -34.93 63.83 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 123.92 0.762 . . . . 0.0 111.44 -178.173 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 64.5 mtm -64.58 -50.82 65.74 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 122.679 0.392 . . . . 0.0 110.615 178.276 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 39.2 mt -66.41 -42.45 90.47 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.383 178.157 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.24 -28.23 69.21 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 117.683 0.22 . . . . 0.0 111.049 178.648 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 36.8 t -75.03 -41.52 59.1 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 122.044 -0.41 . . . . 0.0 110.364 -178.136 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -78.56 -34.77 46.77 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 122.84 0.456 . . . . 0.0 111.469 -177.828 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 14.3 mm-40 -82.67 -43.37 16.99 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.072 0.549 . . . . 0.0 111.81 -174.539 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 . . . . . 0 CA--C 1.554 1.112 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 177.546 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.524 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 4.7 pttt . . . . . 0 N--CA 1.49 1.543 0 CA-C-O 120.796 0.331 . . . . 0.0 110.669 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.529 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 5.0 tmtp? -143.71 144.2 31.75 Favored 'General case' 0 N--CA 1.481 1.091 0 CA-C-O 121.454 0.645 . . . . 0.0 110.66 -175.099 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.499 ' N ' ' HD3' ' A' ' 4' ' ' LYS . 8.8 tt -130.8 135.67 47.97 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 125.246 1.418 . . . . 0.0 107.902 175.04 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.439 HG13 HG23 ' A' ' 61' ' ' ILE . 20.3 pt -126.1 161.94 30.7 Favored 'Isoleucine or valine' 0 C--O 1.242 0.693 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 171.656 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.631 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -148.94 166.61 28.09 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 122.96 0.504 . . . . 0.0 110.015 175.674 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.467 HD21 ' HG3' ' A' ' 41' ' ' GLN . 4.1 tt -136.58 123.38 21.24 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 178.268 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.56 ' HA ' ' O ' ' A' ' 64' ' ' SER . 78.0 m -112.51 112.63 24.31 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 123.61 0.764 . . . . 0.0 109.244 177.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.428 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -126.27 120.74 30.74 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 122.855 0.462 . . . . 0.0 111.547 -176.51 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.801 ' SG ' HD13 ' A' ' 85' ' ' LEU . 1.4 m -127.31 144.64 51.45 Favored Pre-proline 0 N--CA 1.485 1.323 0 C-N-CA 123.957 0.903 . . . . 0.0 111.45 -178.924 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -74.53 -23.61 14.7 Favored 'Trans proline' 0 C--N 1.379 2.176 0 C-N-CA 122.869 2.379 . . . . 0.0 113.161 177.773 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 76.9 mtm -76.11 -41.28 50.72 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 173.879 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 138.08 -156.03 23.65 Favored Glycine 0 C--N 1.347 1.173 0 N-CA-C 114.675 0.63 . . . . 0.0 114.675 172.304 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.3 mt -75.18 -18.48 60.16 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 114.783 1.401 . . . . 0.0 114.783 -164.603 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.98 -48.65 80.82 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-O 121.466 0.65 . . . . 0.0 110.761 178.594 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -66.18 -39.25 89.57 Favored 'General case' 0 C--O 1.246 0.868 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.264 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.407 HG21 ' O ' ' A' ' 41' ' ' GLN . 40.8 p -67.89 -36.34 80.07 Favored 'General case' 0 C--N 1.349 0.581 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.444 -175.944 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -72.49 -25.24 61.34 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 123.389 0.43 . . . . 0.0 111.616 178.329 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 56.3 mtm -63.08 -45.44 92.11 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-O 120.87 0.367 . . . . 0.0 110.055 170.646 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -69.72 -38.07 76.78 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.423 177.536 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.94 -43.09 84.11 Favored 'General case' 0 C--O 1.216 -0.682 0 C-N-CA 123.599 0.76 . . . . 0.0 110.735 -177.205 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.411 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 8.4 tp-100 -66.06 -42.2 89.79 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.064 0.546 . . . . 0.0 110.23 -179.558 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.03 -49.61 67.11 Favored 'General case' 0 CA--C 1.556 1.179 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.988 -178.543 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.431 HD11 ' OG ' ' A' ' 64' ' ' SER . 86.6 mt -66.52 -32.6 74.05 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.184 0.594 . . . . 0.0 111.789 178.595 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.519 ' HA ' HG21 ' A' ' 36' ' ' VAL . 46.0 tt0 -59.89 -53.54 56.72 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 123.907 0.754 . . . . 0.0 109.686 179.069 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 23' ' ' GLN . 30.4 mm-40 -54.07 -52.4 61.06 Favored 'General case' 0 N--CA 1.477 0.888 0 O-C-N 124.719 1.262 . . . . 0.0 110.834 178.707 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.15 -45.84 79.5 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.515 1.126 . . . . 0.0 112.109 -177.247 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.21 -29.71 67.73 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 115.364 -0.834 . . . . 0.0 113.063 177.459 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.48 HG23 ' O ' ' A' ' 26' ' ' GLU . 52.2 t -72.63 -38.55 59.16 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.785 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -71.79 -23.35 61.56 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 114.548 -1.205 . . . . 0.0 111.061 178.281 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.49 -22.31 59.14 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.411 0.684 . . . . 0.0 111.657 176.058 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 105.06 0.34 41.49 Favored Glycine 0 C--N 1.352 1.423 0 CA-C-O 119.555 -0.581 . . . . 0.0 114.512 171.08 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.524 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.1 OUTLIER -113.38 -179.87 3.76 Favored 'General case' 0 N--CA 1.485 1.319 0 CA-C-N 117.642 0.721 . . . . 0.0 111.901 177.427 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.529 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 38.2 tt0 -79.06 152.76 30.68 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.053 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.519 HG21 ' HA ' ' A' ' 26' ' ' GLU . 11.0 p -132.18 141.68 44.74 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 123.647 0.779 . . . . 0.0 110.548 177.904 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 49.1 tptt -147.22 119.52 8.37 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 172.012 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.631 HG12 ' HB3' ' A' ' 7' ' ' ALA . 47.9 mt -120.74 112.45 36.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 C-N-CA 122.938 0.495 . . . . 0.0 111.954 -175.43 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 46.5 tt0 -80.98 117.13 21.33 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.467 0.707 . . . . 0.0 109.423 174.52 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.409 HG22 ' HB2' ' A' ' 9' ' ' CYS . 21.7 p -98.87 115.74 29.53 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.814 0.845 . . . . 0.0 110.177 178.794 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.467 ' HG3' HD21 ' A' ' 8' ' ' LEU . 11.0 mt-30 -108.64 151.43 26.15 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.414 0.686 . . . . 0.0 109.917 175.767 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -172.81 -177.14 41.93 Favored Glycine 0 C--N 1.337 0.596 0 CA-C-N 116.73 -0.214 . . . . 0.0 112.872 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.69 -19.23 65.14 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.637 0.775 . . . . 0.0 112.527 -179.337 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -79.61 -31.74 41.71 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.623 0.769 . . . . 0.0 110.775 174.533 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 143.18 -158.71 27.31 Favored Glycine 0 C--N 1.339 0.738 0 N-CA-C 111.184 -0.766 . . . . 0.0 111.184 -176.652 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.43 HG23 ' HG2' ' A' ' 41' ' ' GLN . 30.0 mt -117.62 154.99 19.47 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 123.031 0.532 . . . . 0.0 109.963 179.541 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -149.8 152.62 35.49 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.198 0.999 . . . . 0.0 109.937 -179.186 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 18.8 t30 60.99 42.02 13.26 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 124.72 1.208 . . . . 0.0 109.89 176.359 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 10.1 tpt180 -54.68 121.59 8.83 Favored 'General case' 0 C--N 1.356 0.853 0 C-N-CA 125.098 1.359 . . . . 0.0 112.157 -169.291 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 44.4 mt -67.31 144.27 55.96 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.805 0.842 . . . . 0.0 110.118 172.195 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.431 ' O ' HG13 ' A' ' 55' ' ' ILE . 31.6 p -111.53 172.46 6.88 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.822 0.849 . . . . 0.0 109.392 177.053 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.44 -30.07 68.23 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 122.862 0.465 . . . . 0.0 111.381 176.181 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -64.33 -47.54 79.01 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.827 0.851 . . . . 0.0 110.814 176.334 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -59.74 -45.04 93.44 Favored 'General case' 0 N--CA 1.48 1.041 0 O-C-N 123.858 0.724 . . . . 0.0 111.028 179.011 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.561 HG22 ' HG3' ' A' ' 78' ' ' ARG . 26.7 mt -73.23 -28.87 26.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 C-N-CA 123.671 0.788 . . . . 0.0 111.017 -176.125 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -74.74 -49.04 22.47 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.249 0.62 . . . . 0.0 111.13 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -81.16 -9.34 59.82 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.407 0.683 . . . . 0.0 111.753 -176.655 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.59 101.15 0.17 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.521 0.729 . . . . 0.0 111.299 179.17 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 24.0 m -61.53 -38.03 85.93 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 115.021 -0.99 . . . . 0.0 109.102 168.589 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.516 HG23 HG21 ' A' ' 99' ' ' ILE . 73.1 mt -130.32 140.4 48.95 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.767 0 CA-C-N 114.819 -1.082 . . . . 0.0 110.174 -179.316 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.439 HG23 HG13 ' A' ' 6' ' ' ILE . 20.5 mt -133.01 131.56 58.88 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 C-N-CA 123.685 0.794 . . . . 0.0 109.098 172.735 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.0 mp -119.84 134.77 62.3 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 173.861 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 7.5 m170 -109.35 85.43 2.1 Favored 'General case' 0 N--CA 1.487 1.419 0 CA-C-N 118.931 0.787 . . . . 0.0 109.339 168.45 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.56 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 19.4 m -77.78 82.11 4.18 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 114.288 -1.324 . . . . 0.0 109.595 175.011 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.404 ' O ' ' HA ' ' A' ' 84' ' ' THR . 21.6 m -127.26 152.67 35.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 121.47 0.652 . . . . 0.0 111.313 -172.426 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -103.13 -29.02 11.59 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.315 1.046 . . . . 0.0 108.936 174.77 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 16.4 m -133.9 163.35 37.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 125.479 1.512 . . . . 0.0 108.447 177.713 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 26.3 m -64.72 117.59 39.78 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 122.942 0.497 . . . . 0.0 110.618 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.437 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 37.9 Cg_endo -67.6 148.81 78.94 Favored 'Trans proline' 0 C--N 1.374 1.874 0 C-N-CA 122.149 1.9 . . . . 0.0 111.079 175.037 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -63.51 -33.12 74.88 Favored 'General case' 0 N--CA 1.483 1.223 0 CA-C-O 121.242 0.544 . . . . 0.0 110.572 -179.235 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.504 ' HB3' ' HD3' ' A' ' 74' ' ' ARG . 1.3 m-20 -94.9 16.23 16.58 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.322 1.049 . . . . 0.0 112.357 -174.921 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.437 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 5.1 p30 -60.37 -36.08 77.2 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.256 0.622 . . . . 0.0 112.403 -174.822 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.64 -21.15 63.57 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.761 0.824 . . . . 0.0 112.945 -174.12 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.504 ' HD3' ' HB3' ' A' ' 71' ' ' ASP . 77.1 mtp180 -62.66 -42.89 99.86 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-O 122.215 1.007 . . . . 0.0 110.286 174.993 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -89.91 -17.97 27.01 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 113.72 -1.582 . . . . 0.0 111.04 -172.164 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -63.5 -27.38 69.23 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.311 0.645 . . . . 0.0 110.488 178.538 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 45.1 t -62.89 -34.73 78.04 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 124.071 0.948 . . . . 0.0 111.554 172.736 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.561 ' HG3' HG22 ' A' ' 55' ' ' ILE . 20.7 mmt180 -95.39 -175.98 3.64 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.329 1.052 . . . . 0.0 111.62 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -94.44 120.29 34.45 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.576 0.751 . . . . 0.0 109.826 173.884 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 62.1 t -130.42 148.49 33.13 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.163 0 C-N-CA 124.213 1.005 . . . . 0.0 110.296 -174.799 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -107.68 90.89 3.44 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.02 0.928 . . . . 0.0 109.342 173.263 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -75.68 111.52 11.1 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.42 0.688 . . . . 0.0 110.362 178.28 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.462 HG13 ' HA ' ' A' ' 64' ' ' SER . 44.2 pt -119.36 -175.53 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 124.489 1.116 . . . . 0.0 109.16 175.15 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.404 ' HA ' ' O ' ' A' ' 65' ' ' VAL . 22.0 p -83.2 148.14 27.62 Favored 'General case' 0 C--O 1.238 0.455 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 168.86 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.801 HD13 ' SG ' ' A' ' 11' ' ' CYS . 5.8 tt -62.41 -26.9 68.73 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.665 0.786 . . . . 0.0 111.482 178.82 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.522 ' HG2' ' HE3' ' A' ' 90' ' ' LYS . 33.7 tt0 -67.04 -40.62 87.2 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 123.795 0.838 . . . . 0.0 111.171 175.953 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.432 ' HB3' HD12 ' A' ' 83' ' ' ILE . 22.8 t70 -61.52 -29.84 70.25 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.456 0.702 . . . . 0.0 111.067 178.495 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -70.31 -18.52 63.1 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.715 0.806 . . . . 0.0 112.998 178.752 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 66.2 mt -95.91 -40.58 10.94 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.826 0 C-N-CA 123.518 0.727 . . . . 0.0 110.392 -179.258 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.522 ' HE3' ' HG2' ' A' ' 86' ' ' GLN . 18.1 ptpt -88.67 -31.05 18.7 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.196 0.598 . . . . 0.0 112.361 -175.044 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -126.58 26.78 6.23 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.374 0.669 . . . . 0.0 110.185 -170.838 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -49.15 -61.12 2.25 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.817 0.847 . . . . 0.0 113.026 -174.238 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.24 -39.74 83.73 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.872 177.852 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -55.97 -47.38 80.29 Favored Glycine 0 C--N 1.353 1.517 0 O-C-N 124.886 1.366 . . . . 0.0 112.991 179.296 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 26.0 mt -58.32 -56.9 13.31 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 124.052 0.941 . . . . 0.0 110.053 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.8 mp -57.25 -50.62 76.12 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.185 0 O-C-N 124.034 0.834 . . . . 0.0 111.42 -176.095 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.65 -29.73 70.34 Favored 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -176.751 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -66.71 -38.44 86.74 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.487 0.715 . . . . 0.0 110.236 177.634 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.516 HG21 HG23 ' A' ' 60' ' ' ILE . 22.2 mt -77.92 -34.31 19.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 -177.669 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -61.14 -46.17 91.66 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.553 1.141 . . . . 0.0 111.821 177.158 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -74.53 -32.84 62.61 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 123.158 0.286 . . . . 0.0 111.465 -178.042 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 65.1 mtm -65.74 -45.57 82.11 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 122.638 0.375 . . . . 0.0 110.62 175.695 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 48.0 mt -65.93 -38.83 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 O-C-N 123.46 0.475 . . . . 0.0 109.938 176.424 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.36 -21.78 66.24 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.147 0.579 . . . . 0.0 111.371 177.416 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 44.6 t -88.58 -38.15 15.11 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 122.944 0.497 . . . . 0.0 111.199 -178.24 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -77.24 -25.48 51.61 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 122.396 0.278 . . . . 0.0 110.885 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 17.0 mm-40 -85.04 -50.24 7.62 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.02 0.528 . . . . 0.0 110.054 174.444 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 24.4 mm-40 . . . . . 0 CA--C 1.55 0.945 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 177.664 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 47.9 pttt . . . . . 0 N--CA 1.473 0.676 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.6 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.3 tmtp? -141.8 140.84 33.12 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 -172.873 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.467 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 10.1 tt -129.36 134.9 48.11 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 177.528 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.431 HD12 HD13 ' A' ' 50' ' ' LEU . 17.7 pt -128.01 165.17 27.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 173.744 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.618 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -152.48 169.08 23.48 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 122.775 0.43 . . . . 0.0 110.078 178.18 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.5 tt -139.73 114.28 9.25 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 -179.574 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.494 ' HA ' ' O ' ' A' ' 64' ' ' SER . 85.6 m -106.39 111.09 23.52 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 177.954 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.513 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -127.38 122.48 33.76 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 122.785 0.434 . . . . 0.0 111.235 -176.756 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.712 ' SG ' HD13 ' A' ' 85' ' ' LEU . 1.2 m -136.55 139.65 30.01 Favored Pre-proline 0 N--CA 1.474 0.74 0 C-N-CA 123.728 0.811 . . . . 0.0 109.878 176.398 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -75.91 -10.01 19.66 Favored 'Trans proline' 0 C--N 1.373 1.867 0 C-N-CA 122.856 2.371 . . . . 0.0 111.504 178.552 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 44.6 mtt -69.3 -56.97 5.98 Favored 'General case' 0 C--N 1.35 0.624 0 C-N-CA 124.93 1.292 . . . . 0.0 109.718 177.55 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 163.0 175.1 33.68 Favored Glycine 0 C--N 1.349 1.266 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.89 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 28.9 mt -69.89 -22.52 63.22 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.388 0.675 . . . . 0.0 112.759 -179.394 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -55.66 -44.65 77.45 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-O 120.956 0.408 . . . . 0.0 111.025 175.633 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -71.33 -36.5 71.57 Favored 'General case' 0 C--O 1.247 0.934 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.81 -178.537 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.414 ' HA ' HD11 ' A' ' 85' ' ' LEU . 44.8 p -70.97 -31.22 67.72 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.822 -178.396 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 -74.4 -28.13 60.95 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.298 0.639 . . . . 0.0 111.013 178.241 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 71.0 mtp -58.92 -51.26 70.81 Favored 'General case' 0 N--CA 1.483 1.189 0 CA-C-O 121.214 0.53 . . . . 0.0 109.838 169.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.01 -40.08 94.37 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.771 177.796 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.93 -37.11 78.7 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.876 0.87 . . . . 0.0 111.461 -176.413 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.424 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 8.4 tp-100 -64.5 -48.13 76.34 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.264 0.626 . . . . 0.0 109.715 178.273 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.465 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -63.11 -51.36 66.84 Favored 'General case' 0 CA--C 1.554 1.101 0 CA-C-N 115.221 -0.9 . . . . 0.0 111.934 -176.585 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 85.4 mt -63.91 -34.57 78.27 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.415 0.686 . . . . 0.0 112.048 -179.309 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.461 ' O ' HG23 ' A' ' 30' ' ' VAL . 39.0 tt0 -60.66 -56.72 17.9 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 123.979 0.799 . . . . 0.0 110.324 -179.022 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.482 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 21.3 mm-40 -56.96 -44.58 82.76 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 124.673 1.233 . . . . 0.0 111.196 -178.534 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.59 -49.45 77.42 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.839 0.855 . . . . 0.0 111.688 -179.57 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.15 -21.99 63.97 Favored 'General case' 0 CA--C 1.552 1.04 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 177.757 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.461 HG23 ' O ' ' A' ' 26' ' ' GLU . 42.3 t -73.61 -42.79 55.35 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.261 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 179.272 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 9.0 mm-40 -76.08 -20.3 57.82 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 114.559 -1.201 . . . . 0.0 110.814 -178.807 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -84.09 -14.6 50.0 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.719 0.808 . . . . 0.0 111.586 173.212 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 86.25 33.4 14.47 Favored Glycine 0 C--N 1.344 0.986 0 N-CA-C 114.792 0.677 . . . . 0.0 114.792 166.294 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -101.95 -179.19 3.93 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 117.781 0.791 . . . . 0.0 109.371 165.478 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.6 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 11.4 tp10 -87.71 132.31 34.17 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 156.618 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.467 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 8.7 p -117.47 135.74 56.88 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.27 0 CA-C-N 119.057 0.844 . . . . 0.0 110.667 -176.269 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.4 tptt -144.44 119.0 9.71 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.333 0.653 . . . . 0.0 109.278 177.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.618 HG12 ' HB3' ' A' ' 7' ' ' ALA . 46.6 mt -121.21 112.22 34.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 C-N-CA 123.082 0.553 . . . . 0.0 111.725 -173.854 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 49.0 tt0 -80.86 116.41 20.83 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.409 0.684 . . . . 0.0 110.115 175.737 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.404 HG22 ' HB2' ' A' ' 9' ' ' CYS . 22.6 p -97.26 114.31 26.04 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.841 0.856 . . . . 0.0 110.749 178.197 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.513 ' O ' ' HA ' ' A' ' 10' ' ' ALA . 45.7 mt-30 -105.09 137.27 43.11 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.918 0.887 . . . . 0.0 109.08 174.886 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -170.35 -165.84 28.33 Favored Glycine 0 C--N 1.345 1.041 0 C-N-CA 121.423 -0.417 . . . . 0.0 113.597 -177.561 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.99 -29.22 68.18 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.908 0.883 . . . . 0.0 112.601 -176.38 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -80.08 -11.25 59.78 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.283 0.633 . . . . 0.0 110.955 176.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 119.75 -157.35 15.57 Favored Glycine 0 C--N 1.345 1.075 0 N-CA-C 111.642 -0.583 . . . . 0.0 111.642 -179.537 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.405 HD12 HH22 ' A' ' 49' ' ' ARG . 55.4 mt -107.31 144.74 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 179.292 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -145.7 150.42 36.24 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.944 0.898 . . . . 0.0 109.514 -174.439 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.6 t30 60.64 43.87 12.08 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.554 1.142 . . . . 0.0 110.058 177.119 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.405 HH22 HD12 ' A' ' 46' ' ' ILE . 19.9 tpp180 -53.37 124.2 14.08 Favored 'General case' 0 C--N 1.357 0.921 0 C-N-CA 124.863 1.265 . . . . 0.0 112.796 -173.152 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.468 ' HB2' HH22 ' A' ' 74' ' ' ARG . 51.4 mt -69.9 140.45 53.12 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 114.49 -1.232 . . . . 0.0 110.96 170.859 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 70.1 p -101.86 164.74 11.57 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.627 0.771 . . . . 0.0 109.76 178.772 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.59 -32.13 64.94 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 122.913 0.485 . . . . 0.0 110.744 173.481 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 44.8 tt0 -61.9 -53.65 52.84 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.96 0.904 . . . . 0.0 110.962 173.304 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -57.68 -41.06 80.8 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 123.257 0.623 . . . . 0.0 111.886 -177.648 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.561 HG22 ' HG3' ' A' ' 78' ' ' ARG . 55.0 mt -72.08 -31.32 39.52 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.125 0 C-N-CA 123.77 0.828 . . . . 0.0 110.962 -177.654 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.72 -45.19 53.72 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.362 0.665 . . . . 0.0 111.337 176.539 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -65.7 -32.92 74.74 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.159 0.984 . . . . 0.0 111.121 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -51.92 102.6 0.05 OUTLIER 'General case' 0 CA--C 1.543 0.693 0 O-C-N 124.857 1.348 . . . . 0.0 112.322 -174.16 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 29.0 m -61.25 -37.96 84.99 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.089 165.761 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 91.7 mt -137.05 139.52 44.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 124.255 1.022 . . . . 0.0 110.371 -176.644 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.442 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 23.5 mt -126.05 141.21 46.36 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 172.6 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.0 mp -129.52 111.92 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 CA-C-N 118.248 0.476 . . . . 0.0 109.827 174.816 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' HIS . . . . . 0.411 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 12.7 m170 -87.74 85.67 7.08 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-O 121.618 0.723 . . . . 0.0 110.021 174.204 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.494 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 19.6 m -82.87 83.22 7.84 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 114.605 -1.179 . . . . 0.0 109.7 176.906 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.409 ' O ' ' HA ' ' A' ' 84' ' ' THR . 31.3 m -129.17 158.76 41.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 CA-C-O 121.668 0.747 . . . . 0.0 112.487 -170.482 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -113.97 -14.66 12.42 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.116 1.366 . . . . 0.0 109.445 175.116 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.3 m -134.1 150.24 31.03 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 125.786 1.635 . . . . 0.0 107.94 174.447 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 50.0 m -64.12 111.39 5.34 Favored Pre-proline 0 CA--C 1.548 0.903 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 174.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.531 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 33.4 Cg_endo -62.79 148.43 93.42 Favored 'Trans proline' 0 C--N 1.38 2.187 0 C-N-CA 122.467 2.111 . . . . 0.0 112.223 -173.721 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -65.13 -32.46 74.16 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.645 -179.214 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -96.55 15.66 20.96 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 115.084 -0.962 . . . . 0.0 112.424 -175.12 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.531 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 51.6 t30 -58.16 -33.51 69.3 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 124.033 0.933 . . . . 0.0 112.137 -179.189 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.42 -23.54 65.55 Favored 'General case' 0 N--CA 1.485 1.283 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -175.836 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.468 HH22 ' HB2' ' A' ' 50' ' ' LEU . 40.7 mtp180 -64.51 -38.12 89.92 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.385 0.674 . . . . 0.0 112.021 174.44 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -91.13 -3.04 57.43 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-N 114.615 -1.175 . . . . 0.0 111.357 -174.676 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -60.46 -30.65 69.81 Favored 'General case' 0 CA--C 1.554 1.099 0 C-N-CA 124.471 1.108 . . . . 0.0 112.021 -176.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 52.7 p -74.95 -18.68 60.35 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 124.048 0.939 . . . . 0.0 112.802 179.641 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.561 ' HG3' HG22 ' A' ' 55' ' ' ILE . 19.9 mmt180 -116.7 168.62 10.04 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.594 0.757 . . . . 0.0 111.881 -166.173 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -76.95 102.65 6.5 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.719 0.808 . . . . 0.0 110.349 -178.741 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.442 ' HA ' ' HB ' ' A' ' 61' ' ' ILE . 58.1 t -112.75 129.28 68.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 123.427 0.691 . . . . 0.0 110.807 -177.47 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 -99.87 90.08 4.31 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.387 1.075 . . . . 0.0 108.41 176.753 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.411 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 47.3 mt-10 -79.29 126.87 31.35 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.953 -176.514 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.55 HD12 ' HB3' ' A' ' 87' ' ' ASP . 38.2 pt -140.91 -172.9 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 C-N-CA 125.278 1.431 . . . . 0.0 109.137 178.729 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.409 ' HA ' ' O ' ' A' ' 65' ' ' VAL . 34.4 p -85.21 153.89 22.33 Favored 'General case' 0 C--N 1.346 0.45 0 CA-C-O 121.071 0.463 . . . . 0.0 110.324 168.476 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.712 HD13 ' SG ' ' A' ' 11' ' ' CYS . 7.6 tt -63.99 -27.54 69.19 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.039 176.179 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.471 ' HG2' ' HE2' ' A' ' 90' ' ' LYS . 35.7 tt0 -64.34 -42.96 96.0 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.864 0.866 . . . . 0.0 111.48 176.226 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.55 ' HB3' HD12 ' A' ' 83' ' ' ILE . 30.1 t70 -62.12 -30.86 71.32 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.462 0.705 . . . . 0.0 111.131 -179.843 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.46 -27.44 67.03 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.852 0.861 . . . . 0.0 112.885 178.762 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 37.6 mt -88.11 -45.96 15.83 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 C-N-CA 123.01 0.524 . . . . 0.0 109.996 -178.357 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.471 ' HE2' ' HG2' ' A' ' 86' ' ' GLN . 0.2 OUTLIER -78.82 -38.06 39.08 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 122.942 0.497 . . . . 0.0 112.089 -175.423 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -122.25 25.34 9.01 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.377 0.671 . . . . 0.0 110.56 -167.325 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.465 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -47.07 -59.37 3.18 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.401 0.68 . . . . 0.0 112.499 -176.186 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.06 -37.4 76.96 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 114.781 -1.1 . . . . 0.0 111.109 178.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.55 -50.7 60.03 Favored Glycine 0 C--N 1.354 1.548 0 O-C-N 124.578 1.174 . . . . 0.0 112.62 -178.151 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.407 ' O ' HG13 ' A' ' 99' ' ' ILE . 33.4 mt -54.38 -57.38 6.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 124.463 1.105 . . . . 0.0 110.126 -179.082 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.0 mp -56.8 -51.36 68.33 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.986 0 O-C-N 124.192 0.932 . . . . 0.0 111.021 -176.534 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.48 -28.12 68.32 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -176.838 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 35.7 mm-40 -70.91 -33.2 70.3 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.554 0.742 . . . . 0.0 110.652 178.413 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 95' ' ' ILE . 19.4 mt -82.14 -33.19 11.38 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 178.921 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -57.0 -49.76 74.8 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.479 1.112 . . . . 0.0 111.091 174.31 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -74.12 -33.93 63.75 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 123.576 0.548 . . . . 0.0 111.7 -177.046 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 66.8 mtm -63.13 -53.55 51.76 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 122.173 0.189 . . . . 0.0 110.6 175.342 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 21.7 mt -64.57 -39.32 85.2 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 O-C-N 123.821 0.701 . . . . 0.0 110.674 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.82 -42.08 99.57 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 122.263 0.225 . . . . 0.0 110.833 178.456 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 14.8 t -69.78 -35.4 74.85 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 122.703 0.401 . . . . 0.0 111.166 -172.397 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -81.18 -28.69 34.86 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 122.811 0.444 . . . . 0.0 111.618 179.169 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -87.26 -21.78 25.59 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.078 0.551 . . . . 0.0 112.033 -178.538 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 . . . . . 0 N--CA 1.481 1.089 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 175.032 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 37.8 pttt . . . . . 0 N--CA 1.478 0.93 0 CA-C-O 120.94 0.4 . . . . 0.0 110.516 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.575 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.2 tmtp? -142.42 134.49 27.36 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 -175.859 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.441 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.9 tt -127.08 136.82 52.69 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 179.091 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 19.6 pt -128.22 164.23 30.42 Favored 'Isoleucine or valine' 0 C--O 1.243 0.724 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 173.515 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.607 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -152.28 165.74 33.98 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.877 177.504 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.515 HD21 ' HG3' ' A' ' 41' ' ' GLN . 3.2 tt -137.34 109.95 7.51 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 -179.413 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.509 ' HA ' ' O ' ' A' ' 64' ' ' SER . 64.1 m -102.25 113.25 26.37 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 123.725 0.81 . . . . 0.0 108.966 177.472 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.415 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -129.01 124.08 34.01 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 122.703 0.401 . . . . 0.0 111.032 -176.887 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.738 ' SG ' HD13 ' A' ' 85' ' ' LEU . 1.3 m -144.17 148.88 43.13 Favored Pre-proline 0 N--CA 1.477 0.891 0 C-N-CA 123.753 0.821 . . . . 0.0 110.552 178.814 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -81.61 -7.16 12.62 Favored 'Trans proline' 0 C--N 1.373 1.863 0 C-N-CA 122.725 2.283 . . . . 0.0 111.411 176.612 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 55.0 mtt -70.52 -20.83 62.8 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.68 1.192 . . . . 0.0 110.991 177.393 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.17 -178.59 17.89 Favored Glycine 0 C--N 1.344 1.007 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.943 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 39.2 mt -72.33 -22.55 61.16 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 112.832 0.679 . . . . 0.0 112.832 -175.326 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.66 -43.53 93.91 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-N 118.484 0.584 . . . . 0.0 111.479 178.074 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.4 t-160 -70.07 -39.63 75.52 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.391 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.444 ' HA ' HD11 ' A' ' 85' ' ' LEU . 48.7 p -68.45 -28.08 66.73 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.419 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.1 m-30 -75.7 -28.23 58.55 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.599 0.76 . . . . 0.0 111.185 177.272 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 78.7 mtp -61.26 -46.14 91.59 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-O 121.303 0.573 . . . . 0.0 109.654 171.771 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.93 -38.05 69.93 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 114.888 -1.051 . . . . 0.0 111.507 178.373 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.23 -42.32 93.5 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.65 0.78 . . . . 0.0 110.837 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.407 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 24.2 tp60 -66.22 -43.49 86.52 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 122.812 0.445 . . . . 0.0 109.991 178.265 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.546 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -60.27 -56.53 20.42 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.912 -177.102 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.414 HD11 ' OG ' ' A' ' 64' ' ' SER . 96.6 mt -65.59 -30.49 71.23 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.789 0.835 . . . . 0.0 111.894 -179.275 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.515 ' HA ' HG21 ' A' ' 36' ' ' VAL . 35.5 tt0 -60.03 -55.37 34.77 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 123.733 0.646 . . . . 0.0 110.054 176.504 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.552 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 55.4 mm-40 -53.03 -51.12 62.72 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 124.513 1.133 . . . . 0.0 110.518 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.74 -49.8 72.1 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.454 1.102 . . . . 0.0 112.032 -177.609 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.94 -23.57 64.17 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 113.508 0.929 . . . . 0.0 113.508 177.938 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' ' 26' ' ' GLU . 49.0 t -75.87 -43.23 39.75 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 -179.707 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.552 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 24.6 mm-40 -69.81 -33.36 72.24 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 114.486 -1.234 . . . . 0.0 110.134 179.32 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -77.35 -19.21 56.63 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.558 0.743 . . . . 0.0 111.707 176.28 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 89.67 39.16 6.32 Favored Glycine 0 C--N 1.342 0.861 0 N-CA-C 114.722 0.649 . . . . 0.0 114.722 166.445 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -104.53 170.27 7.99 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 165.197 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.575 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 45.4 tt0 -78.99 129.45 34.46 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 156.048 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.515 HG21 ' HA ' ' A' ' 26' ' ' GLU . 12.2 p -113.97 137.5 46.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 CA-C-N 118.336 0.516 . . . . 0.0 110.01 -175.626 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 47.8 tptt -144.38 113.33 6.8 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 177.53 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.607 HG12 ' HB3' ' A' ' 7' ' ' ALA . 61.3 mt -118.3 110.96 32.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 122.55 0.34 . . . . 0.0 111.418 -175.321 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -74.29 142.1 45.26 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 123.805 0.691 . . . . 0.0 109.136 171.396 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 14.0 p -128.0 117.55 21.9 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.745 0.818 . . . . 0.0 109.219 -176.817 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.515 ' HG3' HD21 ' A' ' 8' ' ' LEU . 42.3 mt-30 -110.17 128.85 55.7 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 178.428 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -152.79 -176.37 25.28 Favored Glycine 0 C--N 1.336 0.564 0 N-CA-C 112.113 -0.395 . . . . 0.0 112.113 -177.888 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.51 -27.67 69.43 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.711 0.805 . . . . 0.0 111.695 -179.531 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -72.57 -36.32 68.16 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.972 0.909 . . . . 0.0 110.751 177.205 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 146.64 -159.42 27.99 Favored Glycine 0 C--N 1.347 1.155 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.054 -177.052 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 76.1 mt -111.57 131.96 61.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 123.397 0.679 . . . . 0.0 109.58 178.07 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -128.29 150.47 50.04 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.458 1.103 . . . . 0.0 109.691 -177.569 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 17.0 t30 60.63 41.42 15.32 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 124.61 1.164 . . . . 0.0 110.259 176.482 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 18.7 tpp180 -47.35 125.39 8.01 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 125.496 1.519 . . . . 0.0 113.142 -174.492 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 42.2 mt -75.09 127.93 34.35 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.778 173.526 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 50.1 p -87.34 161.2 18.06 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.423 176.534 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -57.48 -29.63 64.41 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 122.971 0.509 . . . . 0.0 111.47 175.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -73.06 -37.1 66.95 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.648 0.779 . . . . 0.0 111.378 178.449 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -62.02 -40.83 97.04 Favored 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 110.332 -0.247 . . . . 0.0 110.332 174.806 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.567 HG22 ' HG3' ' A' ' 78' ' ' ARG . 31.9 mt -73.6 -30.04 28.43 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.991 0 O-C-N 124.206 0.941 . . . . 0.0 110.888 -178.891 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.97 -48.99 31.75 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.598 0.759 . . . . 0.0 111.173 179.303 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -84.23 -4.38 58.79 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.593 0.757 . . . . 0.0 112.025 -177.533 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.91 104.19 0.82 Allowed 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.912 0.387 . . . . 0.0 110.58 177.362 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 26.1 m -60.64 -37.66 82.23 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.226 167.353 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 73.0 mt -135.65 142.45 39.32 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 C-N-CA 123.527 0.731 . . . . 0.0 110.646 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.406 HD13 ' HD2' ' A' ' 75' ' ' PHE . 23.4 mt -129.17 135.79 61.09 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 C-N-CA 124.105 0.962 . . . . 0.0 108.446 171.966 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -125.82 112.69 31.44 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 C-N-CA 123.106 0.562 . . . . 0.0 109.586 174.659 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' HIS . . . . . 0.459 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 16.4 m170 -88.25 86.22 7.04 Favored 'General case' 0 N--CA 1.485 1.319 0 CA-C-N 118.833 0.742 . . . . 0.0 109.45 172.965 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.509 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 23.1 m -82.92 81.62 8.54 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-N 114.808 -1.087 . . . . 0.0 109.466 176.774 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 28.0 m -126.88 159.05 37.25 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-O 121.677 0.751 . . . . 0.0 112.252 -170.548 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -117.54 -21.57 8.52 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.106 1.362 . . . . 0.0 108.822 173.686 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 12.3 m -126.04 156.83 36.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 125.106 1.362 . . . . 0.0 108.197 175.203 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 38.7 m -65.79 118.29 50.23 Favored Pre-proline 0 CA--C 1.546 0.812 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 177.2 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.545 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 56.2 Cg_endo -69.49 146.38 61.67 Favored 'Trans proline' 0 C--N 1.373 1.839 0 C-N-CA 121.683 1.589 . . . . 0.0 110.705 175.385 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -62.69 -48.28 79.99 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-O 121.538 0.685 . . . . 0.0 111.196 -175.358 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -94.76 26.58 3.47 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 114.76 -1.109 . . . . 0.0 111.789 -170.364 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.545 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 6.5 p30 -60.19 -27.75 67.41 Favored 'General case' 0 CA--C 1.557 1.237 0 C-N-CA 124.616 1.166 . . . . 0.0 112.043 -178.557 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.98 -13.1 60.01 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.06 0.944 . . . . 0.0 112.809 -177.334 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -69.53 -23.28 63.57 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-O 121.34 0.591 . . . . 0.0 110.66 171.687 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.406 ' HD2' HD13 ' A' ' 61' ' ' ILE . 27.3 m-85 -104.21 7.72 36.08 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 124.932 1.293 . . . . 0.0 110.563 -177.042 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -56.6 -52.47 64.72 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 124.883 1.273 . . . . 0.0 112.584 -171.069 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 48.4 t -86.79 -2.6 58.69 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.193 0.997 . . . . 0.0 112.046 -175.032 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.567 ' HG3' HG22 ' A' ' 55' ' ' ILE . 25.2 mmt180 -103.41 159.72 15.33 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.925 0.89 . . . . 0.0 110.12 -173.706 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -77.1 99.2 5.28 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-O 121.222 0.534 . . . . 0.0 111.211 -176.291 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 41.6 t -112.44 142.02 26.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 123.982 0.913 . . . . 0.0 110.501 -177.697 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -116.94 93.29 4.13 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.487 1.115 . . . . 0.0 108.656 177.075 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.459 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 42.1 mt-10 -81.81 114.53 20.5 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.598 -176.589 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.529 HD12 ' HB3' ' A' ' 87' ' ' ASP . 45.2 pt -125.46 -173.78 0.95 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.882 0 C-N-CA 124.704 1.201 . . . . 0.0 109.008 177.244 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 40.4 p -80.88 152.52 28.09 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-O 120.935 0.397 . . . . 0.0 110.0 168.184 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.738 HD13 ' SG ' ' A' ' 11' ' ' CYS . 6.7 tt -62.59 -26.09 68.42 Favored 'General case' 0 CA--C 1.551 1.012 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.724 173.473 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.59 ' HG2' ' HE2' ' A' ' 90' ' ' LYS . 34.6 tt0 -64.98 -45.6 84.97 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.733 0.813 . . . . 0.0 111.292 176.387 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.529 ' HB3' HD12 ' A' ' 83' ' ' ILE . 20.3 t70 -61.57 -30.71 70.84 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.375 0.67 . . . . 0.0 111.102 -178.963 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.97 -43.42 95.83 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.514 0.726 . . . . 0.0 111.794 175.722 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 75.3 mt -68.45 -41.22 83.16 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.926 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.271 -177.164 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.59 ' HE2' ' HG2' ' A' ' 86' ' ' GLN . 0.2 OUTLIER -87.35 -53.22 4.95 Favored 'General case' 0 N--CA 1.485 1.299 0 CA-C-O 120.964 0.412 . . . . 0.0 111.938 -175.607 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -102.73 28.15 6.36 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.3 1.04 . . . . 0.0 110.667 -166.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.546 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -43.56 -62.5 1.06 Allowed 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.835 0.854 . . . . 0.0 112.922 -175.272 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.24 -39.17 85.79 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.177 -0.92 . . . . 0.0 110.958 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' GLY . . . . . 0.412 ' O ' ' HG2' ' A' ' 98' ' ' GLU . . . -58.79 -53.91 42.35 Favored Glycine 0 C--N 1.353 1.508 0 O-C-N 124.72 1.262 . . . . 0.0 112.828 -178.162 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 25.8 mt -51.18 -55.74 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 124.481 1.113 . . . . 0.0 110.624 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.8 mp -57.96 -50.61 77.37 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.112 0 O-C-N 124.199 0.937 . . . . 0.0 111.298 -176.308 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.36 -27.42 66.23 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 122.91 0.484 . . . . 0.0 112.174 -176.359 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.412 ' HG2' ' O ' ' A' ' 94' ' ' GLY . 57.7 mm-40 -67.15 -38.75 86.03 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.232 0.613 . . . . 0.0 109.753 176.811 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.41 ' O ' HG13 ' A' ' 103' ' ' ILE . 21.1 mt -77.06 -37.17 25.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -52.13 -51.72 56.11 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 124.735 1.214 . . . . 0.0 111.981 174.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -71.46 -33.14 69.06 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 123.505 0.503 . . . . 0.0 111.218 -177.01 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 71.0 mtm -67.49 -39.24 85.21 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 122.617 0.367 . . . . 0.0 111.042 175.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.478 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 9.3 mt -70.08 -42.8 79.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 176.871 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.37 -21.2 66.23 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.242 0.617 . . . . 0.0 111.23 179.586 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 26.3 t -85.19 -42.18 14.95 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 122.931 0.492 . . . . 0.0 110.09 179.011 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.478 ' HG2' ' HA ' ' A' ' 103' ' ' ILE . 13.1 pt-20 -76.35 -23.3 54.19 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 122.897 0.479 . . . . 0.0 111.599 -178.05 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.9 mm-40 -90.02 -39.86 12.68 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.122 0.569 . . . . 0.0 110.535 177.821 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 80.3 mm-40 . . . . . 0 CA--C 1.554 1.104 0 CA-C-O 118.587 -0.72 . . . . 0.0 109.495 179.891 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.673 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 27.9 pttt . . . . . 0 C--O 1.245 0.838 0 CA-C-O 121.487 0.66 . . . . 0.0 111.04 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.592 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.9 tmtp? -143.75 143.68 31.49 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.477 -172.606 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.477 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.0 tt -128.01 131.13 49.22 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 174.687 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 18.7 pt -122.98 161.72 24.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 108.482 -0.932 . . . . 0.0 108.482 170.097 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.586 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -146.48 171.34 15.21 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.001 176.444 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.5 tt -146.48 117.31 7.66 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 -178.89 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.516 ' HA ' ' O ' ' A' ' 64' ' ' SER . 56.2 m -104.73 112.86 26.11 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.932 0.893 . . . . 0.0 109.239 176.883 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.531 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -128.36 117.24 21.08 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 122.496 0.318 . . . . 0.0 111.183 -178.206 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.767 ' SG ' HD13 ' A' ' 85' ' ' LEU . 1.3 m -138.78 141.78 31.77 Favored Pre-proline 0 N--CA 1.484 1.226 0 C-N-CA 123.89 0.876 . . . . 0.0 110.868 178.186 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -82.94 -7.66 11.21 Favored 'Trans proline' 0 C--N 1.375 1.928 0 C-N-CA 123.434 2.756 . . . . 0.0 111.533 176.863 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 47.9 ttm -65.12 -30.15 71.07 Favored 'General case' 0 C--N 1.354 0.764 0 C-N-CA 124.738 1.215 . . . . 0.0 110.318 170.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 125.79 -176.08 17.43 Favored Glycine 0 C--N 1.346 1.126 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.407 179.176 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 48.9 mt -78.17 -21.75 49.72 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 -173.038 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.82 -41.96 88.06 Favored 'General case' 0 N--CA 1.488 1.463 0 CA-C-N 118.922 0.783 . . . . 0.0 110.898 178.667 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.429 ' ND1' HD22 ' A' ' 85' ' ' LEU . 4.9 t-80 -67.55 -44.63 77.83 Favored 'General case' 0 C--O 1.247 0.94 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.165 -179.603 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 50.1 p -65.76 -36.43 83.53 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 114.816 -1.084 . . . . 0.0 110.916 -178.34 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -68.62 -30.82 69.64 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.34 0.656 . . . . 0.0 111.352 -179.182 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 64.7 mtm -68.28 -40.55 81.77 Favored 'General case' 0 N--CA 1.485 1.293 0 CA-C-O 120.473 0.178 . . . . 0.0 111.1 175.266 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.63 -38.48 83.94 Favored 'General case' 0 N--CA 1.485 1.29 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.133 175.232 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.8 -39.35 80.17 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.084 0.953 . . . . 0.0 110.975 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -62.71 -50.91 69.24 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.672 0.789 . . . . 0.0 109.513 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.15 -50.63 69.66 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 124.265 0.978 . . . . 0.0 111.956 -175.296 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 68.2 mt -63.93 -34.22 77.48 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 122.95 0.5 . . . . 0.0 111.743 179.048 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.44 ' O ' HG23 ' A' ' 30' ' ' VAL . 42.4 tt0 -63.39 -54.12 41.75 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 122.463 0.305 . . . . 0.0 110.313 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -51.28 -50.74 58.7 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 124.616 1.198 . . . . 0.0 111.445 179.357 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.421 ' HB3' HD12 ' A' ' 96' ' ' ILE . . . -67.48 -35.85 79.96 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 115.177 -0.92 . . . . 0.0 112.195 -176.756 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.04 -25.84 59.01 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.073 0.549 . . . . 0.0 111.716 178.208 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.44 HG23 ' O ' ' A' ' 26' ' ' GLU . 53.7 t -71.73 -39.37 68.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 175.205 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -65.87 -29.52 69.98 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 114.688 -1.142 . . . . 0.0 111.088 174.521 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -82.49 1.5 37.38 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 123.45 0.7 . . . . 0.0 112.41 177.623 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.96 -45.93 1.77 Allowed Glycine 0 C--N 1.353 1.503 0 N-CA-C 114.423 0.529 . . . . 0.0 114.423 165.489 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.673 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.1 OUTLIER -71.56 175.72 5.34 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -174.418 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.592 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 37.8 tt0 -77.07 144.03 38.83 Favored 'General case' 0 C--N 1.351 0.638 0 CA-C-N 114.446 -1.252 . . . . 0.0 109.111 178.515 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.477 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 9.3 p -128.66 135.92 61.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 122.66 0.384 . . . . 0.0 110.944 -178.612 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.9 tptt -142.46 113.35 7.5 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.248 0.619 . . . . 0.0 109.482 174.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.586 HG12 ' HB3' ' A' ' 7' ' ' ALA . 40.7 mt -117.54 112.78 40.24 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 122.854 0.462 . . . . 0.0 111.536 -176.376 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.532 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 32.0 tt0 -84.59 124.14 31.1 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.176 0.591 . . . . 0.0 110.288 177.262 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 24.9 p -100.95 105.27 16.49 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.871 0.868 . . . . 0.0 110.413 177.213 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.531 ' O ' ' HA ' ' A' ' 10' ' ' ALA . 40.0 mt-30 -95.35 141.83 28.45 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 172.219 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -162.19 -176.95 34.81 Favored Glycine 0 N--CA 1.464 0.564 0 CA-C-O 120.019 -0.323 . . . . 0.0 112.718 -177.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.6 -28.91 67.6 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.73 0.812 . . . . 0.0 111.807 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -72.69 -43.93 62.45 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.147 0.979 . . . . 0.0 110.363 175.883 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 148.69 -158.58 27.72 Favored Glycine 0 C--N 1.345 1.044 0 CA-C-N 115.257 -0.883 . . . . 0.0 112.007 -175.083 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 64.8 mt -106.82 138.6 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 123.699 0.8 . . . . 0.0 110.146 -175.665 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -140.02 151.23 45.29 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.903 0.881 . . . . 0.0 109.191 -177.384 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 21.7 t30 57.57 48.27 14.61 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 124.507 1.123 . . . . 0.0 109.702 -177.016 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 32.0 tpt180 -48.4 123.36 6.46 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 126.228 1.811 . . . . 0.0 113.704 -173.09 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.532 ' HG ' ' HB2' ' A' ' 39' ' ' GLU . 52.2 mt -75.17 135.54 41.08 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 124.086 0.954 . . . . 0.0 110.318 170.595 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 44.4 p -103.77 173.03 6.48 Favored 'General case' 0 C--O 1.244 0.808 0 C-N-CA 124.164 0.985 . . . . 0.0 109.38 177.536 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.09 -33.81 73.93 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 122.813 0.445 . . . . 0.0 110.759 175.877 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -63.96 -44.75 91.83 Favored 'General case' 0 C--N 1.359 0.982 0 O-C-N 124.066 0.854 . . . . 0.0 110.944 178.228 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -57.99 -47.84 81.81 Favored 'General case' 0 N--CA 1.48 1.045 0 O-C-N 123.8 0.688 . . . . 0.0 110.983 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.546 HG22 ' HG3' ' A' ' 78' ' ' ARG . 14.2 mt -74.94 -28.83 21.57 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 O-C-N 123.741 0.65 . . . . 0.0 111.256 -177.191 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.94 -44.17 70.11 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.561 0.744 . . . . 0.0 111.401 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -89.36 -9.02 51.97 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.322 0.649 . . . . 0.0 111.602 -176.762 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.35 96.74 0.11 Allowed 'General case' 0 C--N 1.351 0.67 0 C-N-CA 123.548 0.739 . . . . 0.0 111.647 -177.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 26.3 m -62.58 -35.99 81.25 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 114.836 -1.075 . . . . 0.0 109.745 172.508 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.456 HG23 HG21 ' A' ' 99' ' ' ILE . 79.8 mt -131.55 137.18 55.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 CA-C-N 114.883 -1.053 . . . . 0.0 109.209 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 30.1 mt -131.23 133.66 62.14 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 175.278 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -124.95 111.11 26.72 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 174.808 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 11.8 m170 -89.19 85.49 6.65 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-O 121.576 0.703 . . . . 0.0 109.626 173.198 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.516 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 18.5 p -79.29 81.27 5.58 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-N 114.531 -1.213 . . . . 0.0 108.973 175.138 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.406 ' O ' ' HA ' ' A' ' 84' ' ' THR . 35.9 m -126.51 159.72 35.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 121.631 0.729 . . . . 0.0 111.553 -171.027 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -128.89 -3.22 5.21 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.068 1.347 . . . . 0.0 109.275 176.722 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.8 m -138.71 158.25 30.31 Favored 'Isoleucine or valine' 0 C--N 1.349 0.564 0 C-N-CA 125.912 1.685 . . . . 0.0 107.356 168.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 39.2 m -63.41 118.43 43.78 Favored Pre-proline 0 CA--C 1.547 0.828 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 175.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.479 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 58.9 Cg_endo -67.37 146.44 75.05 Favored 'Trans proline' 0 C--N 1.377 2.054 0 C-N-CA 122.095 1.863 . . . . 0.0 110.686 179.596 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.458 ' HB2' HE22 ' A' ' 41' ' ' GLN . 9.1 mm-40 -61.82 -38.79 89.47 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-O 121.752 0.787 . . . . 0.0 110.752 -176.866 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -94.57 16.54 15.19 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 114.514 -1.221 . . . . 0.0 112.417 -172.041 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.479 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 4.1 p30 -54.11 -26.59 28.2 Favored 'General case' 0 CA--C 1.565 1.541 0 C-N-CA 123.965 0.906 . . . . 0.0 110.766 174.404 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -56.13 -45.52 79.52 Favored 'General case' 0 CA--C 1.565 1.52 0 C-N-CA 125.836 1.654 . . . . 0.0 112.702 171.765 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 58.7 mtt85 -71.02 -17.77 62.61 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 124.6 1.16 . . . . 0.0 112.656 -176.775 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.539 ' HB3' HG21 ' A' ' 80' ' ' VAL . 77.1 m-85 -103.23 19.12 20.22 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.048 0.939 . . . . 0.0 110.991 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 13.7 tp10 -57.33 -56.51 20.91 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.409 1.083 . . . . 0.0 112.305 -174.734 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 64.8 p -86.2 -9.78 55.93 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.674 0.789 . . . . 0.0 112.453 -174.325 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.546 ' HG3' HG22 ' A' ' 55' ' ' ILE . 38.5 mmt180 -91.37 157.11 17.28 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 123.357 0.663 . . . . 0.0 111.927 -170.827 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -82.14 97.96 8.46 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.668 0.787 . . . . 0.0 109.751 -178.641 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.539 HG21 ' HB3' ' A' ' 75' ' ' PHE . 41.6 t -110.73 118.43 57.22 Favored 'Isoleucine or valine' 0 C--O 1.24 0.602 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.96 -174.854 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -86.39 89.41 7.87 Favored 'General case' 0 C--O 1.24 0.574 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 172.516 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -84.52 125.37 32.34 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.157 -177.527 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.627 HD12 ' HB3' ' A' ' 87' ' ' ASP . 39.0 pt -135.2 -175.37 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 125.024 1.33 . . . . 0.0 109.224 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.406 ' HA ' ' O ' ' A' ' 65' ' ' VAL . 24.8 p -79.57 151.35 30.71 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.847 0.356 . . . . 0.0 110.475 168.241 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.767 HD13 ' SG ' ' A' ' 11' ' ' CYS . 6.5 tt -61.88 -32.15 72.49 Favored 'General case' 0 N--CA 1.48 1.059 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.492 176.066 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 31.2 tt0 -59.83 -43.55 94.51 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.794 0.838 . . . . 0.0 111.181 175.21 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.627 ' HB3' HD12 ' A' ' 83' ' ' ILE . 5.1 t70 -60.31 -31.67 70.5 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.95 0.9 . . . . 0.0 110.773 -176.621 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.93 -28.74 63.67 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.468 0.707 . . . . 0.0 112.831 178.686 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 86.0 mt -77.92 -48.14 24.01 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.874 0 C-N-CA 123.041 0.536 . . . . 0.0 110.32 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -80.31 -43.17 21.71 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.075 0.55 . . . . 0.0 112.323 -176.25 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -114.46 27.86 9.16 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.507 0.723 . . . . 0.0 110.557 -168.084 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -45.38 -60.08 2.34 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 124.063 0.945 . . . . 0.0 112.781 -177.449 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.66 -41.38 94.9 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 114.074 -1.421 . . . . 0.0 110.702 177.318 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -62.81 -42.1 99.74 Favored Glycine 0 C--N 1.354 1.566 0 O-C-N 124.391 1.057 . . . . 0.0 113.301 -173.34 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.403 ' O ' HG13 ' A' ' 99' ' ' ILE . 19.7 mt -63.25 -57.51 11.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 123.909 0.884 . . . . 0.0 108.682 179.45 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.421 HD12 ' HB3' ' A' ' 28' ' ' ALA . 82.6 mt -58.61 -45.77 90.44 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 CA-C-N 114.04 -1.437 . . . . 0.0 111.722 -174.726 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -33.07 73.5 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 122.755 0.422 . . . . 0.0 111.365 -177.531 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -67.5 -37.56 83.01 Favored 'General case' 0 C--N 1.355 0.809 0 O-C-N 123.614 0.571 . . . . 0.0 110.404 177.762 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.456 HG21 HG23 ' A' ' 60' ' ' ILE . 57.1 mt -75.14 -34.94 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 -177.128 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -63.37 -49.5 73.59 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 114.892 -1.049 . . . . 0.0 111.374 176.081 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -73.57 -30.7 63.19 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-O 119.613 -0.232 . . . . 0.0 111.307 -177.712 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.453 ' O ' ' HG2' ' A' ' 106' ' ' GLU . 68.3 mtm -65.47 -61.97 1.8 Allowed 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 175.165 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 41.3 mt -58.58 -48.49 85.44 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 O-C-N 123.932 0.77 . . . . 0.0 111.419 -176.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.83 -37.55 88.01 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -175.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 15.3 t -80.88 -23.47 39.0 Favored 'General case' 0 N--CA 1.484 1.275 0 CA-C-N 117.763 0.256 . . . . 0.0 111.643 -172.764 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' A' ' 102' ' ' MET . 11.6 pt-20 -86.79 -41.69 13.89 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 122.549 0.34 . . . . 0.0 111.058 176.972 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -73.26 -35.62 66.23 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.025 0.53 . . . . 0.0 110.905 -177.465 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 76.3 mm-40 . . . . . 0 CA--C 1.55 0.965 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 175.217 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.639 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 18.1 pttt . . . . . 0 N--CA 1.481 1.121 0 CA-C-O 121.203 0.525 . . . . 0.0 111.684 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.462 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.4 tmtp? -142.2 141.0 32.52 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-O 121.029 0.442 . . . . 0.0 109.834 -173.555 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.474 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 8.9 tt -128.4 139.58 52.3 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 176.199 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.427 HD12 HD13 ' A' ' 50' ' ' LEU . 18.3 pt -131.08 169.48 21.58 Favored 'Isoleucine or valine' 0 C--O 1.244 0.77 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 172.187 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.619 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -155.22 167.74 29.35 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.22 176.47 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.402 ' HA ' ' O ' ' A' ' 39' ' ' GLU . 3.8 tt -138.53 115.23 10.65 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 178.127 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.53 ' HA ' ' O ' ' A' ' 64' ' ' SER . 65.1 m -105.33 112.53 25.67 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.567 0.747 . . . . 0.0 109.045 176.963 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.444 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -126.51 128.26 46.62 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 122.718 0.407 . . . . 0.0 111.641 -176.387 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.75 ' SG ' HD13 ' A' ' 85' ' ' LEU . 20.9 m -125.82 151.15 70.65 Favored Pre-proline 0 N--CA 1.476 0.83 0 C-N-CA 124.24 1.016 . . . . 0.0 109.989 175.516 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -82.15 -0.54 10.32 Favored 'Trans proline' 0 C--N 1.374 1.897 0 C-N-CA 122.757 2.304 . . . . 0.0 112.099 173.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 46.6 ttm -99.4 -62.36 1.25 Allowed 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.307 1.043 . . . . 0.0 110.458 -173.535 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 179.52 -178.22 48.57 Favored Glycine 0 C--N 1.347 1.168 0 CA-C-N 115.96 -0.564 . . . . 0.0 113.336 -176.7 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 74.6 mt -82.32 -17.13 46.84 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 -174.379 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.6 -45.99 91.92 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-N 118.69 0.677 . . . . 0.0 110.998 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 8.0 t-160 -68.88 -36.6 78.28 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.406 -179.277 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.459 ' HA ' HD11 ' A' ' 85' ' ' LEU . 36.2 p -68.81 -30.31 68.85 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.566 179.643 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.496 ' HA ' ' HB3' ' A' ' 22' ' ' ALA . 19.8 m-85 -77.48 -22.35 51.43 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.467 0.707 . . . . 0.0 111.681 177.048 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 77.6 mtp -66.49 -44.33 82.93 Favored 'General case' 0 N--CA 1.486 1.336 0 CA-C-O 121.322 0.582 . . . . 0.0 109.471 171.379 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.73 -37.49 70.58 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 114.687 -1.142 . . . . 0.0 111.101 176.068 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.496 ' HB3' ' HA ' ' A' ' 19' ' ' PHE . . . -70.32 -34.01 72.19 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.437 0.695 . . . . 0.0 110.85 -179.318 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.1 tt0 -61.85 -55.37 30.5 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.342 0.657 . . . . 0.0 109.328 173.323 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.68 -44.37 86.42 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 114.372 -1.286 . . . . 0.0 112.447 -170.232 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.437 HD11 ' OG ' ' A' ' 64' ' ' SER . 96.2 mt -70.04 -34.77 73.66 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 122.745 0.418 . . . . 0.0 111.323 178.299 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.482 ' O ' HG23 ' A' ' 30' ' ' VAL . 36.8 tt0 -60.49 -55.45 33.3 Favored 'General case' 0 C--N 1.354 0.796 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 178.61 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -54.14 -50.2 67.47 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 124.579 1.174 . . . . 0.0 110.886 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.4 -45.1 92.43 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.162 0.985 . . . . 0.0 112.201 -176.942 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.58 -24.81 61.15 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 178.423 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 26' ' ' GLU . 40.6 t -70.43 -43.04 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 175.582 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -62.63 -34.04 76.24 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 114.588 -1.187 . . . . 0.0 111.064 178.193 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.68 -42.28 95.47 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.478 0.711 . . . . 0.0 111.65 177.792 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 135.09 -43.96 1.21 Allowed Glycine 0 C--N 1.348 1.207 0 CA-C-N 116.861 -0.154 . . . . 0.0 113.206 174.307 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.639 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -71.6 177.88 3.85 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 -177.266 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.462 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 30.2 tt0 -78.66 154.66 30.0 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 115.083 -0.962 . . . . 0.0 109.505 178.881 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.474 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 7.1 p -134.94 136.61 51.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 123.226 0.61 . . . . 0.0 110.138 176.733 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 45.9 tptt -143.69 113.83 7.32 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 175.427 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.619 HG12 ' HB3' ' A' ' 7' ' ' ALA . 41.5 mt -116.01 109.85 29.6 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 C-N-CA 122.654 0.382 . . . . 0.0 111.844 -174.232 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.402 ' O ' ' HA ' ' A' ' 8' ' ' LEU . 32.7 tt0 -76.08 135.63 39.88 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 172.067 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.401 HG22 ' HB2' ' A' ' 9' ' ' CYS . 12.2 p -118.93 119.04 33.16 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 123.657 0.783 . . . . 0.0 109.65 -177.24 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.471 HE22 ' HB2' ' A' ' 70' ' ' GLU . 40.4 mt-30 -109.65 137.68 47.11 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 123.796 0.838 . . . . 0.0 109.969 179.153 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -164.45 176.31 40.36 Favored Glycine 0 C--O 1.243 0.664 0 N-CA-C 112.136 -0.386 . . . . 0.0 112.136 179.025 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.72 -19.79 66.03 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.292 0.637 . . . . 0.0 112.034 -179.205 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -74.56 -40.32 61.73 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.159 0.584 . . . . 0.0 110.876 173.789 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 156.06 -158.02 28.28 Favored Glycine 0 C--N 1.343 0.97 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.004 -176.76 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.42 HD12 HH22 ' A' ' 49' ' ' ARG . 74.6 mt -124.12 137.98 55.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 C-N-CA 123.316 0.647 . . . . 0.0 109.769 177.364 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -132.98 152.42 51.95 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.178 0.991 . . . . 0.0 109.636 -178.666 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.1 t30 63.58 36.82 10.74 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 124.24 1.016 . . . . 0.0 110.238 175.057 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.42 HH22 HD12 ' A' ' 46' ' ' ILE . 20.2 tpp180 -45.26 122.51 3.47 Favored 'General case' 0 C--N 1.362 1.117 0 C-N-CA 126.088 1.755 . . . . 0.0 112.762 -175.675 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.427 HD13 HD12 ' A' ' 6' ' ' ILE . 41.1 mt -76.2 147.17 38.59 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.264 172.851 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 17.1 p -104.86 171.88 7.08 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 175.204 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.7 -29.33 70.58 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 122.664 0.386 . . . . 0.0 111.231 175.065 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -64.94 -46.93 79.55 Favored 'General case' 0 C--N 1.354 0.781 0 O-C-N 123.759 0.662 . . . . 0.0 110.243 176.101 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -56.25 -46.09 79.78 Favored 'General case' 0 N--CA 1.484 1.267 0 O-C-N 123.928 0.768 . . . . 0.0 111.403 179.02 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.607 HG22 ' HG3' ' A' ' 78' ' ' ARG . 28.6 mt -74.19 -31.49 29.46 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 O-C-N 123.925 0.765 . . . . 0.0 111.121 -174.708 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.25 -50.02 30.5 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.164 0.585 . . . . 0.0 111.093 178.668 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -79.95 -9.56 59.69 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.4 0.68 . . . . 0.0 111.652 -176.898 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.82 103.25 0.42 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.297 0.639 . . . . 0.0 110.538 176.863 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 30.2 m -61.85 -36.08 80.16 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.656 170.516 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.497 HG23 HG21 ' A' ' 99' ' ' ILE . 79.8 mt -132.36 141.44 45.26 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.292 179.308 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.422 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 21.9 mt -132.12 140.78 47.07 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 123.856 0.862 . . . . 0.0 108.887 171.634 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.2 mp -126.03 116.65 46.51 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.329 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 173.514 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' HIS . . . . . 0.426 ' HE1' ' HA ' ' A' ' 72' ' ' ASN . 5.2 m170 -92.32 86.21 5.64 Favored 'General case' 0 N--CA 1.486 1.334 0 CA-C-O 121.739 0.78 . . . . 0.0 109.834 173.339 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.53 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 22.7 m -82.43 78.91 9.01 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 114.381 -1.282 . . . . 0.0 109.956 178.679 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.447 HG11 ' HG3' ' A' ' 69' ' ' PRO . 34.2 m -125.35 157.14 34.61 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 CA-C-O 121.858 0.837 . . . . 0.0 111.721 -170.074 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -107.77 -23.3 12.14 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 114.17 -1.377 . . . . 0.0 109.483 178.754 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 15.8 m -136.86 179.64 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 125.051 1.341 . . . . 0.0 108.757 178.008 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 86.8 m -69.98 116.02 39.82 Favored Pre-proline 0 CA--C 1.549 0.938 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 172.467 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.592 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 58.1 Cg_endo -73.31 146.8 40.82 Favored 'Trans proline' 0 C--N 1.373 1.857 0 C-N-CA 122.406 2.07 . . . . 0.0 110.859 175.833 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.471 ' HB2' HE22 ' A' ' 41' ' ' GLN . 14.2 mm-40 -67.36 -23.76 65.63 Favored 'General case' 0 N--CA 1.482 1.175 0 CA-C-O 121.219 0.533 . . . . 0.0 111.338 -175.478 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -101.6 10.06 40.57 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.152 -176.36 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.592 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 8.4 t30 -56.45 -34.83 67.23 Favored 'General case' 0 N--CA 1.495 1.814 0 C-N-CA 123.499 0.72 . . . . 0.0 112.021 179.592 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -57.96 -22.24 48.18 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 125.264 1.425 . . . . 0.0 113.314 179.157 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 43.1 mtp180 -86.03 -28.51 24.09 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.409 1.083 . . . . 0.0 112.537 -176.807 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.411 ' HE2' HD13 ' A' ' 50' ' ' LEU . 58.0 m-85 -99.98 -17.77 17.37 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.702 0.801 . . . . 0.0 111.969 -173.249 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -59.08 -29.49 67.38 Favored 'General case' 0 CA--C 1.559 1.292 0 C-N-CA 124.098 0.959 . . . . 0.0 113.282 -168.017 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 14.2 t -85.16 0.41 51.81 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.522 0.729 . . . . 0.0 112.142 -178.786 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.607 ' HG3' HG22 ' A' ' 55' ' ' ILE . 36.8 mmt180 -114.67 168.53 9.8 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.0 0.92 . . . . 0.0 110.081 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -75.65 86.45 2.7 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-O 121.785 0.802 . . . . 0.0 110.28 -178.352 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.422 ' HA ' ' HB ' ' A' ' 61' ' ' ILE . 60.2 t -101.56 125.94 55.53 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 CA-C-N 114.619 -1.173 . . . . 0.0 110.109 179.415 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -98.74 89.53 4.38 Favored 'General case' 0 C--O 1.24 0.592 0 N-CA-C 107.4 -1.333 . . . . 0.0 107.4 174.19 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -78.86 125.33 29.23 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.051 -177.206 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.454 HD12 ' HB3' ' A' ' 87' ' ' ASP . 46.4 pt -128.62 -174.06 1.1 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.856 0 C-N-CA 124.491 1.116 . . . . 0.0 109.379 177.388 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 23.3 p -84.36 149.3 26.13 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 109.908 -0.405 . . . . 0.0 109.908 166.82 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.75 HD13 ' SG ' ' A' ' 11' ' ' CYS . 7.6 tt -61.65 -31.03 71.12 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.865 179.209 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -61.51 -42.98 99.61 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 123.403 0.681 . . . . 0.0 110.938 176.459 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.454 ' HB3' HD12 ' A' ' 83' ' ' ILE . 9.2 t70 -62.8 -31.88 72.96 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.569 0.748 . . . . 0.0 110.913 -179.157 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.54 -14.5 63.05 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.836 0.854 . . . . 0.0 112.906 179.566 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 47.5 mt -96.76 -56.6 5.07 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 123.662 0.785 . . . . 0.0 109.536 178.101 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -77.82 -30.37 51.08 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 -173.301 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -118.35 15.25 13.9 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.443 0.697 . . . . 0.0 110.55 -175.051 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.489 ' HA ' HD12 ' A' ' 95' ' ' ILE . . . -41.97 -57.91 2.26 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 124.49 1.116 . . . . 0.0 113.467 -173.871 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.82 -41.19 97.48 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.944 179.11 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -58.93 -44.08 96.34 Favored Glycine 0 C--N 1.35 1.345 0 O-C-N 124.343 1.027 . . . . 0.0 112.339 -179.439 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.489 HD12 ' HA ' ' A' ' 92' ' ' ALA . 22.3 mt -59.42 -58.53 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 124.144 0.978 . . . . 0.0 110.272 -179.517 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.7 mp -54.37 -51.14 51.72 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 O-C-N 124.175 0.922 . . . . 0.0 110.832 -176.677 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.48 -29.82 69.36 Favored 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -175.431 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -68.34 -36.55 79.42 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 177.939 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.497 HG21 HG23 ' A' ' 60' ' ' ILE . 38.3 mt -76.91 -36.45 25.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 -177.89 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -57.38 -52.58 64.8 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 114.502 -1.226 . . . . 0.0 111.063 177.291 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -71.05 -32.15 68.78 Favored 'General case' 0 CA--C 1.546 0.805 0 O-C-N 123.671 0.607 . . . . 0.0 111.838 -176.514 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 70.7 mtm -66.06 -53.83 33.46 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 122.837 0.455 . . . . 0.0 110.954 177.425 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 40.7 mt -67.7 -33.38 61.5 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.837 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.714 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -72.21 -25.36 61.63 Favored 'General case' 0 C--O 1.212 -0.917 0 CA-C-O 119.666 -0.207 . . . . 0.0 111.066 177.935 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 21.0 t -78.04 -38.76 43.85 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 118.01 0.368 . . . . 0.0 110.88 -178.304 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -72.32 -37.56 68.89 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 122.354 0.262 . . . . 0.0 111.159 178.763 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -84.08 -31.15 25.48 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 122.932 0.493 . . . . 0.0 111.355 -177.501 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 65.9 mm-40 . . . . . 0 C--O 1.25 1.111 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.124 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.561 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 14.6 pttt . . . . . 0 C--O 1.256 1.395 0 CA-C-O 121.71 0.767 . . . . 0.0 111.192 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.567 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 3.7 tmtp? -149.64 141.49 23.73 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.126 -172.428 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.476 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.6 tt -128.48 139.05 52.53 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 176.154 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.417 HD12 HD13 ' A' ' 50' ' ' LEU . 16.0 pt -130.14 165.46 30.24 Favored 'Isoleucine or valine' 0 C--O 1.241 0.625 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 168.941 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.571 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -152.16 169.11 23.24 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 176.304 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.1 tt -140.97 109.69 6.02 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -178.413 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.565 ' HA ' ' O ' ' A' ' 64' ' ' SER . 66.8 m -101.05 107.61 19.1 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.938 0.895 . . . . 0.0 109.463 176.848 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -125.9 115.31 19.74 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 122.852 0.461 . . . . 0.0 110.096 -177.672 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.573 ' SG ' ' HB3' ' A' ' 13' ' ' MET . 25.7 t -123.04 139.06 30.77 Favored Pre-proline 0 N--CA 1.476 0.846 0 C-N-CA 123.034 0.533 . . . . 0.0 110.664 -175.567 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -74.39 -15.9 22.12 Favored 'Trans proline' 0 C--N 1.374 1.911 0 C-N-CA 123.151 2.568 . . . . 0.0 112.848 170.947 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.573 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 44.2 ttm -69.05 -57.13 5.85 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.557 0.743 . . . . 0.0 110.282 177.779 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 164.85 171.47 31.13 Favored Glycine 0 C--O 1.245 0.812 0 CA-C-N 114.886 -1.052 . . . . 0.0 111.813 -177.675 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 81.0 mt -67.5 -20.01 65.4 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.246 0.619 . . . . 0.0 111.941 178.547 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -57.06 -45.35 83.32 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-O 121.047 0.451 . . . . 0.0 110.996 175.361 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 7.7 t-160 -73.01 -36.06 66.93 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.432 -178.928 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.433 ' HA ' HD11 ' A' ' 85' ' ' LEU . 37.4 p -64.41 -37.79 88.77 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.563 179.505 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.404 ' HA ' ' HB3' ' A' ' 22' ' ' ALA . 21.4 m-85 -75.18 -23.42 57.72 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.416 0.687 . . . . 0.0 111.926 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 83.8 mtp -61.32 -48.45 81.3 Favored 'General case' 0 N--CA 1.484 1.262 0 CA-C-O 121.173 0.511 . . . . 0.0 110.064 169.088 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.89 -38.91 73.05 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.951 178.94 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.404 ' HB3' ' HA ' ' A' ' 19' ' ' PHE . . . -68.48 -39.83 81.18 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.934 0.893 . . . . 0.0 111.225 -176.606 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.452 ' O ' ' HG3' ' A' ' 27' ' ' GLU . 16.2 tt0 -65.37 -50.35 65.89 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 123.482 0.489 . . . . 0.0 110.241 176.77 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.87 -48.98 79.35 Favored 'General case' 0 CA--C 1.551 1.013 0 O-C-N 123.829 0.705 . . . . 0.0 112.213 -174.918 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 73.4 mt -64.84 -37.07 86.4 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 122.97 0.508 . . . . 0.0 111.587 177.221 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.482 ' O ' HG23 ' A' ' 30' ' ' VAL . 41.3 tt0 -59.88 -55.23 36.79 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 123.35 0.406 . . . . 0.0 110.25 -179.039 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.534 ' O ' ' HG3' ' A' ' 31' ' ' GLU . 44.6 mt-10 -52.84 -53.11 53.49 Favored 'General case' 0 N--CA 1.475 0.825 0 O-C-N 124.616 1.198 . . . . 0.0 111.159 -179.584 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -62.01 -37.48 85.02 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.721 -176.974 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.56 -24.11 49.91 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.164 0.585 . . . . 0.0 112.503 179.822 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 26' ' ' GLU . 40.6 t -64.14 -43.87 97.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 172.748 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.534 ' HG3' ' O ' ' A' ' 27' ' ' GLU . 25.9 mt-10 -80.13 -20.78 44.16 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 113.506 -1.679 . . . . 0.0 111.643 -176.086 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.65 -16.54 62.27 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.373 0.669 . . . . 0.0 111.221 174.488 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 116.11 -19.01 13.79 Favored Glycine 0 C--N 1.354 1.579 0 N-CA-C 114.53 0.572 . . . . 0.0 114.53 167.64 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.561 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -106.02 -179.58 3.98 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 113.323 0.861 . . . . 0.0 113.323 -173.481 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.567 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 10.8 tp10 -75.77 150.27 37.81 Favored 'General case' 0 C--N 1.355 0.812 0 CA-C-N 114.479 -1.237 . . . . 0.0 109.021 175.419 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.476 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 7.1 p -137.4 132.94 46.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 122.921 0.489 . . . . 0.0 110.238 177.917 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 48.2 tptt -142.11 112.82 7.3 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 179.132 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.571 HG12 ' HB3' ' A' ' 7' ' ' ALA . 45.5 mt -118.6 111.08 32.3 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 -173.785 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -75.55 139.68 42.27 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.829 0.851 . . . . 0.0 109.74 174.007 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.408 HG22 ' HB2' ' A' ' 9' ' ' CYS . 17.0 p -123.1 111.68 16.83 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.881 0.872 . . . . 0.0 109.463 -178.293 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.471 HE22 ' HB2' ' A' ' 70' ' ' GLU . 41.9 mt-30 -105.74 146.38 29.87 Favored 'General case' 0 C--O 1.243 0.744 0 CA-C-O 121.174 0.511 . . . . 0.0 111.376 -177.428 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -169.78 169.24 41.97 Favored Glycine 0 C--N 1.342 0.866 0 CA-C-N 114.917 -1.038 . . . . 0.0 111.752 175.721 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.94 -24.76 67.85 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.556 0.743 . . . . 0.0 111.741 -179.573 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -72.42 -39.93 67.5 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.201 0.6 . . . . 0.0 110.603 174.659 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 163.93 -173.73 40.0 Favored Glycine 0 C--N 1.344 1.027 0 CA-C-N 116.214 -0.448 . . . . 0.0 113.333 -179.516 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 78.2 mt -122.63 134.82 64.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.215 1.006 . . . . 0.0 108.836 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -128.89 152.76 48.18 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.931 0.892 . . . . 0.0 109.628 -179.144 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 10.3 t30 60.21 40.45 18.03 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 124.364 1.066 . . . . 0.0 109.977 176.667 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 17.4 tpp180 -47.58 124.54 7.18 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 125.854 1.662 . . . . 0.0 113.118 -175.724 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.417 HD13 HD12 ' A' ' 6' ' ' ILE . 55.0 mt -77.81 132.91 38.26 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.318 1.047 . . . . 0.0 110.6 173.3 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 43.0 p -96.68 169.77 9.65 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.721 177.171 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.09 -34.89 70.66 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 122.904 0.482 . . . . 0.0 111.204 175.486 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 19.9 tt0 -65.23 -46.74 79.38 Favored 'General case' 0 C--N 1.352 0.716 0 O-C-N 123.717 0.636 . . . . 0.0 110.463 178.117 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -53.66 -44.79 69.94 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 123.362 0.665 . . . . 0.0 111.71 179.267 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 45.8 mt -71.74 -32.73 46.11 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.94 0 O-C-N 124.302 1.002 . . . . 0.0 110.935 -177.47 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.35 -41.55 69.62 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.467 0.707 . . . . 0.0 111.42 178.02 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -72.3 -32.38 66.52 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.99 0.916 . . . . 0.0 111.003 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.73 102.56 0.07 Allowed 'General case' 0 N--CA 1.471 0.622 0 O-C-N 124.568 1.168 . . . . 0.0 112.587 -173.056 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 26.9 m -61.88 -38.59 88.87 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 124.049 0.94 . . . . 0.0 109.429 168.043 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.452 HG23 HG21 ' A' ' 99' ' ' ILE . 70.6 mt -128.44 139.78 50.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.092 -178.44 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.407 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 25.9 mt -131.21 133.49 62.38 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.286 0 C-N-CA 123.821 0.848 . . . . 0.0 108.919 171.401 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.1 mp -121.9 112.5 35.18 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.339 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 174.786 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' HIS . . . . . 0.511 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 9.4 m170 -86.48 86.04 7.33 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-O 121.678 0.751 . . . . 0.0 109.15 173.42 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.565 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 15.0 m -81.25 78.98 7.99 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 114.074 -1.421 . . . . 0.0 109.222 177.452 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 35.3 m -127.5 157.98 39.04 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-O 121.688 0.756 . . . . 0.0 111.537 -169.943 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -117.11 -10.38 10.87 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.524 1.13 . . . . 0.0 109.418 175.164 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 4.0 m -141.84 162.3 20.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 125.699 1.6 . . . . 0.0 108.498 173.825 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 47.0 m -61.83 114.93 12.76 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 123.286 0.634 . . . . 0.0 110.162 175.62 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.547 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 69.1 Cg_endo -70.53 151.54 64.75 Favored 'Trans proline' 0 C--N 1.377 2.055 0 C-N-CA 122.241 1.961 . . . . 0.0 110.87 178.083 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.471 ' HB2' HE22 ' A' ' 41' ' ' GLN . 11.6 mm-40 -67.57 -45.49 75.45 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-O 121.216 0.531 . . . . 0.0 111.107 -172.996 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -89.64 14.4 11.74 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.746 0.818 . . . . 0.0 112.305 -169.869 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.547 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 5.2 p30 -55.47 -27.35 47.77 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 124.83 1.252 . . . . 0.0 112.817 -176.313 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -56.89 -33.6 67.06 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.958 1.303 . . . . 0.0 113.03 -177.951 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -72.58 -38.15 67.97 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.929 0.892 . . . . 0.0 110.812 -175.515 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -77.09 -12.78 59.99 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 114.447 -1.251 . . . . 0.0 111.456 -174.721 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -54.48 -33.28 59.44 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 124.663 1.185 . . . . 0.0 112.352 178.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 73.5 p -73.83 -19.42 60.74 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 -177.686 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 40.6 mmt180 -115.46 170.25 8.55 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.756 0.822 . . . . 0.0 111.803 -170.845 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -76.9 93.94 3.84 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.412 0.685 . . . . 0.0 110.177 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.407 ' HA ' ' HB ' ' A' ' 61' ' ' ILE . 48.3 t -99.0 139.76 20.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.25 177.818 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -116.5 91.14 3.5 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 179.382 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.511 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 49.1 mt-10 -81.14 123.93 28.82 Favored 'General case' 0 C--N 1.35 0.623 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.756 -175.569 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.633 HD12 ' HB3' ' A' ' 87' ' ' ASP . 45.5 pt -131.33 179.57 4.22 Favored 'Isoleucine or valine' 0 C--O 1.248 1.02 0 C-N-CA 125.112 1.365 . . . . 0.0 108.764 178.227 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 3.2 m -80.34 151.59 29.4 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 109.138 -0.689 . . . . 0.0 109.138 167.06 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.545 HD13 ' HB2' ' A' ' 11' ' ' CYS . 7.8 tt -62.86 -29.95 71.13 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.18 0.592 . . . . 0.0 111.591 -178.019 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.536 ' HG2' ' HE2' ' A' ' 90' ' ' LYS . 34.5 tt0 -64.83 -37.01 86.18 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.095 0.558 . . . . 0.0 111.397 179.133 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.633 ' HB3' HD12 ' A' ' 83' ' ' ILE . 5.3 t70 -61.88 -34.06 75.32 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.881 0.872 . . . . 0.0 110.366 -179.411 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -72.23 -11.63 60.81 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.883 0.873 . . . . 0.0 113.017 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 84.2 mt -96.43 -53.0 8.59 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 123.641 0.776 . . . . 0.0 109.723 178.27 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.536 ' HE2' ' HG2' ' A' ' 86' ' ' GLN . 0.2 OUTLIER -72.97 -42.46 63.31 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.456 0.702 . . . . 0.0 111.834 -176.453 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -117.81 26.67 9.52 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.343 1.057 . . . . 0.0 110.098 -167.856 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.49 -58.89 3.68 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.667 0.787 . . . . 0.0 112.956 -174.393 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -64.66 -33.92 77.08 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.103 177.849 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' GLY . . . . . 0.44 ' O ' ' HG2' ' A' ' 98' ' ' GLU . . . -60.5 -52.24 53.8 Favored Glycine 0 C--N 1.354 1.579 0 O-C-N 124.474 1.109 . . . . 0.0 112.269 -178.89 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 22.1 mt -55.73 -53.8 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 124.653 1.181 . . . . 0.0 109.933 -179.143 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 88.8 mt -57.05 -51.34 70.24 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.954 0 CA-C-N 114.47 -1.241 . . . . 0.0 111.638 -177.074 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.03 -30.44 69.66 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -178.355 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' A' ' 94' ' ' GLY . 31.2 mm-40 -63.15 -41.35 99.26 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.4 0.68 . . . . 0.0 109.751 177.107 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.452 HG21 HG23 ' A' ' 60' ' ' ILE . 58.5 mt -76.23 -35.25 27.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 -177.74 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -60.77 -48.14 83.14 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.024 0.93 . . . . 0.0 111.516 178.706 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -70.25 -36.85 74.75 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.952 -179.176 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 62.3 mtm -69.4 -52.01 31.02 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.905 0.482 . . . . 0.0 111.645 -178.033 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 20.0 mt -59.89 -49.08 85.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 O-C-N 123.677 0.611 . . . . 0.0 110.43 178.658 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.34 -28.21 69.85 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -178.95 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 32.8 t -81.4 -35.57 30.58 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 122.789 0.435 . . . . 0.0 111.551 -178.056 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -81.7 -30.27 32.64 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 122.368 0.267 . . . . 0.0 111.48 -178.925 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -76.45 -46.53 26.56 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 122.474 0.309 . . . . 0.0 110.457 178.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 86.9 mm-40 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.877 -0.583 . . . . 0.0 110.316 179.605 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 48.7 pttt . . . . . 0 N--CA 1.474 0.765 0 CA-C-O 120.936 0.398 . . . . 0.0 110.249 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.574 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.7 tmtp? -145.34 132.85 20.81 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 -169.261 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.521 HD11 HG13 ' A' ' 96' ' ' ILE . 10.4 tt -121.23 135.16 55.18 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 107.705 -1.22 . . . . 0.0 107.705 176.145 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.57 HD12 HD13 ' A' ' 50' ' ' LEU . 15.9 pt -127.92 161.27 36.33 Favored 'Isoleucine or valine' 0 C--O 1.242 0.705 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 174.75 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.598 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -152.62 167.54 28.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.12 178.654 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.544 HD21 ' HG3' ' A' ' 41' ' ' GLN . 2.5 tt -140.73 114.97 9.26 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 -178.344 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.546 ' HA ' ' O ' ' A' ' 64' ' ' SER . 56.2 m -107.08 113.14 26.42 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.817 0.847 . . . . 0.0 108.973 176.82 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -128.87 123.89 33.84 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 122.596 0.358 . . . . 0.0 111.225 -177.517 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.76 ' SG ' HD13 ' A' ' 85' ' ' LEU . 1.2 m -133.55 149.77 73.09 Favored Pre-proline 0 N--CA 1.479 0.996 0 C-N-CA 124.022 0.929 . . . . 0.0 110.362 177.859 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -79.52 -11.86 14.12 Favored 'Trans proline' 0 C--N 1.375 1.928 0 C-N-CA 122.596 2.197 . . . . 0.0 112.013 176.657 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 21.8 mmt -73.33 -50.61 21.16 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.309 1.043 . . . . 0.0 110.348 -176.955 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 158.66 -175.18 35.75 Favored Glycine 0 C--N 1.346 1.105 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.107 -179.287 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 74.3 mt -78.6 -16.47 57.34 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.111 0.564 . . . . 0.0 112.357 -176.607 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -57.69 -51.52 69.21 Favored 'General case' 0 C--O 1.25 1.088 0 CA-C-O 121.29 0.567 . . . . 0.0 111.309 177.877 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.438 ' ND1' HD22 ' A' ' 85' ' ' LEU . 4.3 t-80 -67.06 -38.54 85.97 Favored 'General case' 0 C--O 1.248 1.017 0 CA-C-N 114.866 -1.061 . . . . 0.0 110.213 -176.961 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 44.8 p -67.98 -35.68 78.76 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.968 -178.49 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -70.59 -26.77 63.67 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 122.839 0.455 . . . . 0.0 111.789 178.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 38.1 mtm -68.56 -43.06 77.41 Favored 'General case' 0 N--CA 1.484 1.233 0 CA-C-N 117.717 0.235 . . . . 0.0 110.603 174.009 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.91 -41.94 95.16 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.768 174.845 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.73 -43.8 98.14 Favored 'General case' 0 C--O 1.216 -0.705 0 CA-C-N 115.201 -0.909 . . . . 0.0 110.743 179.005 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.438 ' O ' ' HG3' ' A' ' 27' ' ' GLU . 9.0 tp-100 -62.71 -44.47 96.14 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.245 0.618 . . . . 0.0 110.816 -178.316 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.535 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -68.02 -49.18 63.1 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.65 -175.987 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 98.6 mt -64.24 -31.21 72.32 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.241 0.616 . . . . 0.0 111.694 177.716 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.507 ' O ' HG23 ' A' ' 30' ' ' VAL . 30.7 tt0 -63.09 -56.41 17.14 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.632 0.773 . . . . 0.0 110.17 179.113 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.438 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 49.7 mt-10 -55.05 -46.73 75.37 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 124.187 0.929 . . . . 0.0 110.657 -179.525 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.24 -51.01 71.54 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.322 1.049 . . . . 0.0 111.625 -178.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.14 -22.73 65.77 Favored 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 113.788 1.032 . . . . 0.0 113.788 178.053 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.507 HG23 ' O ' ' A' ' 26' ' ' GLU . 52.1 t -76.56 -43.66 34.87 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 178.748 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -68.45 -26.73 65.65 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 114.831 -1.077 . . . . 0.0 110.354 176.465 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.401 ' HB1' ' HE1' ' A' ' 34' ' ' TYR . . . -76.52 -26.48 55.26 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.211 1.004 . . . . 0.0 111.636 176.987 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 102.75 15.03 25.63 Favored Glycine 0 C--N 1.349 1.277 0 N-CA-C 114.654 0.622 . . . . 0.0 114.654 168.819 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.401 ' HE1' ' HB1' ' A' ' 32' ' ' ALA . 1.7 m-85 -95.54 162.54 13.59 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-N 117.844 0.822 . . . . 0.0 109.549 176.028 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.574 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 43.4 tt0 -74.0 126.19 29.94 Favored 'General case' 0 C--O 1.222 -0.373 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 160.732 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.48 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 12.5 p -115.11 132.66 63.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-N 118.772 0.715 . . . . 0.0 111.093 -172.68 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 49.3 tptt -142.33 117.55 10.12 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 179.678 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.598 HG12 ' HB3' ' A' ' 7' ' ' ALA . 55.9 mt -121.1 112.02 33.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -174.535 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.467 ' HG3' ' HA ' ' A' ' 49' ' ' ARG . 41.9 tt0 -71.09 138.91 50.13 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.249 1.02 . . . . 0.0 109.176 172.882 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 7.0 p -128.52 122.1 30.34 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 123.895 0.878 . . . . 0.0 108.911 -177.764 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.852 HE22 ' H ' ' A' ' 71' ' ' ASP . 24.5 mt-30 -122.04 151.75 40.51 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.622 0.725 . . . . 0.0 111.675 -176.218 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -161.31 173.1 37.68 Favored Glycine 0 C--O 1.241 0.554 0 CA-C-N 114.086 -1.415 . . . . 0.0 110.239 172.254 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.02 -16.45 63.72 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 122.919 0.487 . . . . 0.0 110.993 176.817 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -75.7 -34.82 60.43 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 123.821 0.848 . . . . 0.0 110.674 172.067 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 154.26 -176.99 31.91 Favored Glycine 0 C--N 1.348 1.198 0 CA-C-N 116.348 -0.387 . . . . 0.0 113.163 178.292 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.492 HG23 ' HG2' ' A' ' 41' ' ' GLN . 44.1 mt -108.73 156.15 9.44 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 124.434 1.094 . . . . 0.0 109.677 -178.187 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -151.2 149.61 29.63 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.821 0.848 . . . . 0.0 109.514 178.67 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.6 t30 60.4 34.68 20.6 Favored 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 124.135 0.974 . . . . 0.0 110.623 173.079 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.467 ' HA ' ' HG3' ' A' ' 39' ' ' GLU . 23.8 ttp180 -63.2 138.64 58.61 Favored 'General case' 0 C--N 1.351 0.652 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 -168.256 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.57 HD13 HD12 ' A' ' 6' ' ' ILE . 57.8 mt -80.4 121.55 25.86 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 113.747 -1.57 . . . . 0.0 111.504 -177.833 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 43.8 p -87.62 166.92 14.35 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 114.675 -1.148 . . . . 0.0 110.229 -177.94 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -53.13 -34.03 54.95 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.636 0.774 . . . . 0.0 111.898 179.056 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -68.28 -48.19 65.67 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 123.906 0.754 . . . . 0.0 111.271 178.829 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -58.85 -41.88 88.04 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.398 0.679 . . . . 0.0 111.236 -178.517 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.5 HG22 ' HG3' ' A' ' 78' ' ' ARG . 41.1 mt -76.09 -35.39 28.63 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.299 -173.834 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.82 -43.81 62.23 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.23 0.612 . . . . 0.0 111.181 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -85.44 -1.31 56.9 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.436 0.694 . . . . 0.0 111.985 -177.669 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.98 110.2 4.33 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.034 0.534 . . . . 0.0 111.202 178.69 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 16.4 m -61.55 -36.0 79.35 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 124.299 1.04 . . . . 0.0 110.082 167.012 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.535 HG23 HG21 ' A' ' 99' ' ' ILE . 55.6 mt -135.26 143.13 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 C-N-CA 123.885 0.874 . . . . 0.0 110.416 -179.381 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 23.0 mt -135.17 123.49 39.67 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 123.776 0.83 . . . . 0.0 109.165 173.608 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.2 mp -111.65 140.61 30.31 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.332 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 173.861 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' HIS . . . . . 0.541 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 6.9 m170 -114.36 84.89 2.13 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 168.473 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.546 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 15.9 m -81.39 81.98 7.36 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 114.821 -1.081 . . . . 0.0 109.483 176.002 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 30.2 m -125.33 162.72 27.49 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-O 121.782 0.801 . . . . 0.0 112.114 -171.724 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -114.98 -28.35 7.05 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 114.029 -1.441 . . . . 0.0 108.776 173.588 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 22.8 m -137.11 168.6 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 125.371 1.469 . . . . 0.0 108.955 178.588 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 62.1 m -66.42 119.28 61.24 Favored Pre-proline 0 CA--C 1.551 1.013 0 C-N-CA 123.191 0.597 . . . . 0.0 111.02 179.615 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.5 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 57.9 Cg_endo -72.68 146.3 43.1 Favored 'Trans proline' 0 C--N 1.371 1.718 0 C-N-CA 122.406 2.07 . . . . 0.0 111.12 170.285 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -64.77 -31.98 73.46 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 123.12 0.568 . . . . 0.0 111.826 -175.102 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.852 ' H ' HE22 ' A' ' 41' ' ' GLN . 6.4 m-20 -102.81 25.6 9.06 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.461 0.704 . . . . 0.0 111.731 -177.9 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.5 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 5.8 p30 -60.89 -27.65 68.31 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.088 0.555 . . . . 0.0 110.726 174.792 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -59.94 -27.28 66.66 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 125.19 1.396 . . . . 0.0 112.985 177.344 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 81.6 mtt180 -68.59 -21.01 64.54 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.285 0.634 . . . . 0.0 111.85 178.933 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.468 ' HB3' HG21 ' A' ' 80' ' ' VAL . 32.3 m-85 -111.31 7.26 20.96 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.371 1.069 . . . . 0.0 111.236 -174.593 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -53.56 -47.61 69.89 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.761 1.224 . . . . 0.0 113.279 -172.392 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 94.4 p -101.55 4.2 40.81 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.277 0.631 . . . . 0.0 112.348 -174.005 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.5 ' HG3' HG22 ' A' ' 55' ' ' ILE . 29.8 mmt180 -101.65 162.67 12.73 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 122.685 0.394 . . . . 0.0 111.062 -174.216 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -76.7 91.37 3.45 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.357 0.663 . . . . 0.0 110.644 -177.002 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.468 HG21 ' HB3' ' A' ' 75' ' ' PHE . 31.3 t -109.78 148.96 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 123.815 0.846 . . . . 0.0 110.724 -175.873 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -121.24 89.85 3.21 Favored 'General case' 0 C--N 1.348 0.509 0 C-N-CA 124.448 1.099 . . . . 0.0 108.706 -178.063 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.541 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 41.9 mt-10 -79.07 122.49 26.28 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.372 -175.082 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.44 HG13 ' HA ' ' A' ' 64' ' ' SER . 46.1 pt -135.69 -176.55 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.85 0 C-N-CA 124.962 1.305 . . . . 0.0 108.954 178.254 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 23.8 p -81.4 152.48 27.42 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-O 120.878 0.37 . . . . 0.0 110.211 170.244 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.76 HD13 ' SG ' ' A' ' 11' ' ' CYS . 6.3 tt -63.86 -29.82 70.97 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.064 175.716 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -63.9 -44.75 92.05 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.85 176.039 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -60.63 -32.12 71.29 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 122.921 0.488 . . . . 0.0 110.973 -177.615 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.11 -35.87 81.66 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.05 0.94 . . . . 0.0 112.748 178.561 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 59.5 mt -76.41 -38.11 31.96 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 O-C-N 123.648 0.593 . . . . 0.0 110.621 -176.85 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.21 -56.94 3.11 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 122.894 0.478 . . . . 0.0 112.069 -177.675 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -98.21 29.78 3.4 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.11 0.964 . . . . 0.0 110.651 -169.574 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.535 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -43.74 -63.08 0.91 Allowed 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.35 1.06 . . . . 0.0 113.316 -176.535 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.96 -34.04 75.39 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.357 -179.53 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' GLY . . . . . 0.444 ' O ' ' HG2' ' A' ' 98' ' ' GLU . . . -63.83 -47.48 85.77 Favored Glycine 0 C--N 1.353 1.52 0 O-C-N 124.127 0.892 . . . . 0.0 112.613 -179.321 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 19.1 mt -61.7 -53.54 46.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 123.947 0.899 . . . . 0.0 110.461 -177.424 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.521 HG13 HD11 ' A' ' 5' ' ' LEU . 1.9 mp -55.78 -51.04 64.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 O-C-N 124.015 0.822 . . . . 0.0 110.439 -178.615 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.72 -28.29 67.53 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 123.565 0.54 . . . . 0.0 111.781 -176.074 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 94' ' ' GLY . 63.6 mm-40 -62.0 -37.17 83.83 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.304 0.642 . . . . 0.0 109.857 174.34 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.535 HG21 HG23 ' A' ' 60' ' ' ILE . 33.7 mt -79.75 -37.84 18.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.622 -178.413 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.475 ' HG3' ' O ' ' A' ' 96' ' ' ILE . 32.2 mt-10 -60.17 -41.44 92.84 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.276 0.631 . . . . 0.0 110.974 178.191 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -74.55 -31.95 62.27 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 123.406 0.441 . . . . 0.0 110.988 -178.749 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 67.7 mtm -66.1 -37.95 87.02 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 122.562 0.345 . . . . 0.0 111.07 172.828 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.432 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 45.1 mt -69.89 -40.63 79.05 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.855 0 C-N-CA 123.161 0.584 . . . . 0.0 109.555 175.439 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.12 -18.61 64.68 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.503 0.721 . . . . 0.0 111.212 177.159 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 33.3 t -86.61 -41.48 14.23 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.421 0.688 . . . . 0.0 110.849 179.052 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.432 ' HG2' ' HA ' ' A' ' 103' ' ' ILE . 18.6 pt-20 -77.26 -28.4 53.54 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 122.828 0.451 . . . . 0.0 111.504 -176.801 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 79.1 mm-40 -87.99 -36.83 16.82 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 122.923 0.489 . . . . 0.0 111.044 -179.375 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 85.0 mm-40 . . . . . 0 N--CA 1.478 0.951 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 176.436 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.583 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 17.1 pttt . . . . . 0 C--O 1.251 1.178 0 CA-C-O 121.618 0.723 . . . . 0.0 111.271 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.574 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.0 tmtp? -147.53 146.01 29.3 Favored 'General case' 0 CA--C 1.55 0.944 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.257 -172.104 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.426 ' N ' ' HD3' ' A' ' 4' ' ' LYS . 8.5 tt -132.8 135.74 45.86 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.608 1.163 . . . . 0.0 108.116 176.116 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 20.4 pt -125.51 162.8 27.77 Favored 'Isoleucine or valine' 0 C--O 1.242 0.682 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 170.134 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.579 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -150.81 170.54 19.01 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 122.986 0.514 . . . . 0.0 110.028 177.184 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.7 tt -143.91 121.92 12.1 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 107.489 -1.301 . . . . 0.0 107.489 -178.114 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.554 ' HA ' ' O ' ' A' ' 64' ' ' SER . 64.0 m -114.8 113.62 24.48 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.874 0.87 . . . . 0.0 108.984 178.274 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.417 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -126.88 117.83 23.38 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 -174.964 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.772 ' SG ' HD13 ' A' ' 85' ' ' LEU . 71.5 m -118.33 144.59 35.39 Favored Pre-proline 0 N--CA 1.481 1.095 0 C-N-CA 124.687 1.195 . . . . 0.0 110.039 176.5 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -80.81 -8.99 13.32 Favored 'Trans proline' 0 C--N 1.368 1.597 0 C-N-CA 122.658 2.239 . . . . 0.0 112.671 172.409 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 53.5 tpp -78.71 -66.7 0.83 Allowed 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.559 0.743 . . . . 0.0 109.873 176.676 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 179.92 -172.84 44.47 Favored Glycine 0 C--N 1.342 0.885 0 CA-C-N 115.569 -0.741 . . . . 0.0 112.24 -176.5 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 89.5 mt -82.39 -13.64 56.51 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.231 0.826 . . . . 0.0 113.231 -174.399 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.08 -49.92 75.24 Favored 'General case' 0 CA--C 1.556 1.207 0 CA-C-O 121.098 0.475 . . . . 0.0 112.163 -179.751 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.464 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 10.0 t-160 -67.88 -39.44 83.69 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.103 -178.915 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 30.9 p -65.56 -32.41 73.99 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.053 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 14.7 m-30 -73.76 -30.43 62.78 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.484 0.714 . . . . 0.0 112.109 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 67.8 mtm -70.18 -36.48 74.68 Favored 'General case' 0 N--CA 1.487 1.423 0 CA-C-O 120.674 0.274 . . . . 0.0 110.452 173.826 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.26 -38.13 75.07 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.754 173.88 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.84 -42.5 81.34 Favored 'General case' 0 C--O 1.214 -0.768 0 C-N-CA 123.735 0.814 . . . . 0.0 110.575 -179.157 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.468 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 5.7 tp-100 -64.79 -44.49 89.8 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 122.949 0.499 . . . . 0.0 109.875 177.672 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.625 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -62.45 -51.79 66.1 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.836 -176.295 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 98.5 mt -67.48 -29.98 69.57 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.581 0.752 . . . . 0.0 111.511 178.402 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.504 ' HA ' HG21 ' A' ' 36' ' ' VAL . 32.1 tt0 -60.36 -58.54 8.07 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 123.713 0.633 . . . . 0.0 109.432 176.377 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 23' ' ' GLN . 12.1 mm-40 -51.31 -50.35 59.53 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 124.746 1.279 . . . . 0.0 110.736 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.82 -49.73 72.47 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.596 1.159 . . . . 0.0 112.153 -179.359 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.53 -29.83 70.52 Favored 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 176.889 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.5 HG23 ' O ' ' A' ' 26' ' ' GLU . 53.2 t -72.45 -36.65 55.17 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -179.54 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 14.1 mm-40 -71.37 -31.43 67.3 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.466 1.106 . . . . 0.0 110.801 177.549 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.77 -23.23 60.79 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.749 0.819 . . . . 0.0 111.616 175.767 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.13 23.21 27.86 Favored Glycine 0 C--N 1.348 1.2 0 N-CA-C 114.953 0.741 . . . . 0.0 114.953 166.003 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.583 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -118.29 178.03 4.59 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.294 0.638 . . . . 0.0 110.889 169.821 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.574 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 43.0 tt0 -74.51 147.47 41.83 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.432 178.124 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.504 HG21 ' HA ' ' A' ' 26' ' ' GLU . 15.0 p -127.12 139.33 52.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 122.756 0.422 . . . . 0.0 110.176 178.935 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.2 tptt -145.96 110.04 4.94 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 173.364 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.579 HG12 ' HB3' ' A' ' 7' ' ' ALA . 47.3 mt -115.07 111.33 35.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 C-N-CA 122.734 0.413 . . . . 0.0 111.338 -176.68 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.46 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 32.7 tt0 -73.51 145.66 45.44 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.448 0.699 . . . . 0.0 109.195 169.415 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.431 HG22 ' HB2' ' A' ' 9' ' ' CYS . 13.3 p -129.69 113.96 15.41 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 123.699 0.799 . . . . 0.0 108.877 -179.839 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.49 HE22 ' HB2' ' A' ' 70' ' ' GLU . 45.2 mt-30 -105.21 143.64 33.11 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.264 0.626 . . . . 0.0 110.223 179.441 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.409 ' HA2' ' O ' ' A' ' 11' ' ' CYS . . . -162.17 163.05 34.7 Favored Glycine 0 C--N 1.336 0.544 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.928 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.51 -23.61 67.47 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.186 0.595 . . . . 0.0 110.924 173.944 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -73.52 -35.06 65.53 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 124.431 1.092 . . . . 0.0 111.278 175.598 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 160.4 -174.46 37.12 Favored Glycine 0 C--N 1.347 1.174 0 CA-C-N 116.135 -0.484 . . . . 0.0 112.332 -178.692 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 76.7 mt -123.36 134.9 64.95 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 123.439 0.696 . . . . 0.0 109.153 174.471 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -127.77 149.99 50.01 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.313 1.045 . . . . 0.0 109.675 -178.068 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 6.8 t30 61.7 40.13 13.5 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 124.504 1.122 . . . . 0.0 110.58 173.332 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 16.1 tpp180 -47.81 122.59 5.11 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 125.576 1.55 . . . . 0.0 112.603 -176.537 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.46 ' HG ' ' HB2' ' A' ' 39' ' ' GLU . 42.4 mt -69.39 133.6 47.99 Favored 'General case' 0 C--O 1.241 0.657 0 C-N-CA 124.419 1.088 . . . . 0.0 111.032 174.712 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 44.8 p -91.7 163.37 14.11 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 115.113 -0.948 . . . . 0.0 109.085 175.006 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.33 -26.46 66.59 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 122.527 0.331 . . . . 0.0 110.895 173.501 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -70.0 -43.34 71.59 Favored 'General case' 0 C--N 1.355 0.834 0 C-N-CA 123.788 0.835 . . . . 0.0 110.634 177.039 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 45.0 m-20 -58.18 -43.21 87.39 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 122.807 0.443 . . . . 0.0 110.677 176.24 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.401 HG22 ' HG3' ' A' ' 78' ' ' ARG . 22.9 mt -70.24 -27.76 33.2 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 O-C-N 123.986 0.804 . . . . 0.0 110.614 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.47 -40.51 42.85 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.916 0.886 . . . . 0.0 111.817 179.541 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -74.4 -32.0 62.54 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.903 0.881 . . . . 0.0 111.117 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -52.75 99.37 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.658 0 O-C-N 124.747 1.279 . . . . 0.0 113.099 -171.177 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 26.1 m -62.42 -34.5 76.87 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 123.551 0.741 . . . . 0.0 109.163 167.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.488 HG23 HG21 ' A' ' 99' ' ' ILE . 76.7 mt -132.33 140.54 47.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.397 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.408 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 21.8 mt -130.38 139.06 52.3 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 172.072 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -126.81 128.95 71.38 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 173.631 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -103.54 86.97 2.73 Favored 'General case' 0 N--CA 1.489 1.49 0 CA-C-N 118.853 0.751 . . . . 0.0 109.486 169.457 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.554 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 19.6 m -82.86 82.4 8.17 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 124.653 1.181 . . . . 0.0 109.631 175.505 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 26.9 m -127.8 163.88 30.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-O 121.643 0.735 . . . . 0.0 111.719 -169.835 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -117.73 -14.9 10.15 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 114.322 -1.308 . . . . 0.0 109.594 174.741 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 15.2 m -132.07 177.99 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 125.283 1.433 . . . . 0.0 109.359 178.356 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 81.1 m -72.76 114.89 34.5 Favored Pre-proline 0 CA--C 1.545 0.767 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 167.235 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.607 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 33.3 Cg_endo -68.94 146.65 65.99 Favored 'Trans proline' 0 C--N 1.374 1.908 0 C-N-CA 121.788 1.659 . . . . 0.0 110.574 174.747 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.49 ' HB2' HE22 ' A' ' 41' ' ' GLN . 20.1 mm-40 -65.13 -33.7 76.65 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-O 121.387 0.613 . . . . 0.0 111.142 -172.668 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -96.85 9.8 40.81 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.778 -174.68 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.607 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 8.5 t30 -55.28 -34.98 64.57 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 124.112 0.965 . . . . 0.0 112.016 179.016 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -59.55 -22.91 62.37 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 124.993 1.317 . . . . 0.0 113.444 177.711 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 29.3 mtp180 -87.13 -18.71 29.82 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.877 0.871 . . . . 0.0 111.103 -178.802 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.442 ' HB3' HG21 ' A' ' 80' ' ' VAL . 70.6 m-85 -102.56 7.71 39.99 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 124.191 0.996 . . . . 0.0 110.745 178.31 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.8 tp10 -57.48 -51.01 71.17 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 124.696 1.198 . . . . 0.0 112.453 -172.371 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 56.6 p -86.94 -10.55 52.99 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.226 0.61 . . . . 0.0 112.145 -177.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.401 ' HG3' HG22 ' A' ' 55' ' ' ILE . 26.6 mmt180 -89.72 157.3 18.03 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.59 0.756 . . . . 0.0 110.998 -177.109 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -78.28 95.73 5.09 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.491 0.716 . . . . 0.0 110.946 -174.845 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.442 HG21 ' HB3' ' A' ' 75' ' ' PHE . 44.6 t -110.85 140.91 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 123.398 0.679 . . . . 0.0 110.784 -177.991 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -109.53 91.3 3.59 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 124.511 1.124 . . . . 0.0 108.95 176.801 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -76.78 133.0 39.55 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.128 -177.213 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.407 HG13 ' HA ' ' A' ' 64' ' ' SER . 31.5 pt -145.06 -173.25 0.46 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.838 0 C-N-CA 125.371 1.468 . . . . 0.0 108.438 176.168 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 35.5 p -86.78 153.54 21.6 Favored 'General case' 0 C--O 1.24 0.591 0 CA-C-O 121.211 0.529 . . . . 0.0 110.274 169.78 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.772 HD13 ' SG ' ' A' ' 11' ' ' CYS . 6.0 tt -66.27 -29.75 70.04 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.702 176.977 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -59.31 -45.93 89.97 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 123.884 0.874 . . . . 0.0 110.957 172.23 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -62.35 -33.35 74.55 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 123.894 0.746 . . . . 0.0 110.981 -179.181 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.463 ' HB2' ' HB3' ' A' ' 64' ' ' SER . . . -63.54 -31.51 72.7 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.79 0.836 . . . . 0.0 112.557 179.594 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 74.1 mt -79.21 -57.05 5.72 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.218 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.72 -47.43 53.95 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 115.865 -0.607 . . . . 0.0 112.167 -173.68 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -105.16 22.91 14.51 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.156 0.983 . . . . 0.0 110.962 -170.483 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.625 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -39.42 -61.98 0.73 Allowed 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 124.796 1.238 . . . . 0.0 113.985 -174.86 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.65 -30.82 69.61 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 114.564 -1.198 . . . . 0.0 111.345 -178.242 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.54 -45.24 95.2 Favored Glycine 0 C--N 1.35 1.342 0 O-C-N 123.942 0.776 . . . . 0.0 111.939 179.251 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 13.5 mt -60.79 -56.05 20.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.338 1.055 . . . . 0.0 110.471 -179.608 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.7 mp -56.23 -49.76 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 O-C-N 123.781 0.675 . . . . 0.0 111.011 -178.374 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.62 -27.69 66.25 Favored 'General case' 0 N--CA 1.485 1.318 0 O-C-N 123.294 0.371 . . . . 0.0 111.342 -176.77 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -62.33 -42.03 99.05 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.418 0.687 . . . . 0.0 109.856 175.62 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.488 HG21 HG23 ' A' ' 60' ' ' ILE . 25.9 mt -76.83 -36.46 26.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 -176.01 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -61.77 -44.14 97.47 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-N 114.539 -1.209 . . . . 0.0 111.794 176.449 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -76.4 -29.52 57.13 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 123.123 0.264 . . . . 0.0 110.904 -176.449 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 69.0 mtm -69.0 -54.12 16.92 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 122.749 0.42 . . . . 0.0 110.313 176.051 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 62.5 mt -60.36 -45.92 95.8 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 123.165 0.586 . . . . 0.0 110.263 178.529 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.495 ' O ' ' HG2' ' A' ' 108' ' ' GLN . . . -56.08 -48.5 75.97 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 122.869 0.467 . . . . 0.0 110.811 179.375 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 22.9 t -63.73 -43.01 97.8 Favored 'General case' 0 N--CA 1.48 1.038 0 O-C-N 123.785 0.678 . . . . 0.0 111.614 -171.498 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -74.54 -23.84 58.86 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.887 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -87.51 -19.05 28.48 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.655 0.382 . . . . 0.0 111.093 175.838 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.495 ' HG2' ' O ' ' A' ' 104' ' ' ALA . 86.0 mm-40 . . . . . 0 C--O 1.253 1.264 0 C-N-CA 123.369 0.668 . . . . 0.0 109.236 173.678 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.556 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 5.8 pttt . . . . . 0 N--CA 1.48 1.063 0 CA-C-O 120.859 0.361 . . . . 0.0 110.178 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.575 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.6 tmtp? -145.14 144.08 30.7 Favored 'General case' 0 CA--C 1.556 1.208 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 -178.319 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.46 ' N ' ' HD3' ' A' ' 4' ' ' LYS . 9.1 tt -130.04 136.56 49.51 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.03 1.332 . . . . 0.0 107.583 174.901 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.469 HG13 HG23 ' A' ' 61' ' ' ILE . 21.4 pt -126.76 159.67 36.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 170.658 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.604 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -149.23 166.33 29.21 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 123.001 0.52 . . . . 0.0 110.107 177.052 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.584 HD21 ' HG3' ' A' ' 41' ' ' GLN . 3.1 tt -139.3 112.16 7.91 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 -178.963 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.565 ' HA ' ' O ' ' A' ' 64' ' ' SER . 62.9 m -99.94 114.31 27.48 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.9 0.88 . . . . 0.0 109.39 175.151 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.439 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -131.04 122.82 27.44 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 122.768 0.427 . . . . 0.0 111.208 -179.165 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.759 ' SG ' HD13 ' A' ' 85' ' ' LEU . 1.2 m -134.88 148.15 65.84 Favored Pre-proline 0 N--CA 1.478 0.945 0 C-N-CA 123.844 0.858 . . . . 0.0 110.619 178.495 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -79.57 -12.49 13.8 Favored 'Trans proline' 0 C--N 1.373 1.856 0 C-N-CA 122.74 2.294 . . . . 0.0 111.243 173.729 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 45.7 mtt -65.51 -42.59 91.88 Favored 'General case' 0 C--N 1.352 0.68 0 C-N-CA 125.086 1.354 . . . . 0.0 109.746 177.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 141.94 -177.94 21.04 Favored Glycine 0 C--N 1.348 1.233 0 CA-C-N 115.483 -0.781 . . . . 0.0 111.962 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 29.9 mt -73.36 -25.04 60.43 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -177.785 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.66 -41.99 91.84 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-O 121.091 0.472 . . . . 0.0 111.049 179.505 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.532 ' ND1' HD22 ' A' ' 85' ' ' LEU . 12.9 t-80 -67.77 -42.64 81.41 Favored 'General case' 0 C--O 1.251 1.133 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.282 179.305 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.424 ' HA ' HD11 ' A' ' 85' ' ' LEU . 43.5 p -66.5 -30.4 70.72 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 115.085 -0.961 . . . . 0.0 111.214 -179.567 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 18.8 m-30 -71.12 -32.66 69.28 Favored 'General case' 0 C--N 1.351 0.639 0 C-N-CA 123.317 0.647 . . . . 0.0 110.967 179.027 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 47.6 mtm -65.65 -39.3 91.25 Favored 'General case' 0 N--CA 1.486 1.335 0 CA-C-O 120.74 0.305 . . . . 0.0 110.713 176.126 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.22 -37.65 72.02 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.417 174.508 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.54 -38.55 91.4 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.717 0.807 . . . . 0.0 110.816 179.591 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 7.6 tp-100 -68.98 -45.65 70.08 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.027 0.531 . . . . 0.0 110.173 179.042 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.488 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -59.93 -57.21 13.86 Favored 'General case' 0 C--O 1.242 0.675 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.298 -177.785 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.429 HD11 ' OG ' ' A' ' 64' ' ' SER . 94.7 mt -64.2 -32.0 73.41 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.005 0.522 . . . . 0.0 111.852 -178.58 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.536 ' HA ' HG21 ' A' ' 36' ' ' VAL . 32.4 tt0 -61.64 -56.39 20.35 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 110.121 -0.326 . . . . 0.0 110.121 -179.283 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.476 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 44.5 mm-40 -54.02 -49.07 69.73 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 124.584 1.177 . . . . 0.0 111.502 179.229 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.42 ' HB3' HD12 ' A' ' 96' ' ' ILE . . . -65.48 -36.19 83.14 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.438 0.695 . . . . 0.0 112.099 -176.603 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.93 -24.13 58.45 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.06 0.544 . . . . 0.0 111.896 177.757 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 26' ' ' GLU . 54.5 t -68.68 -41.34 82.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 174.34 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.476 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 10.0 mm-40 -70.33 -25.9 63.51 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 114.027 -1.442 . . . . 0.0 111.185 179.363 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -82.77 -2.17 53.68 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 123.474 0.71 . . . . 0.0 112.407 178.229 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 87.84 17.72 57.57 Favored Glycine 0 C--N 1.35 1.346 0 N-CA-C 115.675 1.03 . . . . 0.0 115.675 164.034 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.556 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -130.16 175.37 8.97 Favored 'General case' 0 N--CA 1.484 1.263 0 CA-C-N 117.908 0.854 . . . . 0.0 112.639 175.579 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.575 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 37.0 tt0 -72.21 149.29 44.75 Favored 'General case' 0 C--N 1.353 0.737 0 CA-C-N 114.675 -1.148 . . . . 0.0 108.95 175.435 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.536 HG21 ' HA ' ' A' ' 26' ' ' GLU . 8.1 p -133.16 135.52 56.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 122.65 0.38 . . . . 0.0 110.2 -179.553 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 49.6 tptt -142.4 113.9 7.86 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 175.246 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.604 HG12 ' HB3' ' A' ' 7' ' ' ALA . 43.1 mt -116.78 110.35 31.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 122.838 0.455 . . . . 0.0 111.699 -176.325 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -74.0 144.97 44.94 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.421 0.688 . . . . 0.0 109.192 172.739 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 10.6 p -128.9 113.89 15.8 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.772 0.829 . . . . 0.0 109.46 -177.41 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.584 ' HG3' HD21 ' A' ' 8' ' ' LEU . 8.1 mt-30 -109.82 141.42 42.52 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 177.611 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -165.35 -177.22 37.58 Favored Glycine 0 C--O 1.241 0.593 0 N-CA-C 111.836 -0.506 . . . . 0.0 111.836 179.607 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.02 -31.9 70.38 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.366 0.666 . . . . 0.0 111.271 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -66.33 -40.38 89.85 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.447 0.699 . . . . 0.0 110.951 177.291 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 150.27 -158.6 27.75 Favored Glycine 0 C--N 1.344 1.023 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.989 -176.404 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 66.1 mt -116.14 137.48 49.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 C-N-CA 123.578 0.751 . . . . 0.0 109.556 179.063 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -136.83 151.11 48.77 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.111 0.964 . . . . 0.0 109.308 -176.099 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 17.2 t30 60.61 36.27 19.77 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 124.105 0.962 . . . . 0.0 110.242 177.386 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 14.5 tpp180 -43.59 125.63 4.1 Favored 'General case' 0 C--N 1.362 1.109 0 C-N-CA 126.292 1.837 . . . . 0.0 113.269 -174.902 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 50.1 mt -77.61 128.46 34.16 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.724 171.237 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 45.2 p -96.15 165.51 12.19 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.313 -0.858 . . . . 0.0 108.843 176.057 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.95 -29.94 67.51 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 122.697 0.399 . . . . 0.0 111.463 178.081 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.2 tp-100 -62.65 -41.47 99.06 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.839 0.856 . . . . 0.0 111.508 176.632 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.4 ' HB3' HG21 ' A' ' 6' ' ' ILE . 56.5 m-20 -63.81 -45.09 91.23 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 122.98 0.512 . . . . 0.0 110.545 176.835 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 10.5 mt -69.11 -28.54 39.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 O-C-N 123.836 0.71 . . . . 0.0 110.847 -178.233 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.68 -44.97 61.12 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.721 0.808 . . . . 0.0 111.216 -179.114 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -84.24 -11.19 56.89 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.303 0.641 . . . . 0.0 111.643 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.44 100.67 0.19 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.107 0.563 . . . . 0.0 111.83 -177.554 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 32.5 m -61.9 -40.94 97.17 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.218 168.595 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.529 HG23 HG21 ' A' ' 99' ' ' ILE . 68.4 mt -128.47 140.19 49.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.239 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.469 HG23 HG13 ' A' ' 6' ' ' ILE . 20.4 mt -131.21 133.8 62.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 171.75 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.4 mp -120.7 136.05 58.96 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 173.374 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' HIS . . . . . 0.484 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 8.5 m170 -107.76 86.37 2.29 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 167.544 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.565 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 33.9 m -79.22 79.91 5.62 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 114.529 -1.214 . . . . 0.0 109.208 175.598 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 36.0 m -127.54 161.09 35.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 121.553 0.692 . . . . 0.0 112.034 -169.642 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -118.34 -17.19 9.53 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.33 1.452 . . . . 0.0 108.751 174.043 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 11.8 m -133.93 160.1 42.07 Favored 'Isoleucine or valine' 0 C--N 1.35 0.621 0 C-N-CA 125.399 1.48 . . . . 0.0 109.096 175.54 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 41.6 m -69.78 109.98 5.69 Favored Pre-proline 0 CA--C 1.554 1.115 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 174.15 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -67.13 149.36 82.02 Favored 'Trans proline' 0 C--N 1.379 2.14 0 C-N-CA 122.381 2.054 . . . . 0.0 111.455 -177.544 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.402 ' H ' ' NE2' ' A' ' 41' ' ' GLN . 6.7 mm-40 -61.64 -31.64 71.75 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.223 0.609 . . . . 0.0 111.938 -171.561 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -104.14 21.24 16.85 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.482 0.713 . . . . 0.0 111.707 -175.71 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -60.66 -28.92 68.95 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.15 0.58 . . . . 0.0 111.841 -176.497 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -58.14 -32.59 68.32 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.164 0.985 . . . . 0.0 113.264 -179.103 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 74.4 mtt-85 -61.24 -38.53 87.01 Favored 'General case' 0 N--CA 1.483 1.224 0 CA-C-O 121.944 0.878 . . . . 0.0 110.52 177.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.445 ' HB3' HG21 ' A' ' 80' ' ' VAL . 41.0 m-85 -94.97 -19.83 19.89 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 113.794 -1.548 . . . . 0.0 111.001 -172.419 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -62.18 -30.08 70.81 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.171 0.988 . . . . 0.0 111.322 -176.649 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 22.6 t -81.53 -7.22 59.56 Favored 'General case' 0 CA--C 1.554 1.109 0 C-N-CA 123.824 0.849 . . . . 0.0 111.675 178.311 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 14.5 mmt85 -116.95 169.74 9.16 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.292 1.037 . . . . 0.0 110.24 -171.196 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -78.53 96.44 5.44 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.257 0.623 . . . . 0.0 110.801 -178.19 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.445 HG21 ' HB3' ' A' ' 75' ' ' PHE . 43.0 t -119.22 142.13 35.89 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 123.837 0.855 . . . . 0.0 110.674 -177.07 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 -108.8 94.01 4.82 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 177.781 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.484 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 38.8 mt-10 -83.06 114.17 21.11 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 115.267 -0.878 . . . . 0.0 110.956 -173.954 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.452 HG13 ' HA ' ' A' ' 64' ' ' SER . 45.6 pt -125.14 -173.84 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 124.74 1.216 . . . . 0.0 109.792 -179.017 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 20.3 p -83.55 149.14 26.78 Favored 'General case' 0 C--N 1.345 0.38 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.17 168.844 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.759 HD13 ' SG ' ' A' ' 11' ' ' CYS . 7.2 tt -63.68 -32.49 73.99 Favored 'General case' 0 N--CA 1.486 1.352 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.247 178.391 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.439 ' HG2' ' HE3' ' A' ' 90' ' ' LYS . 29.8 tt0 -61.22 -43.35 99.01 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.932 175.576 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -60.55 -31.31 70.42 Favored 'General case' 0 C--N 1.359 1.017 0 O-C-N 123.857 0.723 . . . . 0.0 110.825 179.765 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.49 -40.79 89.47 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.494 0.718 . . . . 0.0 111.908 177.186 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 63.0 mt -69.65 -42.01 80.33 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.899 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.57 -176.384 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.439 ' HE3' ' HG2' ' A' ' 86' ' ' GLN . 18.2 ptpt -87.56 -46.69 9.34 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 122.823 0.449 . . . . 0.0 112.191 -176.085 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -108.48 27.17 9.64 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 124.012 0.925 . . . . 0.0 110.946 -167.194 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.488 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -43.23 -57.96 2.73 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 124.383 1.073 . . . . 0.0 113.066 -177.448 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.37 -42.93 99.8 Favored 'General case' 0 C--N 1.344 0.357 0 CA-C-N 114.696 -1.138 . . . . 0.0 110.878 178.868 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -59.11 -47.6 89.99 Favored Glycine 0 C--N 1.352 1.462 0 O-C-N 124.269 0.98 . . . . 0.0 113.153 -176.239 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 14.4 mt -62.84 -55.75 21.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 123.946 0.898 . . . . 0.0 109.647 -177.375 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.42 HD12 ' HB3' ' A' ' 28' ' ' ALA . 69.2 mt -58.92 -46.62 91.25 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 CA-C-N 114.139 -1.391 . . . . 0.0 111.357 -175.165 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.54 -31.49 69.74 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 122.63 0.372 . . . . 0.0 110.645 -178.481 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -58.48 -44.02 89.18 Favored 'General case' 0 C--N 1.366 1.303 0 C-N-CA 123.369 0.668 . . . . 0.0 109.542 173.339 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.529 HG21 HG23 ' A' ' 60' ' ' ILE . 34.2 mt -76.41 -30.64 19.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.558 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 -174.598 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -62.5 -47.27 84.7 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.252 1.021 . . . . 0.0 111.772 175.558 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -74.35 -36.49 63.62 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 123.454 0.471 . . . . 0.0 110.624 -177.168 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 6.4 mtp -66.58 -52.83 41.12 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.179 0.991 . . . . 0.0 111.136 178.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.452 HD12 HG12 ' A' ' 60' ' ' ILE . 31.0 mt -66.33 -35.35 74.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.898 177.432 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.533 ' O ' ' HG2' ' A' ' 108' ' ' GLN . . . -58.61 -45.03 90.03 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 118.072 0.396 . . . . 0.0 110.377 174.662 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 22.7 t -67.56 -35.12 78.42 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.54 0.736 . . . . 0.0 111.312 -172.275 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.432 ' HG2' ' HA ' ' A' ' 103' ' ' ILE . 9.5 pt-20 -79.1 -28.45 43.01 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 116.763 -0.199 . . . . 0.0 111.307 177.171 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.433 ' HG2' ' O ' ' A' ' 103' ' ' ILE . 13.7 mm-40 -79.34 -11.35 59.93 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 122.541 0.336 . . . . 0.0 110.957 176.477 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.533 ' HG2' ' O ' ' A' ' 104' ' ' ALA . 80.4 mm-40 . . . . . 0 C--O 1.258 1.518 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 170.227 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 40.6 pttt . . . . . 0 CA--C 1.551 1.006 0 CA-C-O 120.614 0.245 . . . . 0.0 111.53 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.553 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.6 tmtp? -144.06 131.82 21.34 Favored 'General case' 0 N--CA 1.486 1.338 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 -172.095 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.464 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 10.4 tt -126.09 138.47 53.7 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 178.498 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 20.4 pt -128.68 164.16 31.49 Favored 'Isoleucine or valine' 0 C--O 1.241 0.644 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 171.803 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.576 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -152.02 168.35 25.49 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.037 178.129 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.8 tt -141.15 114.93 9.03 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 107.058 -1.46 . . . . 0.0 107.058 -177.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.545 ' HA ' ' O ' ' A' ' 64' ' ' SER . 61.4 m -106.72 113.06 26.34 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 176.791 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.411 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -127.41 127.49 44.23 Favored 'General case' 0 N--CA 1.497 1.922 0 C-N-CA 122.482 0.313 . . . . 0.0 111.836 -175.696 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.817 ' SG ' HD13 ' A' ' 85' ' ' LEU . 50.1 m -125.21 144.78 48.47 Favored Pre-proline 0 N--CA 1.478 0.935 0 C-N-CA 124.48 1.112 . . . . 0.0 110.609 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -75.82 -14.65 19.35 Favored 'Trans proline' 0 C--N 1.37 1.695 0 C-N-CA 122.379 2.053 . . . . 0.0 112.244 173.055 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 54.8 tpp -83.46 -71.76 0.49 Allowed 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.277 0.631 . . . . 0.0 110.531 178.899 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -171.43 -175.37 39.77 Favored Glycine 0 C--N 1.347 1.178 0 C-N-CA 121.807 -0.235 . . . . 0.0 113.351 -176.141 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 60.7 mt -82.37 -17.68 44.74 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -173.804 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.0 -43.6 91.51 Favored 'General case' 0 N--CA 1.487 1.418 0 CA-C-N 119.074 0.852 . . . . 0.0 111.253 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.439 ' ND1' ' SG ' ' A' ' 11' ' ' CYS . 18.2 t-160 -66.43 -43.04 86.75 Favored 'General case' 0 C--O 1.246 0.882 0 CA-C-N 115.015 -0.993 . . . . 0.0 110.199 178.912 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 31.8 p -66.42 -30.34 70.68 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 115.072 -0.967 . . . . 0.0 111.13 -178.22 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.1 m-30 -73.55 -32.11 64.01 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.328 0.651 . . . . 0.0 111.631 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 64.4 mtm -66.41 -38.98 88.68 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-O 120.788 0.328 . . . . 0.0 110.508 173.497 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.0 -40.58 82.99 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.89 174.265 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.36 -31.07 68.18 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.831 0.853 . . . . 0.0 110.963 -178.9 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 24.1 tp60 -67.8 -49.16 63.83 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.298 0.639 . . . . 0.0 109.404 177.062 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.548 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -66.3 -50.23 64.37 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-N 114.992 -1.004 . . . . 0.0 111.675 -174.889 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.418 HD11 ' OG ' ' A' ' 64' ' ' SER . 93.1 mt -64.46 -33.0 74.87 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.129 0.572 . . . . 0.0 111.643 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.45 ' O ' HG23 ' A' ' 30' ' ' VAL . 39.1 tt0 -58.3 -58.9 6.43 Favored 'General case' 0 C--N 1.353 0.747 0 O-C-N 123.838 0.711 . . . . 0.0 109.946 175.734 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -54.16 -47.37 72.03 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 124.602 1.189 . . . . 0.0 110.847 -177.541 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.13 -49.15 78.98 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.372 1.069 . . . . 0.0 111.991 -177.688 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.42 -21.4 61.99 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 113.329 0.862 . . . . 0.0 113.329 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.45 HG23 ' O ' ' A' ' 26' ' ' GLU . 54.1 t -77.6 -43.65 29.73 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.332 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 177.698 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -64.69 -32.44 74.12 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 114.902 -1.044 . . . . 0.0 110.36 174.982 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.24 -38.85 82.27 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.352 1.061 . . . . 0.0 111.344 175.946 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 109.32 22.17 6.93 Favored Glycine 0 C--N 1.342 0.908 0 CA-C-N 115.289 -0.869 . . . . 0.0 114.092 173.163 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.435 ' OH ' ' HG2' ' A' ' 100' ' ' GLU . 1.8 m-85 -95.63 162.95 13.4 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 117.974 0.887 . . . . 0.0 109.84 171.833 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.553 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 40.5 tt0 -75.98 122.82 24.76 Favored 'General case' 0 C--O 1.222 -0.361 0 N-CA-C 106.581 -1.637 . . . . 0.0 106.581 158.499 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.464 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 13.6 p -110.68 136.27 47.21 Favored 'Isoleucine or valine' 0 C--O 1.241 0.617 0 CA-C-N 118.173 0.442 . . . . 0.0 110.195 -173.16 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.1 tptt -143.77 113.84 7.3 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 178.003 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.576 HG12 ' HB3' ' A' ' 7' ' ' ALA . 38.1 mt -117.78 111.7 35.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 122.727 0.411 . . . . 0.0 111.488 -175.433 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -75.53 140.48 42.78 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.648 0.779 . . . . 0.0 109.193 169.992 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.401 HG22 ' HB2' ' A' ' 9' ' ' CYS . 19.8 p -123.38 121.94 37.05 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 123.642 0.777 . . . . 0.0 108.945 -179.494 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.515 HE22 ' HB2' ' A' ' 70' ' ' GLU . 41.1 mt-30 -116.18 151.96 34.66 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.396 0.679 . . . . 0.0 110.365 -178.565 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 179.74 178.33 48.39 Favored Glycine 0 C--N 1.336 0.547 0 CA-C-N 116.106 -0.497 . . . . 0.0 112.897 177.995 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.47 -25.87 68.46 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.53 0.732 . . . . 0.0 111.067 176.373 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -70.89 -36.08 72.59 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.821 0.848 . . . . 0.0 110.838 175.863 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 150.21 -162.47 29.24 Favored Glycine 0 C--N 1.349 1.26 0 CA-C-N 116.109 -0.496 . . . . 0.0 112.604 179.489 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 68.4 mt -120.87 136.86 56.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 124.009 0.924 . . . . 0.0 109.299 174.641 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -134.94 148.33 50.01 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.075 0.95 . . . . 0.0 109.244 -177.982 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 9.5 t30 61.92 42.75 9.9 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.501 1.12 . . . . 0.0 110.526 175.875 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -45.69 128.73 8.75 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 125.794 1.638 . . . . 0.0 113.686 -175.618 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 44.1 mt -80.47 136.86 36.4 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.583 1.153 . . . . 0.0 110.778 172.51 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 64.7 p -100.75 172.38 7.11 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.805 0.842 . . . . 0.0 110.375 179.811 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.75 -35.11 72.21 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.017 0.527 . . . . 0.0 111.201 174.403 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -58.94 -51.73 68.81 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.841 0.857 . . . . 0.0 111.112 175.115 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.437 ' O ' ' HB2' ' A' ' 58' ' ' ALA . 75.8 m-20 -59.9 -41.54 91.88 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.237 -175.499 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.441 HG22 ' HG3' ' A' ' 78' ' ' ARG . 50.6 mt -73.58 -42.96 55.52 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.243 0 C-N-CA 123.409 0.683 . . . . 0.0 111.676 -177.856 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.4 -39.4 71.18 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.215 0.606 . . . . 0.0 111.88 -173.978 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -93.02 -1.56 56.5 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.18 0.592 . . . . 0.0 111.549 -177.797 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.437 ' HB2' ' O ' ' A' ' 54' ' ' ASP . . . -64.45 110.11 2.17 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.056 0.542 . . . . 0.0 111.486 177.587 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 26.4 m -60.75 -37.77 82.91 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.083 0.953 . . . . 0.0 109.76 168.843 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.414 HD12 HD12 ' A' ' 5' ' ' LEU . 59.3 mt -134.47 144.65 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 C-N-CA 123.323 0.649 . . . . 0.0 110.857 177.208 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 21.6 mt -131.37 131.42 63.14 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 C-N-CA 124.07 0.948 . . . . 0.0 109.043 169.168 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -120.1 123.44 70.72 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 174.531 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' HIS . . . . . 0.534 ' HB2' ' HG3' ' A' ' 82' ' ' GLU . 18.1 m170 -97.62 84.06 3.33 Favored 'General case' 0 N--CA 1.488 1.457 0 CA-C-N 119.153 0.888 . . . . 0.0 109.736 170.75 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.545 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 28.4 m -79.25 82.83 5.36 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 114.649 -1.159 . . . . 0.0 109.535 175.15 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 32.1 m -127.43 158.1 38.87 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-O 121.379 0.609 . . . . 0.0 111.892 -170.395 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -103.86 -29.33 11.05 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.351 1.061 . . . . 0.0 109.037 174.749 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 13.6 m -131.62 169.11 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 125.066 1.346 . . . . 0.0 108.697 176.559 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 31.9 m -61.34 119.7 48.62 Favored Pre-proline 0 CA--C 1.551 1.014 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 174.469 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -68.23 151.53 76.65 Favored 'Trans proline' 0 C--N 1.373 1.829 0 C-N-CA 122.342 2.028 . . . . 0.0 110.643 173.872 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.515 ' HB2' HE22 ' A' ' 41' ' ' GLN . 10.2 mm-40 -63.46 -42.87 98.63 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-O 121.734 0.778 . . . . 0.0 109.84 -176.7 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -91.01 21.97 3.94 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 114.809 -1.087 . . . . 0.0 112.402 -173.528 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.413 ' HA ' ' HE1' ' A' ' 63' ' ' HIS . 7.1 p30 -56.01 -33.22 64.67 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.037 0.935 . . . . 0.0 112.613 -177.166 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.96 -18.32 50.7 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.944 0.898 . . . . 0.0 112.64 -174.836 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 3.7 mtp85 -67.01 -28.99 68.7 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-O 121.419 0.628 . . . . 0.0 110.705 176.422 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 47.1 m-85 -97.99 -5.51 33.95 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.235 1.014 . . . . 0.0 111.488 -174.928 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -60.12 -33.68 72.47 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.937 0.895 . . . . 0.0 111.898 -175.85 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 34.5 p -70.96 -13.37 61.99 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.82 0.848 . . . . 0.0 112.621 179.685 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.441 ' HG3' HG22 ' A' ' 55' ' ' ILE . 31.5 mmt180 -117.61 177.99 4.55 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 124.074 0.95 . . . . 0.0 111.185 -174.392 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -89.16 100.95 13.63 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.918 0.887 . . . . 0.0 110.402 -177.677 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 38.4 t -106.97 149.78 10.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.054 -179.51 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -125.09 90.75 3.29 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 124.133 0.973 . . . . 0.0 108.46 178.082 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.534 ' HG3' ' HB2' ' A' ' 63' ' ' HIS . 1.8 mp0 -78.0 131.88 37.57 Favored 'General case' 0 C--N 1.355 0.847 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.651 -178.131 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.522 HD12 ' HB3' ' A' ' 87' ' ' ASP . 37.3 pt -141.45 -172.5 0.59 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.765 0 C-N-CA 125.58 1.552 . . . . 0.0 107.786 179.315 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 32.0 p -83.03 152.54 25.35 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 121.129 0.49 . . . . 0.0 110.077 168.702 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.817 HD13 ' SG ' ' A' ' 11' ' ' CYS . 6.7 tt -65.91 -29.37 69.78 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.192 177.281 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.435 ' O ' ' HG2' ' A' ' 90' ' ' LYS . 29.7 tt0 -64.79 -39.45 93.62 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.049 0.54 . . . . 0.0 110.581 174.965 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.522 ' HB3' HD12 ' A' ' 83' ' ' ILE . 7.5 t70 -59.47 -32.85 70.63 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 124.106 0.962 . . . . 0.0 110.797 178.729 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.413 ' HB2' ' HB3' ' A' ' 64' ' ' SER . . . -66.03 -39.36 90.14 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.417 0.687 . . . . 0.0 112.106 177.194 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 75.3 mt -70.7 -43.07 77.73 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.84 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.724 -177.776 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.435 ' HG2' ' O ' ' A' ' 86' ' ' GLN . 0.2 OUTLIER -91.68 -44.21 9.15 Favored 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -173.169 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -106.52 22.8 15.24 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.845 0.858 . . . . 0.0 110.829 -169.939 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.548 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -42.3 -60.93 1.31 Allowed 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 124.071 0.948 . . . . 0.0 112.991 -175.81 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.63 -38.32 84.38 Favored 'General case' 0 C--N 1.348 0.506 0 CA-C-N 115.201 -0.909 . . . . 0.0 111.005 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -61.84 -50.2 68.29 Favored Glycine 0 C--N 1.353 1.482 0 O-C-N 124.415 1.072 . . . . 0.0 112.803 -177.354 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 17.2 mt -54.4 -58.01 4.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 124.228 1.011 . . . . 0.0 110.415 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.468 ' O ' ' HG3' ' A' ' 100' ' ' GLU . 2.1 mp -57.36 -54.68 27.61 Favored 'Isoleucine or valine' 0 C--N 1.36 1.028 0 O-C-N 124.391 1.057 . . . . 0.0 110.81 -175.813 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.28 -29.86 70.72 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -175.203 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -67.41 -39.0 85.49 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.402 0.681 . . . . 0.0 110.355 177.514 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 28.1 mt -75.71 -35.96 32.38 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.468 ' HG3' ' O ' ' A' ' 96' ' ' ILE . 28.4 mt-10 -60.31 -46.3 90.38 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.867 178.327 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -72.31 -31.02 65.33 Favored 'General case' 0 N--CA 1.48 1.03 0 O-C-N 123.594 0.559 . . . . 0.0 111.299 -177.039 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 71.0 mtm -64.4 -48.17 76.42 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-O 120.786 0.327 . . . . 0.0 110.584 173.96 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 63.9 mt -63.5 -46.17 95.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.038 176.94 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.24 -20.28 64.8 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.22 0.608 . . . . 0.0 111.627 -177.277 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 38.2 t -76.73 -41.33 45.49 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 122.65 0.38 . . . . 0.0 110.2 177.588 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -81.83 -21.59 37.53 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 122.925 0.49 . . . . 0.0 112.267 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 22.9 mm-40 -81.67 -47.66 12.7 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.311 0.644 . . . . 0.0 110.013 176.192 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 71.6 mm-40 . . . . . 0 C--O 1.251 1.16 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.988 -174.92 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 41.9 pttt . . . . . 0 N--CA 1.481 1.081 0 CA-C-O 120.987 0.422 . . . . 0.0 111.298 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.598 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.1 tmtp? -147.52 135.13 20.93 Favored 'General case' 0 CA--C 1.557 1.212 0 CA-C-O 121.291 0.567 . . . . 0.0 109.625 -173.647 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.453 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 10.1 tt -128.56 138.72 52.37 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.551 1.14 . . . . 0.0 108.339 178.007 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.511 HD12 HD13 ' A' ' 50' ' ' LEU . 20.2 pt -128.78 167.8 23.33 Favored 'Isoleucine or valine' 0 C--O 1.241 0.641 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 172.163 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.633 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -154.55 169.14 24.53 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.156 177.317 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.404 ' HA ' ' O ' ' A' ' 39' ' ' GLU . 4.6 tt -140.23 116.45 10.55 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 177.649 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.533 ' HA ' ' O ' ' A' ' 64' ' ' SER . 77.9 m -106.18 115.08 29.6 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 177.347 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.421 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -129.65 116.77 19.33 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 122.819 0.448 . . . . 0.0 111.542 -175.652 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.702 ' SG ' HD13 ' A' ' 85' ' ' LEU . 1.7 m -124.84 143.14 42.89 Favored Pre-proline 0 N--CA 1.479 1.017 0 C-N-CA 124.495 1.118 . . . . 0.0 109.471 175.479 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -77.2 -7.08 16.99 Favored 'Trans proline' 0 C--N 1.375 1.947 0 C-N-CA 122.561 2.174 . . . . 0.0 112.486 -178.479 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 58.3 mtt -79.78 -49.19 12.37 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.353 1.061 . . . . 0.0 110.038 -178.579 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 162.03 -168.63 37.15 Favored Glycine 0 C--N 1.343 0.93 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.679 -178.038 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 60.4 mt -82.96 -17.72 42.53 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 113.364 0.876 . . . . 0.0 113.364 -176.395 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.28 -45.09 95.93 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-O 121.482 0.658 . . . . 0.0 111.205 -178.654 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.2 t-160 -65.55 -40.87 93.33 Favored 'General case' 0 C--O 1.247 0.939 0 CA-C-N 114.646 -1.161 . . . . 0.0 110.214 -179.127 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 52.6 p -72.18 -31.79 66.25 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 114.402 -1.272 . . . . 0.0 111.027 -176.483 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 15.6 m-30 -68.92 -31.95 71.22 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.127 0.571 . . . . 0.0 111.043 178.197 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 54.5 mtm -67.76 -40.92 84.03 Favored 'General case' 0 N--CA 1.486 1.341 0 O-C-N 123.378 0.424 . . . . 0.0 110.883 174.872 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.97 -37.84 84.98 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.933 174.846 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.51 -38.98 81.41 Favored 'General case' 0 C--O 1.217 -0.653 0 C-N-CA 123.923 0.889 . . . . 0.0 110.797 179.257 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -63.69 -43.35 96.9 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.685 0.794 . . . . 0.0 110.158 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.662 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -61.05 -58.32 8.89 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 114.727 -1.124 . . . . 0.0 111.601 179.531 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 95.8 mt -66.92 -30.9 71.17 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.143 0.577 . . . . 0.0 112.164 -176.293 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.507 ' O ' HG23 ' A' ' 30' ' ' VAL . 36.7 tt0 -62.01 -61.29 2.59 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.062 0.545 . . . . 0.0 109.751 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.548 ' O ' ' HG3' ' A' ' 31' ' ' GLU . 16.5 mm-40 -51.01 -51.94 47.91 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 124.71 1.256 . . . . 0.0 111.661 179.754 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -62.85 -40.18 96.65 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.775 0.83 . . . . 0.0 112.572 -174.841 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.17 -27.91 61.05 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 122.895 0.478 . . . . 0.0 112.202 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.507 HG23 ' O ' ' A' ' 26' ' ' GLU . 77.7 t -64.1 -44.69 97.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 175.563 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.548 ' HG3' ' O ' ' A' ' 27' ' ' GLU . 18.9 mt-10 -70.23 -32.37 70.21 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 114.755 -1.111 . . . . 0.0 110.4 -179.555 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.78 -17.89 61.54 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.688 0.795 . . . . 0.0 111.636 176.774 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.81 22.17 11.34 Favored Glycine 0 C--N 1.346 1.114 0 N-CA-C 115.157 0.823 . . . . 0.0 115.157 165.018 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.438 ' CE2' HD12 ' A' ' 60' ' ' ILE . 0.0 OUTLIER -104.04 173.09 6.45 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-N 118.189 0.995 . . . . 0.0 110.522 172.159 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.598 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 43.2 tt0 -83.2 123.65 29.77 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 106.83 -1.544 . . . . 0.0 106.83 157.745 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.453 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 9.5 p -109.12 135.78 46.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 122.931 0.492 . . . . 0.0 110.247 -174.945 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 47.9 tptt -145.46 116.21 7.72 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 179.124 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.633 HG12 ' HB3' ' A' ' 7' ' ' ALA . 42.5 mt -120.19 110.92 30.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 122.896 0.478 . . . . 0.0 111.846 -172.587 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.404 ' O ' ' HA ' ' A' ' 8' ' ' LEU . 39.6 tt0 -79.38 118.89 21.69 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.401 0.68 . . . . 0.0 109.819 175.619 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 34.8 p -96.78 133.11 41.77 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.035 177.315 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.454 ' HG2' HG12 ' A' ' 46' ' ' ILE . 42.6 mt-30 -126.88 141.3 51.85 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.098 0.959 . . . . 0.0 109.537 178.307 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -173.33 177.97 45.49 Favored Glycine 0 C--N 1.335 0.524 0 CA-C-N 116.769 -0.196 . . . . 0.0 113.031 179.525 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.18 -25.94 67.37 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.899 0.88 . . . . 0.0 111.885 178.04 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -75.18 -33.54 61.47 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.74 0.816 . . . . 0.0 111.298 178.937 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 156.39 -160.52 30.25 Favored Glycine 0 C--N 1.348 1.207 0 O-C-N 123.371 0.42 . . . . 0.0 112.481 179.64 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.458 HG21 ' NH1' ' A' ' 49' ' ' ARG . 73.1 mt -127.12 135.27 64.04 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.244 0 C-N-CA 123.82 0.848 . . . . 0.0 108.885 172.178 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -136.95 155.0 50.29 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.205 0.602 . . . . 0.0 110.474 -175.662 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 20.4 t30 60.93 36.76 18.7 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.704 1.202 . . . . 0.0 110.15 177.144 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.458 ' NH1' HG21 ' A' ' 46' ' ' ILE . 19.1 tpp180 -48.66 123.23 6.5 Favored 'General case' 0 C--N 1.361 1.106 0 C-N-CA 125.157 1.383 . . . . 0.0 112.103 -174.747 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.511 HD13 HD12 ' A' ' 6' ' ' ILE . 39.8 mt -70.32 140.37 52.23 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 114.786 -1.097 . . . . 0.0 110.544 173.316 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.455 ' O ' HG13 ' A' ' 55' ' ' ILE . 52.9 p -94.84 161.04 14.33 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 172.557 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.11 -25.21 66.82 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 122.449 0.3 . . . . 0.0 110.813 174.418 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -65.88 -45.61 81.42 Favored 'General case' 0 C--N 1.354 0.791 0 O-C-N 124.035 0.834 . . . . 0.0 110.485 173.481 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 -57.86 -44.55 86.65 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.181 0.592 . . . . 0.0 110.943 176.421 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.575 HD11 HH21 ' A' ' 74' ' ' ARG . 12.5 mt -71.91 -29.78 34.65 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 O-C-N 124.106 0.879 . . . . 0.0 110.738 -176.049 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.78 -46.24 46.78 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.345 0.658 . . . . 0.0 110.828 177.832 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -67.26 -27.67 67.4 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.855 0.862 . . . . 0.0 111.553 178.186 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -56.19 99.04 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.514 0 O-C-N 124.476 1.11 . . . . 0.0 112.255 -175.074 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 29.1 m -60.99 -37.94 84.26 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 114.553 -1.203 . . . . 0.0 109.237 168.708 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.438 HD12 ' CE2' ' A' ' 34' ' ' TYR . 83.9 mt -134.22 140.18 46.61 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 C-N-CA 123.854 0.862 . . . . 0.0 110.262 179.805 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.43 HG23 HG13 ' A' ' 6' ' ' ILE . 24.9 mt -129.02 137.18 57.86 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 175.512 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.8 mp -128.4 113.09 28.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 CA-C-N 118.567 0.621 . . . . 0.0 110.104 175.362 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 6.1 m170 -88.24 86.08 7.02 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 121.388 0.614 . . . . 0.0 109.781 173.845 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.533 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 19.0 m -78.71 79.48 5.13 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 114.67 -1.15 . . . . 0.0 109.52 175.824 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.416 ' O ' ' HA ' ' A' ' 84' ' ' THR . 35.9 m -124.98 157.07 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 CA-C-O 121.869 0.842 . . . . 0.0 111.858 -170.265 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -112.59 -16.42 12.84 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 114.318 -1.31 . . . . 0.0 109.053 173.898 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 19.2 m -130.4 168.55 23.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 125.604 1.561 . . . . 0.0 109.234 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 64.9 m -78.61 112.95 30.53 Favored Pre-proline 0 CA--C 1.546 0.824 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 170.327 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.433 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 37.6 Cg_endo -63.76 150.26 88.86 Favored 'Trans proline' 0 C--N 1.376 2.009 0 C-N-CA 122.757 2.305 . . . . 0.0 112.367 -177.657 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -67.11 -23.98 65.88 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.176 0.59 . . . . 0.0 110.858 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -102.58 15.6 28.79 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.268 -0.878 . . . . 0.0 112.202 -177.825 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.433 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 25.6 t30 -53.35 -38.7 63.51 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.742 0.817 . . . . 0.0 111.777 179.482 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.55 -30.29 71.2 Favored 'General case' 0 N--CA 1.482 1.156 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 -176.595 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.575 HH21 HD11 ' A' ' 55' ' ' ILE . 43.5 mtp180 -62.55 -39.36 93.38 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-O 121.385 0.612 . . . . 0.0 111.842 174.555 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -97.37 -8.46 29.49 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.392 -175.76 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -64.63 -33.32 75.67 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.257 1.023 . . . . 0.0 111.115 -177.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 64.2 p -75.15 -17.13 60.46 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.656 0.782 . . . . 0.0 111.847 177.079 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.448 ' HG3' HG22 ' A' ' 55' ' ' ILE . 25.2 mmt180 -104.03 160.17 15.06 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.092 0.957 . . . . 0.0 111.091 -170.922 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -77.01 101.41 6.01 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.137 0.575 . . . . 0.0 110.145 174.829 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 80.9 t -111.9 138.7 39.65 Favored 'Isoleucine or valine' 0 C--O 1.238 0.493 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.395 -179.405 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -98.98 89.46 4.29 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 172.663 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -82.3 128.09 33.87 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.221 -176.363 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.529 HD12 ' HB3' ' A' ' 87' ' ' ASP . 47.2 pt -133.13 -171.78 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 C-N-CA 124.674 1.19 . . . . 0.0 108.953 178.773 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' THR . . . . . 0.416 ' HA ' ' O ' ' A' ' 65' ' ' VAL . 18.0 p -86.55 151.43 23.48 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 122.638 0.375 . . . . 0.0 110.262 168.554 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.702 HD13 ' SG ' ' A' ' 11' ' ' CYS . 6.4 tt -63.59 -30.76 71.83 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.59 178.617 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.466 ' HG2' ' HE2' ' A' ' 90' ' ' LYS . 9.4 tt0 -63.44 -41.61 98.67 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.49 175.531 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.529 ' HB3' HD12 ' A' ' 83' ' ' ILE . 8.8 t70 -61.53 -31.43 71.45 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.713 0.805 . . . . 0.0 111.097 -178.874 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.2 -45.43 88.34 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.262 0.625 . . . . 0.0 111.259 175.829 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 74.1 mt -67.05 -43.09 89.12 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.959 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.936 -176.842 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.466 ' HE2' ' HG2' ' A' ' 86' ' ' GLN . 0.2 OUTLIER -86.55 -38.25 17.36 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -174.981 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -119.62 30.89 6.83 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 122.943 0.497 . . . . 0.0 110.856 -166.277 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.662 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -45.68 -61.22 1.8 Allowed 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 123.817 0.847 . . . . 0.0 113.015 -176.352 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -58.03 -46.36 85.45 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.464 175.199 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' GLY . . . . . 0.44 ' O ' ' HG2' ' A' ' 98' ' ' GLU . . . -54.97 -45.27 81.83 Favored Glycine 0 C--N 1.356 1.639 0 O-C-N 124.662 1.226 . . . . 0.0 113.931 -174.942 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 14.1 mt -62.61 -57.42 12.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 123.813 0.845 . . . . 0.0 109.378 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 96.5 mt -59.95 -44.85 95.43 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 CA-C-N 114.031 -1.44 . . . . 0.0 111.415 -172.759 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.69 -31.56 71.61 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.058 0.543 . . . . 0.0 111.936 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' A' ' 94' ' ' GLY . 51.4 mm-40 -63.85 -36.78 85.03 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 123.471 0.482 . . . . 0.0 110.2 176.138 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 16.0 mt -81.07 -32.39 12.42 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 -178.552 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -57.63 -50.89 71.65 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.448 1.099 . . . . 0.0 111.151 173.466 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -72.71 -35.09 67.52 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 123.647 0.592 . . . . 0.0 111.028 -176.83 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 64.4 mtm -63.47 -46.0 88.2 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 122.544 0.338 . . . . 0.0 110.43 177.549 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.426 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 19.7 mt -67.17 -40.85 86.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 O-C-N 123.631 0.582 . . . . 0.0 110.199 177.048 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.91 -24.72 67.61 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 122.933 0.493 . . . . 0.0 111.785 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 22.3 t -91.11 -33.43 15.46 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.087 0.555 . . . . 0.0 110.784 -176.111 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' GLU . . . . . 0.426 ' HG2' ' HA ' ' A' ' 103' ' ' ILE . 13.2 pt-20 -81.42 -28.78 34.11 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 122.775 0.43 . . . . 0.0 110.876 -179.489 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 87.0 mm-40 -79.76 -36.46 37.17 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.031 0.533 . . . . 0.0 110.157 175.75 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 65.7 mm-40 . . . . . 0 CA--C 1.552 1.045 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 178.42 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.252 1.209 0 CA-C-O 121.424 0.63 . . . . 0.0 110.423 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.55 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.1 tmtp? -145.51 137.29 25.34 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 -178.783 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.413 ' N ' ' HD3' ' A' ' 4' ' ' LYS . 9.4 tt -122.88 135.2 54.43 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.651 1.18 . . . . 0.0 108.064 175.139 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.473 HG21 ' HB3' ' A' ' 54' ' ' ASP . 18.9 pt -125.92 160.96 32.08 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 170.283 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.615 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -149.68 164.47 35.13 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.934 176.681 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.5 tt -138.0 110.35 7.42 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 107.439 -1.319 . . . . 0.0 107.439 -177.335 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.525 ' HA ' ' O ' ' A' ' 64' ' ' SER . 60.2 m -99.18 107.5 19.86 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.065 0.946 . . . . 0.0 109.568 176.227 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -121.78 124.43 44.18 Favored 'General case' 0 N--CA 1.492 1.657 0 C-N-CA 122.566 0.346 . . . . 0.0 111.455 -177.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.792 ' SG ' HD13 ' A' ' 85' ' ' LEU . 36.9 m -127.76 146.27 58.17 Favored Pre-proline 0 N--CA 1.48 1.033 0 C-N-CA 123.847 0.859 . . . . 0.0 111.172 177.222 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -86.92 -13.78 4.49 Favored 'Trans proline' 0 C--N 1.369 1.629 0 C-N-CA 122.971 2.447 . . . . 0.0 111.984 168.825 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 23.0 mmt -79.54 -58.41 3.21 Favored 'General case' 0 C--N 1.355 0.813 0 C-N-CA 124.11 0.964 . . . . 0.0 110.298 -175.645 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -179.12 162.35 29.17 Favored Glycine 0 C--N 1.347 1.194 0 CA-C-N 115.564 -0.744 . . . . 0.0 112.77 -178.228 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 37.2 mt -70.81 -18.35 62.74 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.81 0.844 . . . . 0.0 111.714 178.768 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.42 -43.89 79.83 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-O 121.036 0.446 . . . . 0.0 110.903 174.375 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.461 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 3.9 t-160 -67.87 -41.7 82.45 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.234 -178.991 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.407 ' HA ' HD11 ' A' ' 85' ' ' LEU . 42.7 p -67.1 -36.33 81.72 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.429 -177.854 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.3 m-30 -72.45 -35.02 68.17 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.091 0.556 . . . . 0.0 111.394 -177.364 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 60.3 mtm -67.96 -35.82 79.03 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-O 120.592 0.234 . . . . 0.0 110.601 176.265 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -69.82 -41.56 74.82 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.386 0.674 . . . . 0.0 111.198 173.906 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.35 -39.76 89.38 Favored 'General case' 0 C--O 1.218 -0.571 0 C-N-CA 123.81 0.844 . . . . 0.0 110.899 -177.909 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -70.55 -41.49 72.41 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 123.624 0.578 . . . . 0.0 109.903 -179.369 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.554 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -62.89 -52.24 63.84 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.434 -178.919 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 82.9 mt -65.1 -33.42 75.98 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.319 0.647 . . . . 0.0 111.501 178.283 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.474 ' O ' HG23 ' A' ' 30' ' ' VAL . 40.1 tt0 -60.42 -58.39 8.72 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 123.973 0.796 . . . . 0.0 110.587 179.55 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.536 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 29.8 mm-40 -53.65 -48.38 69.45 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 124.387 1.055 . . . . 0.0 111.119 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -57.68 -46.6 84.06 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 124.043 0.839 . . . . 0.0 111.789 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.56 -28.56 67.06 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 123.721 0.808 . . . . 0.0 113.08 178.051 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 26' ' ' GLU . 42.9 t -70.2 -40.15 77.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.83 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.536 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 8.0 mm-40 -70.85 -24.59 62.55 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 114.635 -1.166 . . . . 0.0 111.297 178.816 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -77.77 -7.33 56.41 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.36 0.664 . . . . 0.0 111.964 177.95 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 83.69 24.69 49.0 Favored Glycine 0 C--N 1.351 1.389 0 N-CA-C 114.668 0.627 . . . . 0.0 114.668 165.666 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -128.96 178.76 6.16 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-N 117.328 0.564 . . . . 0.0 111.311 173.107 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.55 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 41.2 tt0 -78.5 140.36 38.59 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.325 178.746 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.43 HG21 ' HA ' ' A' ' 26' ' ' GLU . 13.9 p -120.33 143.63 31.61 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 122.88 0.472 . . . . 0.0 110.204 178.648 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 49.3 tptt -149.3 115.86 5.87 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 173.684 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.615 HG12 ' HB3' ' A' ' 7' ' ' ALA . 51.0 mt -121.03 114.57 43.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -176.832 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.431 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 34.7 tt0 -75.71 143.22 42.21 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.089 0.956 . . . . 0.0 109.167 171.763 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.492 HG22 ' HB2' ' A' ' 9' ' ' CYS . 1.9 p -127.93 103.54 7.31 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.087 0.555 . . . . 0.0 110.2 -179.132 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -94.56 137.56 33.53 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 122.852 0.461 . . . . 0.0 110.373 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -156.2 169.13 33.69 Favored Glycine 0 C--N 1.337 0.592 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.467 176.939 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.03 -29.36 69.67 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.545 0.738 . . . . 0.0 111.614 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -71.91 -39.35 69.58 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.036 0.935 . . . . 0.0 110.535 177.092 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 161.28 -177.55 37.57 Favored Glycine 0 C--N 1.345 1.066 0 CA-C-N 115.949 -0.569 . . . . 0.0 112.643 -178.334 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 73.6 mt -111.52 122.44 65.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 123.783 0.833 . . . . 0.0 110.08 179.175 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.441 ' HB3' ' OG1' ' A' ' 40' ' ' THR . 6.5 tp-100 -105.47 147.01 28.77 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.476 1.11 . . . . 0.0 110.688 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 17.8 t30 79.06 -51.92 0.44 Allowed 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 126.734 2.014 . . . . 0.0 111.582 172.455 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 21.6 tpp180 63.57 121.63 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.686 1.594 . . . . 0.0 113.549 173.088 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.431 ' HG ' ' HB2' ' A' ' 39' ' ' GLU . 45.1 mt -82.25 127.96 33.71 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.458 172.396 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.401 ' O ' HG13 ' A' ' 55' ' ' ILE . 43.8 p -90.2 160.74 16.06 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.039 176.475 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.24 -27.03 66.88 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 122.848 0.459 . . . . 0.0 111.481 177.088 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -69.29 -40.15 77.89 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.73 0.812 . . . . 0.0 111.113 175.16 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.473 ' HB3' HG21 ' A' ' 6' ' ' ILE . 53.7 m-20 -58.32 -47.75 82.72 Favored 'General case' 0 N--CA 1.483 1.212 0 O-C-N 123.35 0.406 . . . . 0.0 110.249 174.421 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.522 HG22 ' HG3' ' A' ' 78' ' ' ARG . 24.8 mt -68.47 -29.64 44.76 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.069 0 O-C-N 124.618 1.199 . . . . 0.0 111.024 -177.684 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.445 ' HA ' HH21 ' A' ' 78' ' ' ARG . . . -71.68 -49.05 43.2 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.68 0.792 . . . . 0.0 111.552 179.458 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -84.82 -12.54 53.37 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.421 0.688 . . . . 0.0 112.157 -175.938 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.9 99.0 0.11 Allowed 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.546 0.739 . . . . 0.0 111.834 -178.33 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 25.2 m -61.59 -34.86 76.35 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 124.268 1.027 . . . . 0.0 109.797 170.682 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.561 HG23 HG21 ' A' ' 99' ' ' ILE . 81.5 mt -130.45 138.14 54.51 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 C-N-CA 124.416 1.087 . . . . 0.0 109.61 179.55 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.401 HG23 HG13 ' A' ' 6' ' ' ILE . 34.8 mt -133.06 132.27 58.81 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.358 0 C-N-CA 123.721 0.809 . . . . 0.0 108.821 174.81 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -121.14 117.01 51.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 174.917 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 9.9 m170 -90.84 84.52 5.83 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-N 118.879 0.763 . . . . 0.0 108.972 170.01 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.525 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 20.7 p -83.22 81.83 8.53 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 114.674 -1.148 . . . . 0.0 108.763 176.905 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 34.8 m -128.57 158.31 40.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 CA-C-O 121.699 0.762 . . . . 0.0 111.957 -168.661 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -111.71 -11.9 13.93 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.013 1.325 . . . . 0.0 109.363 172.898 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 11.5 m -135.47 151.73 30.59 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 125.397 1.479 . . . . 0.0 108.909 178.574 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 25.6 m -65.3 110.79 4.77 Favored Pre-proline 0 CA--C 1.55 0.976 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 173.087 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -62.66 153.3 72.91 Favored 'Trans proline' 0 C--N 1.379 2.137 0 C-N-CA 122.342 2.028 . . . . 0.0 112.912 -174.005 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -76.58 -25.4 53.93 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.444 0.698 . . . . 0.0 111.001 -177.236 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -96.02 10.43 37.48 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.813 0.845 . . . . 0.0 111.252 179.127 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.5 -32.95 69.29 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 124.074 0.95 . . . . 0.0 111.354 -174.984 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.421 ' HA ' ' HB2' ' A' ' 76' ' ' GLU . 0.4 OUTLIER -65.66 -24.87 67.12 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.154 0.581 . . . . 0.0 112.359 178.777 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 77.3 mtt180 -70.5 -23.37 62.65 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.254 0.622 . . . . 0.0 111.646 173.194 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.416 ' HB3' HG21 ' A' ' 80' ' ' VAL . 56.8 m-85 -105.37 2.43 28.77 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.148 0.979 . . . . 0.0 111.301 -179.501 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.421 ' HB2' ' HA ' ' A' ' 73' ' ' GLU . 29.2 tt0 -61.61 -50.39 72.77 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.876 0.87 . . . . 0.0 111.909 -172.446 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 69.7 p -82.71 0.26 44.22 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.054 0.541 . . . . 0.0 111.841 -178.651 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.522 ' HG3' HG22 ' A' ' 55' ' ' ILE . 15.8 mmt180 -102.4 149.32 24.48 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.634 0.774 . . . . 0.0 110.71 176.343 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -79.37 92.28 5.17 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.712 0.805 . . . . 0.0 110.624 -178.54 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.416 HG21 ' HB3' ' A' ' 75' ' ' PHE . 45.1 t -98.49 144.79 10.98 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.788 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.096 -179.728 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 -102.45 92.2 4.58 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.82 1.248 . . . . 0.0 107.858 174.61 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -83.16 121.62 27.31 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.579 0.752 . . . . 0.0 110.708 -175.306 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.498 HG13 ' HA ' ' A' ' 64' ' ' SER . 43.9 pt -130.55 -177.59 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 124.675 1.19 . . . . 0.0 109.25 177.391 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 18.5 p -83.79 149.28 26.53 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 167.479 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.792 HD13 ' SG ' ' A' ' 11' ' ' CYS . 7.7 tt -63.09 -29.22 70.63 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.358 0.663 . . . . 0.0 111.816 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.555 ' HG2' ' HE3' ' A' ' 90' ' ' LYS . 29.4 tt0 -60.22 -41.78 93.79 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.445 0.698 . . . . 0.0 110.755 175.072 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.459 ' HB3' HD12 ' A' ' 83' ' ' ILE . 24.1 t70 -63.18 -32.46 73.86 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.674 0.79 . . . . 0.0 110.728 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.403 ' HB2' ' HB2' ' A' ' 64' ' ' SER . . . -63.74 -29.9 71.06 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.749 0.82 . . . . 0.0 112.697 179.132 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 65.8 mt -83.54 -54.0 10.08 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 C-N-CA 123.603 0.761 . . . . 0.0 110.062 -178.468 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.555 ' HE3' ' HG2' ' A' ' 86' ' ' GLN . 18.5 ptpt -72.8 -45.4 58.68 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.117 0.567 . . . . 0.0 112.33 -175.256 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -108.61 24.07 13.6 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.185 0.994 . . . . 0.0 110.594 -169.913 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.554 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -41.73 -62.2 0.94 Allowed 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.286 1.034 . . . . 0.0 113.672 -175.935 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.35 -36.29 83.2 Favored 'General case' 0 C--N 1.34 0.179 0 CA-C-N 114.922 -1.036 . . . . 0.0 110.806 179.862 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -61.07 -48.06 88.0 Favored Glycine 0 C--N 1.354 1.546 0 O-C-N 124.703 1.252 . . . . 0.0 112.526 -178.3 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 35.9 mt -56.99 -57.89 8.03 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 C-N-CA 124.597 1.159 . . . . 0.0 110.31 -179.693 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.9 mp -56.31 -51.65 61.15 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.912 0 O-C-N 124.257 0.973 . . . . 0.0 111.296 -177.309 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.31 -31.16 72.15 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 -176.758 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -67.19 -36.96 82.84 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 122.877 0.471 . . . . 0.0 110.217 177.876 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.561 HG21 HG23 ' A' ' 60' ' ' ILE . 56.4 mt -76.47 -37.49 30.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -177.847 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -57.55 -52.66 64.51 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 114.191 -1.368 . . . . 0.0 111.257 176.979 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -69.96 -33.51 72.19 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 123.632 0.582 . . . . 0.0 111.534 -177.794 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 67.7 mtm -65.0 -56.9 10.44 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 122.386 0.274 . . . . 0.0 110.817 178.985 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 48.2 mt -64.35 -39.72 86.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 O-C-N 123.677 0.61 . . . . 0.0 111.037 -179.231 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.43 ' HA ' ' HG2' ' A' ' 107' ' ' GLN . . . -67.55 -37.4 82.64 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.659 0.384 . . . . 0.0 111.433 179.729 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 33.9 t -68.48 -39.1 81.49 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 122.351 0.26 . . . . 0.0 110.848 -175.365 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -79.98 -29.67 39.57 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 116.106 -0.497 . . . . 0.0 112.173 -178.41 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.43 ' HG2' ' HA ' ' A' ' 104' ' ' ALA . 12.0 pt20 -85.08 -28.78 25.39 Favored 'General case' 0 N--CA 1.487 1.418 0 CA-C-N 117.991 0.359 . . . . 0.0 111.203 -178.78 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 . . . . . 0 C--O 1.249 1.034 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 179.037 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.8 pttm . . . . . 0 C--O 1.242 0.693 0 CA-C-O 121.189 0.519 . . . . 0.0 110.617 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.604 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.4 tmtp? -144.37 140.24 28.94 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 -169.736 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.515 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.9 tt -132.26 136.68 47.13 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 178.431 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.511 HD12 HD13 ' A' ' 50' ' ' LEU . 15.8 pt -128.15 161.14 37.1 Favored 'Isoleucine or valine' 0 C--O 1.244 0.769 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 173.715 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.592 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -147.21 168.16 22.39 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.99 177.854 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.0 tt -142.07 113.62 7.8 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 -178.592 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.52 ' HA ' ' O ' ' A' ' 64' ' ' SER . 56.0 m -103.28 111.42 23.81 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.696 0.798 . . . . 0.0 108.851 177.16 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.451 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -123.31 127.29 48.33 Favored 'General case' 0 N--CA 1.497 1.919 0 C-N-CA 122.521 0.328 . . . . 0.0 111.44 -177.663 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.798 ' SG ' HD13 ' A' ' 85' ' ' LEU . 56.0 m -130.79 145.45 57.74 Favored Pre-proline 0 N--CA 1.481 1.087 0 C-N-CA 123.866 0.866 . . . . 0.0 111.768 -178.915 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -79.37 -28.16 3.82 Favored 'Trans proline' 0 C--N 1.375 1.929 0 C-N-CA 122.866 2.377 . . . . 0.0 111.466 167.513 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 12.2 tpt -69.74 -50.77 40.27 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.012 0.925 . . . . 0.0 110.744 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 155.68 -176.79 33.11 Favored Glycine 0 C--N 1.345 1.053 0 N-CA-C 114.178 0.431 . . . . 0.0 114.178 175.605 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 71.0 mt -73.62 -20.18 60.66 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.974 0.909 . . . . 0.0 113.393 -172.632 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.82 -42.66 89.74 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-N 118.574 0.625 . . . . 0.0 110.619 176.693 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.479 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 7.2 t-160 -67.1 -43.27 82.93 Favored 'General case' 0 C--O 1.246 0.919 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.866 178.28 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 34.7 p -65.8 -31.26 72.13 Favored 'General case' 0 C--N 1.353 0.76 0 CA-C-N 115.509 -0.769 . . . . 0.0 111.558 -177.967 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -74.15 -33.42 63.5 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 119.028 -0.51 . . . . 0.0 111.192 -178.941 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 64.6 mtm -65.05 -35.82 82.37 Favored 'General case' 0 N--CA 1.492 1.66 0 CA-C-O 120.961 0.41 . . . . 0.0 110.87 173.275 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.48 -48.67 54.66 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.999 177.441 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.68 -36.13 82.82 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 124.32 1.048 . . . . 0.0 110.946 -177.301 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -71.04 -41.11 71.24 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 -176.533 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -72.97 -38.95 66.5 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.919 -178.166 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 76.5 mt -71.68 -33.41 68.81 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.079 0.552 . . . . 0.0 110.784 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.447 ' O ' HG23 ' A' ' 30' ' ' VAL . 37.4 tt0 -61.29 -55.86 27.11 Favored 'General case' 0 C--N 1.35 0.599 0 O-C-N 124.019 0.824 . . . . 0.0 109.209 177.721 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.434 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 44.8 mt-10 -56.22 -48.25 76.82 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 124.36 1.037 . . . . 0.0 110.717 -178.414 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.47 -47.46 79.15 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.119 0.968 . . . . 0.0 111.548 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.03 -22.18 62.18 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.186 0.994 . . . . 0.0 113.537 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 26' ' ' GLU . 37.6 t -79.93 -41.55 21.55 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 -179.425 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 6.9 mm-40 -72.21 -21.72 61.37 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 114.465 -1.243 . . . . 0.0 110.102 175.422 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.437 ' HB1' ' HE1' ' A' ' 34' ' ' TYR . . . -75.61 -31.25 59.83 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 114.726 -1.125 . . . . 0.0 111.436 173.679 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 98.77 22.79 12.93 Favored Glycine 0 C--N 1.344 1.019 0 CA-C-N 115.833 -0.621 . . . . 0.0 114.095 171.751 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.437 ' HE1' ' HB1' ' A' ' 32' ' ' ALA . 2.5 m-85 -99.75 163.51 12.44 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 171.946 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.604 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 35.1 tt0 -74.33 130.42 39.65 Favored 'General case' 0 C--O 1.217 -0.646 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 159.636 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.515 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 9.3 p -119.28 134.46 62.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 CA-C-N 119.133 0.879 . . . . 0.0 110.9 -173.648 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 45.2 tptt -141.0 120.45 13.16 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.509 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.592 HG12 ' HB3' ' A' ' 7' ' ' ALA . 43.1 mt -122.28 122.94 67.64 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 C-N-CA 122.712 0.405 . . . . 0.0 112.08 -175.325 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 76.9 tt0 -88.53 116.0 26.46 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.493 1.117 . . . . 0.0 109.904 175.256 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.511 HG22 ' HB2' ' A' ' 9' ' ' CYS . 24.3 p -100.85 104.96 16.2 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 122.521 0.328 . . . . 0.0 110.366 177.735 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.451 ' O ' ' HA ' ' A' ' 10' ' ' ALA . 13.9 mt-30 -96.66 144.0 27.1 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.237 0.615 . . . . 0.0 109.45 175.802 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -167.98 177.47 42.19 Favored Glycine 0 C--N 1.335 0.49 0 C-N-CA 121.716 -0.278 . . . . 0.0 112.568 179.419 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.79 -29.27 69.34 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.535 0.734 . . . . 0.0 111.958 179.534 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -67.53 -42.32 82.93 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.407 0.683 . . . . 0.0 110.205 174.037 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 153.77 -173.01 32.51 Favored Glycine 0 C--N 1.341 0.811 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.93 -176.762 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 72.6 mt -101.59 135.57 37.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 176.399 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.416 ' HB3' ' OG1' ' A' ' 40' ' ' THR . 9.1 tp-100 -132.16 144.78 50.91 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.386 0.674 . . . . 0.0 110.383 -172.786 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 42.2 t30 74.39 -64.87 0.37 Allowed 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 126.43 1.892 . . . . 0.0 108.855 -177.618 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 22.6 ttt-85 63.73 129.19 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 127.048 2.139 . . . . 0.0 113.947 172.52 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.511 HD13 HD12 ' A' ' 6' ' ' ILE . 26.9 mt -77.76 148.63 34.74 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 113.837 -1.529 . . . . 0.0 110.272 175.884 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 58.5 p -113.72 170.14 8.47 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.505 176.347 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -57.19 -33.41 67.46 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.382 0.673 . . . . 0.0 111.222 -179.211 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -61.17 -54.95 37.95 Favored 'General case' 0 C--N 1.35 0.608 0 O-C-N 124.256 0.972 . . . . 0.0 109.667 175.31 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 53.1 m-20 -54.56 -41.82 70.26 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 123.966 0.906 . . . . 0.0 112.239 -176.906 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.673 HD11 HH21 ' A' ' 74' ' ' ARG . 40.4 mt -71.11 -33.47 51.39 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 O-C-N 123.874 0.734 . . . . 0.0 110.604 -176.39 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.23 -39.63 65.34 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.475 0.71 . . . . 0.0 111.299 176.203 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -69.25 -32.28 71.37 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.881 0.872 . . . . 0.0 110.95 179.425 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -56.57 101.88 0.07 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.884 1.274 . . . . 0.0 113.216 -172.527 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 27.4 m -61.11 -39.59 90.55 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.759 0.824 . . . . 0.0 109.12 165.302 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.52 HG23 HG21 ' A' ' 99' ' ' ILE . 53.0 mt -127.22 144.37 37.51 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 C-N-CA 123.746 0.818 . . . . 0.0 110.581 179.149 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 28.1 mt -134.42 120.28 32.75 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 C-N-CA 124.014 0.926 . . . . 0.0 108.839 172.689 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.6 mp -109.46 119.77 59.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 175.167 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' HIS . . . . . 0.438 ' HB2' ' HG3' ' A' ' 82' ' ' GLU . 12.6 m170 -92.44 83.92 5.05 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-O 121.747 0.784 . . . . 0.0 108.944 168.61 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.52 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 24.8 p -80.45 83.58 6.24 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 114.236 -1.347 . . . . 0.0 109.072 175.551 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 33.7 m -128.29 156.58 40.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 CA-C-O 121.872 0.844 . . . . 0.0 112.29 -169.126 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -109.3 -21.44 12.54 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 113.633 -1.622 . . . . 0.0 109.002 173.88 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 6.2 m -137.13 148.48 26.29 Favored 'Isoleucine or valine' 0 C--N 1.35 0.613 0 C-N-CA 125.519 1.528 . . . . 0.0 108.015 175.509 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 67.6 m -59.27 116.18 15.1 Favored Pre-proline 0 CA--C 1.548 0.899 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 176.075 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.407 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 39.9 Cg_endo -64.29 151.46 85.32 Favored 'Trans proline' 0 C--N 1.381 2.241 0 C-N-CA 122.86 2.373 . . . . 0.0 111.475 -176.514 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -64.62 -36.72 85.15 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-O 121.619 0.723 . . . . 0.0 110.408 -178.34 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.509 ' HB3' ' HD3' ' A' ' 74' ' ' ARG . 2.2 m-20 -91.49 13.21 18.33 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.486 1.115 . . . . 0.0 111.919 -173.764 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.407 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 4.8 p30 -56.15 -30.3 61.98 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 124.372 1.069 . . . . 0.0 112.154 -177.985 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -61.08 -33.61 73.62 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.67 1.188 . . . . 0.0 112.457 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.673 HH21 HD11 ' A' ' 55' ' ' ILE . 27.3 mtp180 -65.11 -29.34 70.2 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.436 1.094 . . . . 0.0 112.007 177.918 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -100.24 -11.74 20.12 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 114.913 -1.04 . . . . 0.0 111.84 -175.213 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -56.86 -35.27 68.68 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.373 1.069 . . . . 0.0 111.92 -177.365 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 34.7 t -73.53 -19.01 61.02 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.852 0.861 . . . . 0.0 112.507 -178.608 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.59 ' HG3' HG22 ' A' ' 55' ' ' ILE . 32.3 mmt180 -111.44 173.59 6.27 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.531 0.733 . . . . 0.0 111.781 -171.209 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -84.33 97.68 9.59 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.758 0.823 . . . . 0.0 110.387 -177.289 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 39.3 t -105.87 153.14 7.39 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 CA-C-N 114.966 -1.016 . . . . 0.0 110.255 -179.421 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 -124.36 91.39 3.44 Favored 'General case' 0 C--O 1.243 0.72 0 C-N-CA 124.815 1.246 . . . . 0.0 107.895 179.197 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.438 ' HG3' ' HB2' ' A' ' 63' ' ' HIS . 2.2 mp0 -77.08 126.86 31.65 Favored 'General case' 0 C--N 1.353 0.746 0 C-N-CA 122.916 0.486 . . . . 0.0 110.714 -177.613 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.454 HG13 ' HA ' ' A' ' 64' ' ' SER . 43.4 pt -136.46 -178.58 2.43 Favored 'Isoleucine or valine' 0 C--O 1.246 0.911 0 C-N-CA 125.327 1.451 . . . . 0.0 108.317 177.861 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 23.5 p -83.39 147.44 27.89 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.102 0.477 . . . . 0.0 109.825 169.118 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.798 HD13 ' SG ' ' A' ' 11' ' ' CYS . 8.1 tt -65.85 -28.29 68.86 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.929 179.404 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.434 ' O ' ' HG2' ' A' ' 90' ' ' LYS . 28.6 tt0 -62.6 -44.96 95.01 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.555 0.742 . . . . 0.0 110.428 174.107 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -60.82 -30.95 70.4 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.758 0.823 . . . . 0.0 110.609 179.253 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.7 -21.57 63.48 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.956 0.902 . . . . 0.0 113.318 178.999 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 65.5 mt -89.27 -41.82 14.1 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 C-N-CA 123.622 0.769 . . . . 0.0 110.36 -179.163 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.434 ' HG2' ' O ' ' A' ' 86' ' ' GLN . 16.2 ptpt -92.68 -47.44 7.09 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.016 0.526 . . . . 0.0 112.172 -174.994 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -99.48 18.55 17.58 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 123.746 0.818 . . . . 0.0 111.477 -173.296 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.498 ' HA ' HD12 ' A' ' 95' ' ' ILE . . . -45.66 -57.98 3.8 Favored 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 124.158 0.983 . . . . 0.0 113.527 -171.522 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.48 -38.77 81.68 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.39 0.676 . . . . 0.0 111.014 179.041 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -61.77 -46.48 94.09 Favored Glycine 0 C--N 1.352 1.454 0 O-C-N 124.462 1.101 . . . . 0.0 112.696 -179.511 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.498 HD12 ' HA ' ' A' ' 92' ' ' ALA . 16.8 mt -57.72 -57.95 8.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 124.137 0.975 . . . . 0.0 110.22 -179.752 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.476 ' O ' ' HG3' ' A' ' 100' ' ' GLU . 2.2 mp -57.52 -51.98 62.9 Favored 'Isoleucine or valine' 0 C--N 1.357 0.926 0 O-C-N 124.131 0.894 . . . . 0.0 110.647 -176.51 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -32.14 71.98 Favored 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -175.412 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -65.01 -37.52 87.93 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 123.806 0.691 . . . . 0.0 110.137 176.71 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.52 HG21 HG23 ' A' ' 60' ' ' ILE . 25.8 mt -79.93 -31.94 13.79 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.834 -178.995 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.476 ' HG3' ' O ' ' A' ' 96' ' ' ILE . 36.2 mt-10 -59.71 -50.59 73.26 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.396 0.678 . . . . 0.0 110.621 177.319 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -68.99 -36.99 78.47 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 123.835 0.71 . . . . 0.0 111.083 -177.225 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 71.4 mtm -60.43 -54.04 50.34 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 122.421 0.289 . . . . 0.0 110.323 176.527 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.5 HD12 HG12 ' A' ' 60' ' ' ILE . 39.7 mt -67.3 -35.71 74.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 123.288 0.635 . . . . 0.0 111.523 -178.358 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.73 -36.72 83.12 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.041 0.537 . . . . 0.0 110.47 178.85 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 70.0 m -79.49 -27.08 41.5 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 122.918 0.487 . . . . 0.0 111.383 -174.05 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -85.79 -33.44 21.38 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 122.377 0.271 . . . . 0.0 111.639 177.181 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -80.47 -30.16 37.44 Favored 'General case' 0 N--CA 1.487 1.416 0 CA-C-N 118.086 0.403 . . . . 0.0 111.186 -179.273 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 12.7 mm100 . . . . . 0 C--O 1.248 1.015 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 175.959 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.405 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 3.3 pttt . . . . . 0 C--O 1.251 1.139 0 CA-C-O 121.376 0.608 . . . . 0.0 110.348 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.551 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.2 tmtp? -143.69 140.38 30.01 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.615 -0.721 . . . . 0.0 109.163 -175.71 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.479 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 8.8 tt -126.25 137.19 53.5 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 176.718 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.442 HD12 HD13 ' A' ' 50' ' ' LEU . 16.4 pt -128.88 161.75 37.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 172.447 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.609 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -147.63 168.06 22.99 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.111 0.481 . . . . 0.0 109.86 176.427 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.6 tt -138.65 114.34 9.86 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.515 ' HA ' ' O ' ' A' ' 64' ' ' SER . 80.5 m -106.4 107.65 18.77 Favored 'General case' 0 C--O 1.218 -0.583 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 177.957 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.424 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -125.97 122.95 37.39 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.025 0.53 . . . . 0.0 110.939 -177.346 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.821 ' SG ' HD13 ' A' ' 85' ' ' LEU . 2.9 m -140.42 146.78 46.8 Favored Pre-proline 0 N--CA 1.477 0.901 0 C-N-CA 123.682 0.793 . . . . 0.0 111.113 178.194 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -85.49 0.78 8.5 Favored 'Trans proline' 0 C--N 1.377 2.069 0 C-N-CA 123.596 2.864 . . . . 0.0 112.19 -179.469 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 27.0 mmt -88.38 -26.01 22.41 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.24 1.016 . . . . 0.0 110.644 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 135.93 177.04 14.69 Favored Glycine 0 C--N 1.344 0.992 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.809 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 47.0 mt -75.53 -13.88 60.38 Favored 'General case' 0 C--N 1.352 0.678 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -179.563 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.23 -46.49 89.57 Favored 'General case' 0 C--O 1.249 1.053 0 CA-C-O 121.168 0.509 . . . . 0.0 110.877 177.2 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.44 ' HD1' ' HG ' ' A' ' 11' ' ' CYS . 12.3 t-160 -65.38 -43.53 90.45 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.742 179.591 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.404 ' HA ' HD11 ' A' ' 85' ' ' LEU . 31.2 p -65.71 -36.0 82.36 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.471 -176.681 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.0 m-30 -70.41 -32.56 70.23 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.381 0.672 . . . . 0.0 111.342 -179.05 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' MET . . . . . 0.406 ' HB2' ' HE3' ' A' ' 20' ' ' MET . 65.2 mtm -67.15 -37.96 84.69 Favored 'General case' 0 N--CA 1.484 1.275 0 CA-C-O 120.888 0.375 . . . . 0.0 110.762 175.333 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.38 -39.32 81.77 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.989 173.58 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.06 -40.57 91.02 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.668 0.787 . . . . 0.0 110.662 -178.925 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -61.4 -51.36 69.06 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.604 0.762 . . . . 0.0 109.616 177.707 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.405 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -64.52 -48.44 75.09 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 114.765 -1.107 . . . . 0.0 112.502 -174.314 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 91.4 mt -66.12 -33.0 74.79 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.421 0.689 . . . . 0.0 111.69 179.433 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.502 ' HA ' HG21 ' A' ' 36' ' ' VAL . 32.4 tt0 -64.03 -52.21 60.52 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 123.584 0.552 . . . . 0.0 110.02 178.816 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -54.42 -48.63 71.42 Favored 'General case' 0 N--CA 1.481 1.079 0 O-C-N 124.213 0.945 . . . . 0.0 110.572 179.322 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.9 -47.37 86.03 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.603 1.161 . . . . 0.0 111.955 -178.035 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.42 -28.29 67.78 Favored 'General case' 0 N--CA 1.476 0.866 0 CA-C-N 115.068 -0.969 . . . . 0.0 112.842 178.833 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 26' ' ' GLU . 41.1 t -72.0 -38.11 62.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 178.296 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -67.88 -25.21 65.4 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.578 1.151 . . . . 0.0 111.317 176.394 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -80.88 -9.39 59.83 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 123.847 0.859 . . . . 0.0 112.075 177.298 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.62 2.81 67.09 Favored Glycine 0 C--N 1.347 1.167 0 N-CA-C 115.442 0.937 . . . . 0.0 115.442 166.429 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.405 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.1 OUTLIER -113.92 178.66 4.2 Favored 'General case' 0 N--CA 1.49 1.527 0 CA-C-N 117.746 0.773 . . . . 0.0 111.751 179.849 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.551 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 38.9 tt0 -76.47 153.73 35.33 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 123.926 0.766 . . . . 0.0 109.366 178.154 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.502 HG21 ' HA ' ' A' ' 26' ' ' GLU . 7.2 p -136.49 138.83 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 123.073 0.549 . . . . 0.0 110.284 178.493 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 43.7 tptt -146.8 122.1 10.25 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 175.268 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.609 HG12 ' HB3' ' A' ' 7' ' ' ALA . 45.7 mt -122.69 113.0 36.46 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 123.098 0.559 . . . . 0.0 111.788 -173.433 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 68.8 tt0 -81.25 107.46 14.06 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.669 0.788 . . . . 0.0 109.667 174.845 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.48 HG22 ' HB2' ' A' ' 9' ' ' CYS . 22.3 p -88.72 109.31 20.04 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.233 0.613 . . . . 0.0 110.15 175.773 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.517 HE22 ' HB2' ' A' ' 70' ' ' GLU . 42.0 mt-30 -103.6 155.42 18.56 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.685 0.755 . . . . 0.0 111.542 178.182 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 178.52 167.95 37.08 Favored Glycine 0 C--O 1.24 0.474 0 CA-C-N 114.529 -1.214 . . . . 0.0 110.406 172.285 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.12 -19.49 65.63 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-N 116.944 0.372 . . . . 0.0 110.2 173.699 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -64.63 -40.74 96.01 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 124.548 1.139 . . . . 0.0 110.856 171.178 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 162.47 -176.68 38.8 Favored Glycine 0 C--N 1.344 1.003 0 CA-C-N 115.43 -0.805 . . . . 0.0 112.176 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.532 HD13 ' NH2' ' A' ' 49' ' ' ARG . 85.0 mt -129.25 134.24 64.22 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 C-N-CA 123.972 0.909 . . . . 0.0 108.789 176.123 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 9.7 tp-100 -140.8 149.65 42.31 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.013 0.925 . . . . 0.0 110.398 -172.141 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ASN . . . . . 0.455 ' HB3' ' O ' ' A' ' 38' ' ' ILE . 33.8 t30 57.22 34.42 24.77 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 125.275 1.43 . . . . 0.0 110.392 177.377 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.532 ' NH2' HD13 ' A' ' 46' ' ' ILE . 20.4 ttm180 -57.39 131.51 50.31 Favored 'General case' 0 C--N 1.351 0.664 0 C-N-CA 124.695 1.198 . . . . 0.0 112.737 -171.209 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.594 ' HB2' HH22 ' A' ' 74' ' ' ARG . 27.8 mt -72.95 149.04 43.7 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 113.871 -1.513 . . . . 0.0 110.961 177.246 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.431 ' O ' HG13 ' A' ' 55' ' ' ILE . 42.7 p -103.38 174.3 5.93 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.287 173.409 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.72 -31.42 71.58 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 122.716 0.406 . . . . 0.0 110.631 173.44 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -66.23 -42.36 88.79 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.883 0.873 . . . . 0.0 110.686 178.705 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -57.19 -48.92 77.55 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.423 0.689 . . . . 0.0 111.035 175.881 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.677 HD11 HH21 ' A' ' 74' ' ' ARG . 23.1 mt -69.21 -36.39 72.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 O-C-N 124.143 0.902 . . . . 0.0 111.24 -175.292 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.75 -46.16 69.58 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.831 0.853 . . . . 0.0 111.451 -178.156 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -84.96 -10.73 56.75 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.248 0.619 . . . . 0.0 111.557 -178.061 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.95 106.93 1.12 Allowed 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.339 0.656 . . . . 0.0 110.761 178.165 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 13.7 m -63.35 -36.0 82.26 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.27 1.028 . . . . 0.0 109.831 169.495 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.513 HG23 HG21 ' A' ' 99' ' ' ILE . 75.8 mt -132.07 140.83 46.98 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 124.193 0.997 . . . . 0.0 110.082 -177.716 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 32.4 mt -135.96 125.43 39.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 C-N-CA 123.746 0.818 . . . . 0.0 108.964 174.701 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.3 mp -112.28 127.96 69.18 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 175.394 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' HIS . . . . . 0.405 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 5.7 m170 -99.82 86.15 3.24 Favored 'General case' 0 N--CA 1.486 1.353 0 CA-C-O 121.773 0.797 . . . . 0.0 109.111 169.844 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.515 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 19.7 m -81.09 81.63 7.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 114.254 -1.339 . . . . 0.0 109.173 175.998 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 34.9 m -128.5 159.68 39.74 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.413 0 CA-C-O 121.741 0.782 . . . . 0.0 111.608 -171.208 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -110.43 -25.4 10.08 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 114.494 -1.23 . . . . 0.0 108.994 172.411 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 14.6 m -135.96 164.39 32.18 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 C-N-CA 125.523 1.529 . . . . 0.0 108.868 -178.874 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 96.2 m -68.53 114.1 19.89 Favored Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 122.999 0.52 . . . . 0.0 110.272 -179.386 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.561 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 46.1 Cg_endo -68.45 152.97 74.87 Favored 'Trans proline' 0 C--N 1.382 2.323 0 C-N-CA 122.445 2.097 . . . . 0.0 112.489 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.517 ' HB2' HE22 ' A' ' 41' ' ' GLN . 40.1 mm-40 -67.29 -29.31 68.88 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.368 0.667 . . . . 0.0 111.637 -175.581 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.487 ' HB3' ' HD3' ' A' ' 74' ' ' ARG . 2.1 m-20 -104.32 18.69 21.64 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.607 -175.251 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.561 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 41.7 t30 -57.62 -35.46 70.5 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.166 0.986 . . . . 0.0 112.341 -177.654 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.53 -31.37 72.51 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 123.385 0.674 . . . . 0.0 112.632 -179.745 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.677 HH21 HD11 ' A' ' 55' ' ' ILE . 35.5 mtp180 -59.26 -33.79 71.47 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.87 0.868 . . . . 0.0 112.416 175.821 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -98.95 -16.49 18.74 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 115.083 -0.962 . . . . 0.0 111.448 -175.032 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -54.97 -33.43 62.44 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 124.14 0.976 . . . . 0.0 112.39 -176.742 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 40.4 p -78.75 -6.39 55.76 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.793 0.837 . . . . 0.0 112.909 -177.393 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.57 ' HG3' HG22 ' A' ' 55' ' ' ILE . 25.2 mmt180 -120.24 171.13 8.72 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.909 0.884 . . . . 0.0 111.343 -172.58 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -78.37 92.69 4.59 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.361 0.665 . . . . 0.0 110.014 -177.5 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 43.6 t -109.05 139.48 31.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 123.169 0.588 . . . . 0.0 110.946 -177.719 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -108.11 91.01 3.47 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.981 1.312 . . . . 0.0 107.92 -179.299 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.405 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 44.7 mt-10 -78.41 128.89 34.27 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.526 -177.016 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.423 HG13 ' HA ' ' A' ' 64' ' ' SER . 40.9 pt -141.87 -174.85 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 C-N-CA 125.433 1.493 . . . . 0.0 108.819 -179.408 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 25.5 p -83.34 148.83 27.11 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.033 0.444 . . . . 0.0 109.956 167.523 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.821 HD13 ' SG ' ' A' ' 11' ' ' CYS . 7.8 tt -63.68 -29.91 71.08 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.285 177.098 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.523 ' HG2' ' HE3' ' A' ' 90' ' ' LYS . 27.6 tt0 -70.15 -36.27 74.63 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.954 178.323 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -60.64 -33.23 72.48 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.703 0.801 . . . . 0.0 110.367 173.491 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.1 -20.63 64.94 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.827 0.851 . . . . 0.0 113.274 178.923 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 68.4 mt -87.32 -55.26 6.69 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 123.189 0.595 . . . . 0.0 109.654 178.704 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.523 ' HE3' ' HG2' ' A' ' 86' ' ' GLN . 18.0 ptpt -77.78 -43.84 29.42 Favored 'General case' 0 N--CA 1.482 1.174 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.626 -173.552 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -105.51 20.46 18.86 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.032 0.933 . . . . 0.0 110.522 -173.454 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.405 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -44.03 -58.99 2.51 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 124.007 0.923 . . . . 0.0 113.052 -175.342 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.07 -41.15 91.77 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.032 -0.986 . . . . 0.0 110.785 178.317 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -58.21 -46.02 93.34 Favored Glycine 0 C--N 1.352 1.459 0 O-C-N 124.493 1.121 . . . . 0.0 112.539 -179.189 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 26.8 mt -59.74 -57.42 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 124.516 1.127 . . . . 0.0 109.625 -178.906 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.8 mp -55.31 -50.97 60.87 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.99 0 O-C-N 124.302 1.002 . . . . 0.0 111.027 -177.225 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.95 -29.27 68.28 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 122.897 0.479 . . . . 0.0 112.097 -175.774 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -68.74 -33.72 74.39 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 123.493 0.496 . . . . 0.0 110.16 176.589 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.513 HG21 HG23 ' A' ' 60' ' ' ILE . 66.4 mt -75.82 -41.2 39.81 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 -179.894 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -58.03 -45.09 87.53 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 114.194 -1.366 . . . . 0.0 111.965 177.403 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -74.45 -30.29 61.82 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 123.208 0.317 . . . . 0.0 111.232 -178.42 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 69.9 mtm -66.99 -49.93 63.83 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 122.368 0.267 . . . . 0.0 110.404 175.335 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 50.4 mt -62.5 -36.74 76.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 123.364 0.666 . . . . 0.0 110.233 176.182 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.402 ' HA ' ' HG2' ' A' ' 107' ' ' GLN . . . -65.52 -38.95 91.15 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.118 0.567 . . . . 0.0 110.867 176.62 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 26.5 t -68.61 -33.52 74.19 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.43 0.692 . . . . 0.0 111.312 -174.441 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -85.67 -29.3 24.1 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-N 116.096 -0.502 . . . . 0.0 112.255 179.314 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.402 ' HG2' ' HA ' ' A' ' 104' ' ' ALA . 4.3 pt20 -86.7 -30.02 22.0 Favored 'General case' 0 N--CA 1.492 1.67 0 CA-C-N 118.333 0.515 . . . . 0.0 111.593 -174.772 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 . . . . . 0 N--CA 1.48 1.056 0 C-N-CA 123.422 0.689 . . . . 0.0 110.8 179.825 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.656 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 15.0 pttt . . . . . 0 N--CA 1.481 1.117 0 CA-C-O 120.964 0.411 . . . . 0.0 110.195 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.538 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.4 tmtp? -145.22 143.25 30.17 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-O 121.377 0.608 . . . . 0.0 110.501 -174.3 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.432 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 8.4 tt -131.47 138.56 49.07 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.542 1.137 . . . . 0.0 108.075 174.491 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.467 HG13 HG23 ' A' ' 61' ' ' ILE . 17.4 pt -129.01 163.91 32.78 Favored 'Isoleucine or valine' 0 C--O 1.24 0.588 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 170.41 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.603 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -152.39 168.47 25.35 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 120.95 0.405 . . . . 0.0 110.074 178.683 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.7 tt -141.12 120.8 13.37 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 107.513 -1.291 . . . . 0.0 107.513 -177.806 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.553 ' HA ' ' O ' ' A' ' 64' ' ' SER . 60.0 m -110.73 113.78 26.65 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.664 0.786 . . . . 0.0 108.913 175.285 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.409 ' HB3' HG12 ' A' ' 65' ' ' VAL . . . -125.64 112.61 16.35 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 122.78 0.432 . . . . 0.0 110.925 -175.891 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.546 ' SG ' ' HB2' ' A' ' 13' ' ' MET . 44.0 t -121.27 136.61 25.92 Favored Pre-proline 0 N--CA 1.47 0.537 0 C-N-CA 123.928 0.891 . . . . 0.0 110.183 -179.589 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -69.58 -23.26 31.8 Favored 'Trans proline' 0 C--N 1.37 1.682 0 C-N-CA 122.781 2.321 . . . . 0.0 112.477 175.26 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.546 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 0.3 OUTLIER -71.65 -43.15 66.58 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.596 0.758 . . . . 0.0 111.209 -178.097 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 156.8 -172.06 34.39 Favored Glycine 0 C--N 1.345 1.055 0 CA-C-N 116.381 -0.372 . . . . 0.0 113.265 179.343 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 65.4 mt -82.6 -18.94 39.44 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 -175.256 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.85 -42.33 99.71 Favored 'General case' 0 N--CA 1.485 1.295 0 CA-C-N 118.818 0.736 . . . . 0.0 111.234 -177.832 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.446 ' CE1' HD22 ' A' ' 85' ' ' LEU . 10.4 t-160 -65.76 -42.22 91.15 Favored 'General case' 0 C--O 1.247 0.966 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.124 177.417 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.453 HG22 HD11 ' A' ' 85' ' ' LEU . 35.3 p -67.38 -32.61 73.65 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.238 -178.517 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -74.47 -31.37 62.2 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.357 0.663 . . . . 0.0 111.738 -178.512 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 56.3 mtm -64.8 -41.27 95.94 Favored 'General case' 0 N--CA 1.485 1.316 0 CA-C-O 120.921 0.391 . . . . 0.0 110.234 172.681 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.35 -38.4 84.76 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.324 174.541 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.84 -32.79 72.73 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.401 0.68 . . . . 0.0 111.059 -179.334 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 7.3 tp-100 -74.22 -42.77 59.22 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 122.944 0.498 . . . . 0.0 109.832 177.728 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.37 -51.01 61.5 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.489 -176.469 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.417 HD11 ' OG ' ' A' ' 64' ' ' SER . 94.3 mt -63.55 -34.26 77.41 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.502 0.721 . . . . 0.0 111.374 177.799 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.573 ' HA ' HG21 ' A' ' 36' ' ' VAL . 31.0 tt0 -56.38 -56.83 16.21 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 123.916 0.76 . . . . 0.0 110.455 174.686 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.471 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 44.8 mt-10 -52.79 -48.81 66.62 Favored 'General case' 0 N--CA 1.478 0.966 0 O-C-N 124.535 1.147 . . . . 0.0 111.238 -179.785 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.94 -49.14 78.96 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.303 1.041 . . . . 0.0 112.199 -177.915 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.26 -26.3 67.28 Favored 'General case' 0 CA--C 1.546 0.81 0 CA-C-N 115.372 -0.831 . . . . 0.0 112.863 178.519 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 26' ' ' GLU . 55.4 t -72.31 -38.3 61.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 178.21 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.471 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 8.4 mm-40 -71.54 -22.64 61.74 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 114.836 -1.074 . . . . 0.0 111.051 178.313 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -82.43 -20.19 37.5 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.318 0.647 . . . . 0.0 111.105 174.331 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 113.48 -37.56 3.55 Favored Glycine 0 C--N 1.348 1.225 0 N-CA-C 113.951 0.34 . . . . 0.0 113.951 167.783 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.656 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -76.0 174.39 10.05 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 -175.07 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.538 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 12.4 tp10 -72.56 151.65 42.29 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 113.935 -1.484 . . . . 0.0 109.507 178.515 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.573 HG21 ' HA ' ' A' ' 26' ' ' GLU . 9.6 p -136.05 128.71 46.26 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 C-N-CA 123.045 0.538 . . . . 0.0 110.753 -179.434 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 48.5 tptt -138.03 114.97 10.78 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.654 0.782 . . . . 0.0 109.071 176.276 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.603 HG12 ' HB3' ' A' ' 7' ' ' ALA . 43.2 mt -118.69 111.01 31.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -174.098 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -72.9 148.11 44.67 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 171.547 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.8 p -133.69 122.21 23.07 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.863 0.865 . . . . 0.0 109.182 -177.577 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -114.52 134.27 55.15 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -162.25 179.74 37.38 Favored Glycine 0 C--N 1.341 0.807 0 N-CA-C 112.699 -0.16 . . . . 0.0 112.699 -176.459 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.35 -24.19 67.21 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.943 0.897 . . . . 0.0 112.123 179.562 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -75.61 -36.3 60.3 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.598 0.759 . . . . 0.0 110.548 176.511 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 147.36 -156.52 27.02 Favored Glycine 0 C--N 1.346 1.099 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.417 -177.589 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.413 HD12 HH22 ' A' ' 49' ' ' ARG . 77.5 mt -113.12 141.5 28.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 174.198 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -135.54 150.25 49.68 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.258 1.023 . . . . 0.0 109.145 179.17 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 8.8 t30 64.3 39.29 7.37 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.533 1.133 . . . . 0.0 110.085 174.366 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.413 HH22 HD12 ' A' ' 46' ' ' ILE . 22.8 tpp180 -42.03 125.69 3.04 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 125.961 1.704 . . . . 0.0 113.31 -178.176 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 42.7 mt -82.48 126.95 32.82 Favored 'General case' 0 C--O 1.242 0.663 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.221 174.074 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.418 ' O ' HG13 ' A' ' 55' ' ' ILE . 60.2 p -96.64 164.35 12.63 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.932 -178.062 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.87 -29.92 63.37 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.462 0.705 . . . . 0.0 111.247 177.299 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.413 ' O ' ' HG3' ' A' ' 57' ' ' GLU . 47.7 tt0 -57.54 -61.14 2.72 Favored 'General case' 0 C--N 1.354 0.763 0 C-N-CA 123.783 0.833 . . . . 0.0 110.104 170.807 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.454 ' HB3' HG21 ' A' ' 6' ' ' ILE . 38.9 m-20 -52.02 -44.11 64.03 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 124.134 0.973 . . . . 0.0 112.343 -176.555 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ILE . . . . . 0.527 HG22 ' HG3' ' A' ' 78' ' ' ARG . 29.4 mt -67.4 -38.11 80.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 O-C-N 124.285 0.991 . . . . 0.0 111.742 -175.961 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -79.88 -28.69 39.9 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.218 179.732 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' A' ' 53' ' ' GLN . 53.0 mt-10 -71.07 -35.97 72.09 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.534 0.734 . . . . 0.0 110.274 173.751 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -58.53 108.01 0.58 Allowed 'General case' 0 C--N 1.348 0.521 0 CA-C-N 114.643 -1.162 . . . . 0.0 111.997 -171.686 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 37.3 m -62.68 -40.43 97.06 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 115.046 -0.979 . . . . 0.0 109.041 165.01 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 80.4 mt -129.27 140.26 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.317 -178.194 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.467 HG23 HG13 ' A' ' 6' ' ' ILE . 20.2 mt -130.31 135.0 61.63 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 171.595 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -119.42 133.98 64.47 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 173.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' HIS . . . . . 0.441 ' HB2' ' HG3' ' A' ' 82' ' ' GLU . 13.2 m170 -107.46 84.35 1.95 Allowed 'General case' 0 N--CA 1.484 1.232 0 CA-C-O 121.481 0.658 . . . . 0.0 109.648 170.421 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.553 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 20.4 m -78.54 80.59 4.92 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 124.659 1.184 . . . . 0.0 110.344 177.014 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.409 HG12 ' HB3' ' A' ' 10' ' ' ALA . 34.7 m -125.37 160.0 31.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 CA-C-O 121.665 0.745 . . . . 0.0 112.175 -169.567 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -110.59 -23.13 11.27 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 114.589 -1.187 . . . . 0.0 109.071 173.821 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 17.0 m -130.86 165.87 30.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 C-N-CA 125.545 1.538 . . . . 0.0 108.638 178.282 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 88.8 m -62.29 117.17 27.75 Favored Pre-proline 0 CA--C 1.547 0.848 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 175.229 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.606 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 38.5 Cg_endo -63.92 142.91 83.89 Favored 'Trans proline' 0 C--N 1.376 2.002 0 C-N-CA 122.06 1.84 . . . . 0.0 111.544 177.907 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -68.61 -37.49 79.82 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.45 0.7 . . . . 0.0 110.715 -174.925 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -97.6 25.06 6.07 Favored 'General case' 0 C--O 1.219 -0.503 0 CA-C-N 115.21 -0.905 . . . . 0.0 110.683 -177.892 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.606 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 38.6 t30 -55.11 -37.35 66.77 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.148 0.579 . . . . 0.0 111.407 177.285 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.65 -22.1 66.89 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.613 0.765 . . . . 0.0 112.778 -179.181 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.6 mmp_? -66.71 -33.09 74.86 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.146 0.578 . . . . 0.0 111.455 174.097 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -107.62 -29.48 9.14 Favored 'General case' 0 N--CA 1.485 1.298 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -168.197 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -54.94 -27.43 43.4 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 -165.403 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 20.9 t -84.8 7.19 21.6 Favored 'General case' 0 CA--C 1.56 1.352 0 C-N-CA 123.638 0.775 . . . . 0.0 112.204 -179.412 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.527 ' HG3' HG22 ' A' ' 55' ' ' ILE . 34.9 mmt180 -121.28 -177.03 3.42 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 124.595 1.158 . . . . 0.0 110.036 179.511 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -79.5 86.79 5.14 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.062 0.545 . . . . 0.0 110.893 178.788 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 22.5 t -108.68 146.64 14.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 123.75 0.82 . . . . 0.0 109.877 179.184 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -125.73 96.04 4.64 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.819 0.848 . . . . 0.0 109.737 177.589 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.441 ' HG3' ' HB2' ' A' ' 63' ' ' HIS . 1.8 mp0 -72.3 129.1 37.62 Favored 'General case' 0 C--N 1.352 0.696 0 CA-C-O 121.233 0.54 . . . . 0.0 110.404 178.261 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.485 HG13 ' HA ' ' A' ' 64' ' ' SER . 45.8 pt -138.45 -176.48 1.35 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.83 0 C-N-CA 125.231 1.412 . . . . 0.0 108.386 177.271 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 13.1 p -83.63 147.44 27.71 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 122.63 0.372 . . . . 0.0 110.158 170.42 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.518 HD13 ' HB2' ' A' ' 11' ' ' CYS . 4.8 tt -63.26 -30.23 71.41 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.341 0.656 . . . . 0.0 111.153 178.074 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -61.38 -43.76 98.32 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.39 0.676 . . . . 0.0 110.946 173.858 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.425 ' HB3' HD12 ' A' ' 83' ' ' ILE . 9.6 t70 -59.77 -32.99 71.11 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.628 0.771 . . . . 0.0 110.901 179.427 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.483 ' HB2' ' HB3' ' A' ' 64' ' ' SER . . . -65.46 -23.59 66.96 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.837 0.855 . . . . 0.0 113.244 179.112 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 34.9 mt -93.89 -51.12 11.51 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 123.091 0.556 . . . . 0.0 109.895 -179.187 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 58.1 pttt -75.62 -29.73 59.28 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.329 0.652 . . . . 0.0 112.297 -174.759 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -126.45 18.75 7.5 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 122.989 0.516 . . . . 0.0 110.886 -168.736 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -44.98 -57.35 3.88 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -174.671 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.27 -36.07 79.01 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.024 -0.989 . . . . 0.0 111.491 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -62.48 -56.55 20.97 Favored Glycine 0 C--N 1.351 1.365 0 O-C-N 124.152 0.908 . . . . 0.0 111.554 179.818 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.405 ' O ' HG13 ' A' ' 99' ' ' ILE . 33.7 mt -47.05 -57.76 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 125.039 1.336 . . . . 0.0 111.09 -179.383 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.9 mp -57.48 -53.49 43.48 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 O-C-N 124.244 0.965 . . . . 0.0 111.212 -176.688 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -27.26 67.64 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -176.567 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 24.3 mm-40 -69.33 -36.4 76.89 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.762 0.825 . . . . 0.0 109.744 178.701 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.405 HG13 ' O ' ' A' ' 95' ' ' ILE . 30.3 mt -77.99 -38.94 25.01 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -55.71 -47.84 76.17 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 114.22 -1.355 . . . . 0.0 111.489 176.581 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -74.56 -33.76 62.77 Favored 'General case' 0 C--N 1.349 0.557 0 O-C-N 123.566 0.541 . . . . 0.0 111.278 -177.804 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 70.3 mtm -60.46 -51.41 69.6 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 176.943 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 60.2 mt -65.76 -45.27 92.2 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.916 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.562 178.109 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.73 -31.53 72.24 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -175.506 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 66.1 m -84.2 -24.74 29.97 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -176.004 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -84.46 -31.8 24.38 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 122.002 0.121 . . . . 0.0 110.973 174.131 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -84.08 -33.32 24.41 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 122.847 0.459 . . . . 0.0 111.248 -178.947 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 27.3 mm-40 . . . . . 0 C--O 1.251 1.183 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 177.293 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.6 mmt . . . . . 0 N--CA 1.484 1.268 0 N-CA-C 110.479 -0.193 . . . . 0.0 110.479 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 54.2 m -68.27 100.14 1.01 Allowed 'General case' 0 C--N 1.353 0.731 0 C-N-CA 123.328 0.651 . . . . 0.0 110.406 178.284 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.622 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 17.1 pttt -74.07 178.83 4.75 Favored 'General case' 0 N--CA 1.48 1.038 0 CA-C-O 121.302 0.573 . . . . 0.0 110.847 174.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.54 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.0 tmtp? -146.34 143.61 29.22 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -170.374 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.486 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.2 tt -132.29 141.9 49.17 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 175.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.496 HD13 ' HA ' ' A' ' 55' ' ' ILE . 21.0 pt -132.57 169.79 21.26 Favored 'Isoleucine or valine' 0 C--O 1.241 0.653 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 170.501 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.615 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -153.64 169.74 22.53 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.354 175.636 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.1 tt -143.03 113.5 7.38 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 178.12 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 64' ' ' SER . 56.3 m -101.05 113.53 26.63 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 175.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.474 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -126.8 119.0 25.79 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 122.626 0.37 . . . . 0.0 110.405 -178.035 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.514 ' SG ' ' HB2' ' A' ' 13' ' ' MET . 51.7 t -125.26 138.53 31.86 Favored Pre-proline 0 N--CA 1.472 0.64 0 C-N-CA 123.339 0.656 . . . . 0.0 111.185 -172.635 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -68.38 -20.42 42.27 Favored 'Trans proline' 0 C--N 1.378 2.109 0 C-N-CA 123.096 2.531 . . . . 0.0 112.606 172.319 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.514 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 60.5 mtt -75.91 -46.36 30.38 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.635 0.774 . . . . 0.0 110.01 178.674 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 141.92 -161.49 27.13 Favored Glycine 0 C--N 1.346 1.138 0 CA-C-N 116.038 -0.528 . . . . 0.0 113.307 176.492 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 52.9 mt -74.2 -26.61 60.37 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 -170.806 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.73 -43.34 94.25 Favored 'General case' 0 N--CA 1.485 1.32 0 CA-C-O 121.498 0.666 . . . . 0.0 110.971 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 8.6 t-160 -71.56 -38.1 71.0 Favored 'General case' 0 C--O 1.247 0.935 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.385 -178.353 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 51.6 p -66.45 -32.02 73.14 Favored 'General case' 0 C--N 1.35 0.604 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.869 178.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 18.6 m-30 -72.14 -30.35 64.95 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.049 0.54 . . . . 0.0 111.694 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 41.0 mtm -67.28 -40.19 86.09 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 120.758 0.313 . . . . 0.0 110.456 173.178 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.46 -36.6 74.01 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.363 176.383 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.56 -50.38 58.78 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.828 0.851 . . . . 0.0 110.301 -178.449 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.484 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 8.7 tp-100 -58.32 -43.94 88.4 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.737 0.815 . . . . 0.0 110.44 179.098 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.48 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -62.73 -54.39 39.88 Favored 'General case' 0 CA--C 1.55 0.96 0 CA-C-N 115.66 -0.7 . . . . 0.0 112.052 -178.204 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 92.1 mt -64.69 -29.61 70.61 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.196 0.598 . . . . 0.0 111.536 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.503 ' O ' HG23 ' A' ' 30' ' ' VAL . 32.9 tt0 -65.91 -55.27 17.78 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.812 0.695 . . . . 0.0 110.012 -179.385 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.51 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 27.5 mm-40 -52.44 -47.5 66.37 Favored 'General case' 0 N--CA 1.484 1.261 0 O-C-N 124.359 1.037 . . . . 0.0 110.432 178.88 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.49 -51.68 67.59 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.502 1.121 . . . . 0.0 111.925 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.55 -23.39 65.42 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 115.332 -0.849 . . . . 0.0 113.184 178.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.503 HG23 ' O ' ' A' ' 26' ' ' GLU . 53.9 t -74.88 -37.6 42.13 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 178.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.51 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 17.4 mm-40 -72.75 -21.48 61.01 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.745 177.393 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -80.64 -13.76 58.76 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.532 0.733 . . . . 0.0 111.76 174.044 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 105.0 -37.79 3.62 Favored Glycine 0 C--N 1.347 1.191 0 N-CA-C 114.278 0.471 . . . . 0.0 114.278 167.012 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.622 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -76.75 -179.4 5.35 Favored 'General case' 0 N--CA 1.483 1.207 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -175.897 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.54 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 8.8 tp10 -73.05 153.06 41.01 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 114.453 -1.248 . . . . 0.0 110.31 176.496 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.486 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 6.7 p -142.46 128.06 17.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 123.273 0.629 . . . . 0.0 110.595 176.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 49.7 tptt -136.39 114.51 11.48 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 177.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.615 HG12 ' HB3' ' A' ' 7' ' ' ALA . 59.2 mt -117.39 111.31 34.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.925 0 C-N-CA 122.6 0.36 . . . . 0.0 111.877 -174.327 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -77.99 141.79 38.7 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.614 0.766 . . . . 0.0 109.099 171.449 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.417 HG22 ' HB2' ' A' ' 9' ' ' CYS . 17.4 p -124.64 117.51 24.44 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.53 0.732 . . . . 0.0 109.294 -177.666 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.474 ' O ' ' HA ' ' A' ' 10' ' ' ALA . 42.1 mt-30 -109.81 135.79 50.16 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.578 0.751 . . . . 0.0 110.146 178.44 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -161.68 179.59 36.97 Favored Glycine 0 C--N 1.336 0.57 0 N-CA-C 111.929 -0.468 . . . . 0.0 111.929 178.38 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.24 -14.51 63.0 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.127 0.571 . . . . 0.0 111.998 -179.271 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -84.78 -27.37 26.91 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.468 0.707 . . . . 0.0 111.347 176.238 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 147.19 -157.67 27.48 Favored Glycine 0 C--N 1.344 0.986 0 CA-C-N 116.413 -0.358 . . . . 0.0 112.545 -179.597 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.418 HG12 ' HG2' ' A' ' 41' ' ' GLN . 70.2 mt -127.48 132.35 69.39 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 C-N-CA 123.711 0.804 . . . . 0.0 109.995 178.829 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.408 ' HB3' ' OG1' ' A' ' 40' ' ' THR . 8.2 tp-100 -126.91 150.25 49.4 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.198 0.999 . . . . 0.0 110.586 -178.143 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 19.7 t30 61.43 41.5 12.69 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 124.966 1.306 . . . . 0.0 110.219 174.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 22.6 tpp180 -48.35 122.34 5.27 Favored 'General case' 0 C--N 1.356 0.873 0 C-N-CA 125.277 1.431 . . . . 0.0 112.544 -176.278 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.43 ' HB2' HH22 ' A' ' 74' ' ' ARG . 36.9 mt -66.73 148.99 51.18 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 114.605 -1.179 . . . . 0.0 110.621 170.107 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 34.4 p -104.45 167.81 9.5 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 172.24 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.61 -34.49 71.19 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-O 121.019 0.438 . . . . 0.0 110.461 175.52 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -63.76 -48.64 76.12 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.847 175.288 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -54.18 -42.35 69.57 Favored 'General case' 0 N--CA 1.496 1.873 0 C-N-CA 123.321 0.648 . . . . 0.0 111.791 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.617 HG22 ' HG3' ' A' ' 78' ' ' ARG . 43.2 mt -75.28 -27.96 19.97 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.939 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.041 -176.205 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -75.51 -45.9 35.49 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.485 0.714 . . . . 0.0 111.117 176.624 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -61.38 -35.3 77.1 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.342 1.057 . . . . 0.0 110.77 178.513 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -53.15 100.49 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.579 0 O-C-N 125.001 1.438 . . . . 0.0 112.582 -174.071 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 30.2 m -63.94 -36.45 84.0 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 114.673 -1.149 . . . . 0.0 109.067 167.858 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.5 HG23 HG21 ' A' ' 99' ' ' ILE . 80.0 mt -129.05 140.45 49.2 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 CA-C-N 114.769 -1.105 . . . . 0.0 109.794 178.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.529 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 35.1 mt -129.89 141.37 46.6 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 171.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.6 mp -127.02 112.55 29.22 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 CA-C-N 118.344 0.52 . . . . 0.0 109.632 172.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 8.6 m170 -89.17 83.95 6.52 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-O 121.745 0.783 . . . . 0.0 109.322 170.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.462 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 20.6 p -80.32 79.86 6.85 Favored 'General case' 0 C--O 1.24 0.567 0 CA-C-N 114.361 -1.29 . . . . 0.0 109.312 176.509 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 27.6 m -126.21 161.52 31.79 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 CA-C-O 121.685 0.755 . . . . 0.0 111.943 -170.375 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -123.08 -17.24 6.75 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 114.491 -1.231 . . . . 0.0 109.592 175.187 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 6.7 m -131.92 159.22 43.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 124.699 1.2 . . . . 0.0 108.401 173.666 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 79.0 m -64.45 111.83 6.46 Favored Pre-proline 0 CA--C 1.544 0.714 0 O-C-N 123.8 0.688 . . . . 0.0 109.663 177.348 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.512 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 55.8 Cg_endo -68.14 142.23 55.17 Favored 'Trans proline' 0 C--N 1.376 2.01 0 C-N-CA 122.175 1.916 . . . . 0.0 110.651 -179.157 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.425 ' HB2' HE22 ' A' ' 41' ' ' GLN . 18.4 mm-40 -65.36 -21.87 66.74 Favored 'General case' 0 N--CA 1.482 1.141 0 CA-C-O 121.327 0.584 . . . . 0.0 111.63 -173.496 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.838 ' HB3' HH11 ' A' ' 74' ' ' ARG . 4.0 m-20 -104.46 12.61 33.1 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.201 1.0 . . . . 0.0 112.737 -174.511 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.512 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 5.6 p30 -60.06 -24.95 64.98 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.558 0.743 . . . . 0.0 112.384 -176.044 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -60.89 -32.4 71.86 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.887 1.275 . . . . 0.0 113.08 -179.561 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.838 HH11 ' HB3' ' A' ' 71' ' ' ASP . 40.1 mtp180 -68.36 -25.32 65.02 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 124.338 1.055 . . . . 0.0 111.569 -179.418 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.433 ' HB3' HG21 ' A' ' 80' ' ' VAL . 33.0 m-85 -103.07 -2.21 27.87 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 114.139 -1.392 . . . . 0.0 111.277 -175.511 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -54.79 -42.76 72.16 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 124.639 1.176 . . . . 0.0 111.933 -179.136 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 58.5 p -82.86 -13.69 55.68 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.642 0.777 . . . . 0.0 112.358 -177.087 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.617 ' HG3' HG22 ' A' ' 55' ' ' ILE . 33.3 mmt180 -103.64 164.54 11.6 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.706 0.802 . . . . 0.0 111.63 -169.01 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -83.38 99.35 10.0 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 123.748 0.819 . . . . 0.0 110.146 -177.249 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.529 ' HA ' ' HB ' ' A' ' 61' ' ' ILE . 51.4 t -112.28 135.68 50.87 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 C-N-CA 123.643 0.777 . . . . 0.0 110.514 -174.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 73.6 m-85 -104.26 88.58 3.02 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 107.367 -1.345 . . . . 0.0 107.367 175.074 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -86.92 116.13 24.79 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 114.619 -1.173 . . . . 0.0 109.676 -172.203 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.439 HG13 ' HA ' ' A' ' 64' ' ' SER . 43.6 pt -126.24 -172.58 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 124.693 1.197 . . . . 0.0 110.106 -179.459 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 15.9 p -82.79 147.34 28.45 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.728 169.675 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.444 HD13 ' HB2' ' A' ' 11' ' ' CYS . 6.5 tt -62.85 -27.69 69.51 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.381 176.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.659 ' HG2' ' HE2' ' A' ' 90' ' ' LYS . 10.1 tt0 -71.11 -40.52 71.42 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 122.725 0.41 . . . . 0.0 111.113 177.016 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.43 ' HB3' HD12 ' A' ' 83' ' ' ILE . 24.5 t70 -59.86 -33.54 71.94 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.101 0.561 . . . . 0.0 110.195 176.695 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.54 -28.44 69.86 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.881 0.872 . . . . 0.0 112.739 177.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 63.9 mt -88.03 -49.04 14.77 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.992 0 C-N-CA 123.287 0.635 . . . . 0.0 110.273 -179.372 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.659 ' HE2' ' HG2' ' A' ' 86' ' ' GLN . 0.1 OUTLIER -79.46 -30.69 42.24 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 -173.599 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -123.31 16.8 9.81 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.148 0.579 . . . . 0.0 110.851 -170.088 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.48 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -40.22 -59.01 1.36 Allowed 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 124.304 1.042 . . . . 0.0 113.584 -173.111 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.56 -39.5 94.55 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 114.919 -1.037 . . . . 0.0 111.165 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -60.6 -46.78 93.76 Favored Glycine 0 C--N 1.354 1.553 0 O-C-N 124.304 1.003 . . . . 0.0 112.055 -178.386 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.428 HD12 ' HA ' ' A' ' 92' ' ' ALA . 34.1 mt -53.53 -62.21 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 124.893 1.277 . . . . 0.0 110.219 177.478 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.7 mp -55.04 -53.8 30.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 O-C-N 124.178 0.924 . . . . 0.0 111.227 -174.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.16 -28.93 69.15 Favored 'General case' 0 N--CA 1.485 1.302 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -175.072 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 50.5 mm-40 -71.93 -36.76 70.02 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 122.572 0.349 . . . . 0.0 110.418 176.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.5 HG21 HG23 ' A' ' 60' ' ' ILE . 55.3 mt -71.82 -35.59 55.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 179.403 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -59.05 -49.46 77.8 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-N 114.337 -1.301 . . . . 0.0 111.13 177.226 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -79.5 -25.96 41.69 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -175.861 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 65.2 mtm -69.04 -53.68 19.17 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 122.575 0.35 . . . . 0.0 110.393 174.772 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 26.6 mt -61.44 -49.22 85.36 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.281 177.296 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.524 ' O ' ' HG2' ' A' ' 108' ' ' GLN . . . -56.02 -39.97 72.73 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 122.961 0.505 . . . . 0.0 111.55 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 30.6 t -62.28 -45.84 91.46 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 123.981 0.8 . . . . 0.0 110.652 -177.187 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -78.82 -19.8 51.22 Favored 'General case' 0 N--CA 1.483 1.193 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 179.143 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 20.3 mm-40 -85.25 -12.62 52.06 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 122.84 0.456 . . . . 0.0 111.841 178.259 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.524 ' HG2' ' O ' ' A' ' 104' ' ' ALA . 76.8 mm-40 . . . . . 0 CA--C 1.556 1.21 0 CA-C-O 119.214 -0.422 . . . . 0.0 110.129 175.057 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.2 mtp . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 120.711 0.291 . . . . 0.0 110.317 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.7 m -67.29 99.69 0.73 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.566 0.746 . . . . 0.0 110.769 178.052 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.456 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 3.2 pttt -80.44 179.4 7.73 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.97 0.908 . . . . 0.0 110.229 177.201 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.431 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 3.6 tmtp? -143.86 139.56 29.31 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 -172.863 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.472 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 8.6 tt -128.86 140.15 51.82 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 176.45 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 23.1 pt -128.87 158.4 41.44 Favored 'Isoleucine or valine' 0 C--O 1.24 0.594 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 170.381 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.636 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -147.19 169.53 19.14 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 177.386 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.443 HD21 ' OE1' ' A' ' 41' ' ' GLN . 5.4 tt -143.68 117.9 9.56 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 -179.144 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.511 ' HA ' ' O ' ' A' ' 64' ' ' SER . 61.5 m -108.39 108.41 19.36 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.88 0.872 . . . . 0.0 109.364 176.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -123.3 124.11 42.25 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 122.783 0.433 . . . . 0.0 110.697 -179.18 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.772 ' SG ' HD13 ' A' ' 85' ' ' LEU . 1.3 m -142.67 144.61 30.74 Favored Pre-proline 0 N--CA 1.483 1.209 0 C-N-CA 123.218 0.607 . . . . 0.0 111.766 -179.493 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -83.65 -14.57 7.74 Favored 'Trans proline' 0 C--N 1.373 1.868 0 C-N-CA 123.496 2.797 . . . . 0.0 112.447 174.424 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 23.1 ttt -60.38 -53.23 60.14 Favored 'General case' 0 C--N 1.357 0.908 0 C-N-CA 123.411 0.684 . . . . 0.0 109.671 174.062 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 157.48 175.26 28.21 Favored Glycine 0 C--O 1.246 0.87 0 CA-C-N 115.136 -0.938 . . . . 0.0 112.047 -179.115 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 29.9 mt -67.37 -20.61 65.59 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 122.925 0.49 . . . . 0.0 111.877 177.438 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.9 -45.53 82.54 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-O 121.008 0.433 . . . . 0.0 110.792 174.439 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.474 ' HD1' ' HG ' ' A' ' 11' ' ' CYS . 12.1 t-160 -68.48 -44.8 73.97 Favored 'General case' 0 C--O 1.242 0.666 0 CA-C-N 115.366 -0.833 . . . . 0.0 109.86 -179.174 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.491 ' HA ' HD11 ' A' ' 85' ' ' LEU . 47.5 p -64.7 -37.99 89.48 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.413 -176.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.479 ' HZ ' ' HG2' ' A' ' 47' ' ' GLN . 13.2 m-85 -74.25 -28.2 61.11 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.191 0.596 . . . . 0.0 112.0 -178.044 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 67.5 mtm -69.63 -36.7 76.36 Favored 'General case' 0 N--CA 1.483 1.222 0 CA-C-N 118.024 0.375 . . . . 0.0 110.483 173.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.02 -40.2 71.92 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.95 174.302 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.32 -42.75 83.11 Favored 'General case' 0 C--O 1.217 -0.613 0 C-N-CA 123.715 0.806 . . . . 0.0 110.334 -178.508 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.476 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 8.9 tp-100 -61.7 -47.23 86.23 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.463 0.705 . . . . 0.0 109.503 178.556 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.563 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -62.03 -52.8 62.51 Favored 'General case' 0 CA--C 1.552 1.038 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.698 -177.799 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 75.6 mt -64.54 -32.63 74.35 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.535 0.734 . . . . 0.0 111.635 -179.193 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.58 ' HA ' HG21 ' A' ' 36' ' ' VAL . 30.6 tt0 -65.89 -55.7 15.6 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 123.688 0.617 . . . . 0.0 110.141 -179.129 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.558 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 19.9 mm-40 -55.82 -44.36 77.8 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 124.456 1.097 . . . . 0.0 110.255 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -57.01 -50.44 72.72 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.162 0.985 . . . . 0.0 111.66 177.745 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.62 -22.88 65.32 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 123.671 0.788 . . . . 0.0 113.096 178.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 26' ' ' GLU . 55.1 t -75.97 -40.16 37.81 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.715 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.558 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 7.1 mm-40 -72.67 -18.53 61.55 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.513 177.845 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -80.93 -12.28 59.43 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.112 0.965 . . . . 0.0 111.302 173.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 82.77 23.43 55.88 Favored Glycine 0 C--N 1.349 1.298 0 N-CA-C 114.764 0.666 . . . . 0.0 114.764 167.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.456 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.1 OUTLIER -129.55 176.96 7.57 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.283 0.633 . . . . 0.0 111.089 173.138 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.431 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 11.7 tp10 -72.86 153.39 41.06 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.131 178.865 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.58 HG21 ' HA ' ' A' ' 26' ' ' GLU . 6.4 p -141.5 128.96 21.36 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 C-N-CA 123.426 0.69 . . . . 0.0 110.637 179.603 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 47.7 tptt -135.78 111.13 9.08 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.521 0.728 . . . . 0.0 109.568 179.289 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.636 HG12 ' HB3' ' A' ' 7' ' ' ALA . 48.4 mt -116.15 113.45 43.23 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.235 0 N-CA-C 112.767 0.654 . . . . 0.0 112.767 -172.604 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -79.22 117.65 20.43 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 123.933 0.893 . . . . 0.0 110.047 176.257 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.437 ' OG1' ' HB3' ' A' ' 47' ' ' GLN . 3.3 p -103.51 103.93 13.95 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.237 0.615 . . . . 0.0 110.623 -179.612 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.443 ' OE1' HD21 ' A' ' 8' ' ' LEU . 31.3 mt-30 -98.62 132.17 44.23 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 -179.576 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -148.29 179.85 24.82 Favored Glycine 0 C--O 1.241 0.588 0 N-CA-C 111.483 -0.647 . . . . 0.0 111.483 177.419 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.78 -23.75 67.49 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.46 0.704 . . . . 0.0 111.348 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -67.76 -44.47 77.44 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.819 1.247 . . . . 0.0 110.173 174.051 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 150.61 -175.79 29.47 Favored Glycine 0 C--N 1.336 0.54 0 CA-C-N 114.822 -1.081 . . . . 0.0 111.482 -175.292 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.467 HG21 ' NH1' ' A' ' 49' ' ' ARG . 67.6 mt -98.86 111.66 29.03 Favored 'Isoleucine or valine' 0 C--O 1.24 0.587 0 C-N-CA 123.685 0.794 . . . . 0.0 109.78 -179.412 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.479 ' HG2' ' HZ ' ' A' ' 19' ' ' PHE . 64.1 tp60 -96.33 148.48 22.71 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.104 0.962 . . . . 0.0 110.084 177.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 25.8 t30 79.82 -54.21 0.39 Allowed 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 126.264 1.826 . . . . 0.0 111.571 173.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.467 ' NH1' HG21 ' A' ' 46' ' ' ILE . 17.7 tpp180 65.32 144.63 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.238 0 C-N-CA 125.347 1.459 . . . . 0.0 112.918 176.781 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 37.8 mt -112.29 129.9 56.12 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.391 1.077 . . . . 0.0 109.86 173.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 39.7 p -95.92 165.34 12.32 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.931 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.53 -30.46 63.08 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.479 0.712 . . . . 0.0 111.317 177.221 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -67.79 -47.34 69.4 Favored 'General case' 0 C--N 1.353 0.731 0 C-N-CA 123.699 0.8 . . . . 0.0 110.959 176.763 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -56.33 -44.42 79.98 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.386 0.674 . . . . 0.0 110.902 178.685 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.503 HG22 ' HG3' ' A' ' 78' ' ' ARG . 33.1 mt -72.39 -36.85 56.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 O-C-N 124.483 1.115 . . . . 0.0 111.277 -175.898 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.42 -44.01 68.79 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.385 0.674 . . . . 0.0 111.124 -178.676 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -86.31 -8.1 57.97 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.305 0.642 . . . . 0.0 111.998 -177.006 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.69 108.45 1.72 Allowed 'General case' 0 N--CA 1.473 0.71 0 O-C-N 123.709 0.63 . . . . 0.0 111.053 178.646 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 17.3 m -62.1 -37.22 84.28 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.429 167.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.584 HG23 HG21 ' A' ' 99' ' ' ILE . 76.5 mt -132.25 141.89 44.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 C-N-CA 124.363 1.065 . . . . 0.0 110.346 -176.543 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 27.2 mt -131.85 132.2 61.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 C-N-CA 123.916 0.887 . . . . 0.0 108.812 172.747 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.4 mp -119.23 133.25 66.67 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 172.126 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' HIS . . . . . 0.523 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 11.7 m170 -109.58 84.96 2.01 Favored 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 167.868 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.511 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 28.0 p -81.31 85.39 6.41 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 114.514 -1.221 . . . . 0.0 108.995 174.095 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 35.9 m -126.85 160.59 35.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-O 121.783 0.802 . . . . 0.0 111.982 -171.34 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -118.2 -19.01 9.18 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 114.007 -1.452 . . . . 0.0 109.116 176.016 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 5.8 m -132.19 160.49 42.45 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 C-N-CA 125.533 1.533 . . . . 0.0 108.037 176.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 63.8 m -59.47 116.78 17.77 Favored Pre-proline 0 C--O 1.244 0.766 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 174.243 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.524 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 37.9 Cg_endo -63.27 140.15 75.7 Favored 'Trans proline' 0 C--N 1.372 1.792 0 C-N-CA 121.949 1.766 . . . . 0.0 110.702 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -59.34 -38.11 79.51 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 123.92 0.762 . . . . 0.0 110.551 -174.708 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.435 ' HB3' ' HG3' ' A' ' 74' ' ' ARG . 4.4 m-20 -104.12 30.45 5.21 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 114.51 -1.223 . . . . 0.0 111.385 -174.13 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.524 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 7.2 p30 -59.89 -27.82 67.03 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.413 0.685 . . . . 0.0 110.858 177.582 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -60.04 -32.83 71.27 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.258 1.423 . . . . 0.0 112.262 176.397 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.435 ' HG3' ' HB3' ' A' ' 71' ' ' ASP . 12.1 mmp_? -66.26 -30.82 71.33 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 124.202 1.001 . . . . 0.0 111.715 -176.654 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -108.29 -2.06 19.56 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.962 -169.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -62.3 -35.27 78.52 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.265 0.626 . . . . 0.0 112.204 -172.824 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 69.8 p -75.74 -15.43 60.28 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.412 0.685 . . . . 0.0 112.014 -179.075 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.503 ' HG3' HG22 ' A' ' 55' ' ' ILE . 38.0 mmt180 -109.32 163.22 13.59 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.751 0.82 . . . . 0.0 111.153 -173.872 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 33.2 m-20 -76.42 109.25 9.98 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.463 0.705 . . . . 0.0 110.357 177.461 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 44.3 t -113.69 137.58 46.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 123.437 0.695 . . . . 0.0 109.918 179.339 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 79.7 m-85 -101.75 89.82 3.81 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 176.756 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.523 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 42.5 mt-10 -83.19 125.54 31.66 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.725 -174.631 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.509 HG13 ' HA ' ' A' ' 64' ' ' SER . 42.1 pt -136.09 -174.35 1.08 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 C-N-CA 124.928 1.291 . . . . 0.0 108.84 -179.558 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 22.0 p -87.45 152.3 22.34 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 120.911 0.386 . . . . 0.0 110.02 169.097 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.772 HD13 ' SG ' ' A' ' 11' ' ' CYS . 8.0 tt -66.26 -27.34 67.87 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.905 178.843 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.594 ' HG2' ' HE3' ' A' ' 90' ' ' LYS . 35.6 tt0 -63.76 -43.45 96.39 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.461 0.705 . . . . 0.0 110.719 173.782 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -61.61 -31.64 71.72 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.577 0.751 . . . . 0.0 110.818 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.02 -33.17 75.4 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.664 0.785 . . . . 0.0 112.433 177.159 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 86.0 mt -79.03 -46.79 23.44 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.846 0 C-N-CA 123.634 0.773 . . . . 0.0 110.524 -177.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.594 ' HE3' ' HG2' ' A' ' 86' ' ' GLN . 18.6 ptpt -81.9 -43.04 18.69 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.114 0.566 . . . . 0.0 111.994 -174.9 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 62.9 t30 -113.77 28.49 8.72 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.762 0.825 . . . . 0.0 110.907 -169.022 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.563 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -45.02 -62.1 1.37 Allowed 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -175.562 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.56 -36.51 82.9 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.056 -0.974 . . . . 0.0 110.913 -179.322 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -61.1 -48.54 85.45 Favored Glycine 0 C--N 1.354 1.569 0 O-C-N 124.616 1.198 . . . . 0.0 112.752 -178.668 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 22.5 mt -55.74 -56.77 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.169 0.988 . . . . 0.0 110.245 178.841 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.425 HG23 ' OH ' ' A' ' 34' ' ' TYR . 1.7 mp -55.75 -50.91 64.85 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.048 0 O-C-N 124.247 0.967 . . . . 0.0 111.71 -177.342 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -32.19 73.14 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 112.041 0.386 . . . . 0.0 112.041 -176.577 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -64.81 -39.02 92.9 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 123.7 0.625 . . . . 0.0 109.734 178.234 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.584 HG21 HG23 ' A' ' 60' ' ' ILE . 53.2 mt -73.14 -39.07 56.32 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.983 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -56.7 -48.99 76.47 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.973 0.909 . . . . 0.0 111.243 178.666 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -74.66 -32.35 62.21 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 123.631 0.582 . . . . 0.0 111.483 -175.282 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 69.3 mtm -66.02 -47.75 73.39 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 122.582 0.353 . . . . 0.0 110.688 175.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 30.5 mt -68.02 -39.18 81.09 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.411 179.103 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.15 -28.65 69.56 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.045 0.538 . . . . 0.0 111.083 177.724 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 18.2 t -74.15 -43.27 58.05 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 123.155 0.582 . . . . 0.0 110.949 -178.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -76.63 -34.88 58.32 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 122.93 0.492 . . . . 0.0 111.513 -179.144 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -75.85 -24.1 55.76 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 122.966 0.507 . . . . 0.0 111.574 -178.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 32.3 mm-40 . . . . . 0 N--CA 1.478 0.964 0 CA-C-O 118.458 -0.782 . . . . 0.0 109.789 177.608 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.1 mtt . . . . . 0 N--CA 1.482 1.133 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.1 t -70.63 86.42 0.65 Allowed 'General case' 0 CA--C 1.544 0.715 0 CA-C-O 121.322 0.582 . . . . 0.0 109.922 178.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 43.9 pttt -72.92 162.09 29.91 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.607 175.148 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.596 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.1 tmtp? -141.25 137.37 32.49 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 -170.187 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.477 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 10.2 tt -130.01 130.32 44.84 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 178.381 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.5 HD12 HD13 ' A' ' 50' ' ' LEU . 14.2 pt -121.34 165.61 16.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 172.589 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.599 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -152.09 169.15 23.11 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.641 176.51 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.9 tt -141.45 115.46 9.25 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.528 ' HA ' ' O ' ' A' ' 64' ' ' SER . 62.1 m -107.24 111.61 24.09 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 177.68 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.449 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -125.69 112.66 16.37 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 122.474 0.31 . . . . 0.0 111.106 -175.181 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.521 ' HB2' HD13 ' A' ' 85' ' ' LEU . 36.0 t -127.43 136.2 28.58 Favored Pre-proline 0 N--CA 1.473 0.693 0 C-N-CA 123.791 0.836 . . . . 0.0 110.442 -179.261 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -76.07 -19.48 15.65 Favored 'Trans proline' 0 C--N 1.365 1.447 0 C-N-CA 122.972 2.448 . . . . 0.0 112.791 177.15 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.447 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 21.7 mmt -71.89 -31.94 66.93 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.513 0.725 . . . . 0.0 110.663 -178.91 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 149.24 175.67 21.82 Favored Glycine 0 C--N 1.348 1.216 0 CA-C-N 115.789 -0.642 . . . . 0.0 112.675 177.198 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.6 mt -73.67 -19.57 60.79 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.582 0.753 . . . . 0.0 112.509 -179.395 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.04 -44.09 87.2 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-O 121.189 0.518 . . . . 0.0 111.325 177.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 11.9 t-160 -66.69 -41.51 87.93 Favored 'General case' 0 C--O 1.247 0.923 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.275 179.075 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 34.2 p -66.77 -32.78 74.29 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.99 -178.595 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.6 m-30 -69.49 -31.63 70.01 Favored 'General case' 0 C--N 1.354 0.772 0 C-N-CA 123.246 0.618 . . . . 0.0 111.25 178.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 64.5 mtm -67.01 -41.15 87.14 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-O 120.639 0.257 . . . . 0.0 110.901 175.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.14 -44.55 83.88 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.065 174.416 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.13 -41.28 97.27 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.954 0.901 . . . . 0.0 110.895 -177.415 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -57.17 -54.75 43.21 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.981 0.912 . . . . 0.0 109.949 177.73 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.06 -42.87 93.79 Favored 'General case' 0 CA--C 1.553 1.06 0 CA-C-N 114.953 -1.021 . . . . 0.0 111.99 -174.279 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.424 HD11 ' OG ' ' A' ' 64' ' ' SER . 89.2 mt -68.11 -35.77 78.68 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 123.13 0.572 . . . . 0.0 111.265 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.558 ' HA ' HG21 ' A' ' 36' ' ' VAL . 35.6 tt0 -62.19 -53.0 61.56 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 123.837 0.71 . . . . 0.0 109.725 -178.455 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.447 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 45.3 mt-10 -54.59 -46.77 73.82 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 114.547 -1.206 . . . . 0.0 110.402 179.442 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.58 -52.12 67.03 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.323 1.049 . . . . 0.0 111.729 -178.488 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.94 -24.31 67.48 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 178.703 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 26' ' ' GLU . 50.5 t -77.09 -42.35 31.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.414 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 19.6 mm-40 -66.67 -28.39 68.42 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 114.604 -1.18 . . . . 0.0 110.344 175.24 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -80.18 -25.08 39.89 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.211 1.005 . . . . 0.0 111.923 176.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.96 32.74 7.74 Favored Glycine 0 C--N 1.344 0.999 0 N-CA-C 114.264 0.466 . . . . 0.0 114.264 170.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -102.4 163.48 12.21 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 117.36 0.58 . . . . 0.0 109.592 168.5 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.596 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 41.0 tt0 -73.66 124.97 26.99 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 106.502 -1.666 . . . . 0.0 106.502 158.509 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.558 HG21 ' HA ' ' A' ' 26' ' ' GLU . 13.5 p -111.27 137.32 44.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 CA-C-N 118.635 0.652 . . . . 0.0 110.72 -174.335 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 45.0 tptt -148.21 111.77 5.02 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 178.741 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.599 HG12 ' HB3' ' A' ' 7' ' ' ALA . 48.9 mt -116.94 110.63 31.98 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 122.602 0.361 . . . . 0.0 111.891 -173.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -77.92 115.25 17.52 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 123.238 0.615 . . . . 0.0 109.658 176.267 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 7.0 p -95.76 108.09 20.38 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.938 177.605 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.54 ' HG2' HG12 ' A' ' 46' ' ' ILE . 42.2 mt-30 -100.97 154.02 19.04 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.256 0.623 . . . . 0.0 110.679 176.2 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -171.08 -178.39 41.56 Favored Glycine 0 C--O 1.238 0.379 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.617 178.177 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.34 -26.05 66.3 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.089 0.556 . . . . 0.0 111.327 178.348 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -65.8 -39.41 90.91 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.495 0.718 . . . . 0.0 110.117 171.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 142.18 -151.99 23.32 Favored Glycine 0 C--N 1.341 0.852 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.969 -178.426 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.54 HG12 ' HG2' ' A' ' 41' ' ' GLN . 65.2 mt -113.21 145.25 19.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 123.683 0.793 . . . . 0.0 110.067 -174.112 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -140.01 149.28 43.02 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.865 0.866 . . . . 0.0 110.137 -179.267 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 44.1 t30 79.1 -49.94 0.43 Allowed 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 126.487 1.915 . . . . 0.0 110.043 178.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 21.7 tpp180 66.86 122.82 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.869 1.667 . . . . 0.0 113.339 169.722 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.5 HD13 HD12 ' A' ' 6' ' ' ILE . 39.4 mt -92.31 146.41 23.72 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 114.772 -1.104 . . . . 0.0 110.55 172.481 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.42 ' O ' HG13 ' A' ' 55' ' ' ILE . 66.4 p -105.12 166.63 10.26 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.744 0.818 . . . . 0.0 109.693 176.478 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.06 -29.49 69.77 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 122.931 0.492 . . . . 0.0 110.562 176.752 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -72.27 -41.14 67.06 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.43 177.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -59.5 -43.49 93.34 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 122.836 0.454 . . . . 0.0 110.927 177.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.663 HG22 ' HG3' ' A' ' 78' ' ' ARG . 23.1 mt -74.38 -32.32 30.62 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 O-C-N 123.961 0.788 . . . . 0.0 110.891 -176.692 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.57 -41.5 62.83 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.434 0.694 . . . . 0.0 111.619 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -91.27 -3.04 57.26 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.554 0.742 . . . . 0.0 111.398 -177.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.55 106.22 1.11 Allowed 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 122.948 0.499 . . . . 0.0 110.437 176.239 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 27.7 m -60.26 -36.92 78.9 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.846 0.858 . . . . 0.0 109.44 169.755 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 72.8 mt -137.27 143.35 34.68 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 123.904 0.882 . . . . 0.0 110.315 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.498 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 26.3 mt -127.81 135.64 62.48 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 171.46 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -124.12 111.16 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 CA-C-N 118.405 0.548 . . . . 0.0 109.526 173.442 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 12.1 m170 -88.24 85.28 6.89 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-O 121.586 0.708 . . . . 0.0 109.524 174.35 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.528 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 25.0 m -81.01 82.64 6.92 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.542 176.767 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 29.5 m -125.93 155.78 35.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 CA-C-O 121.965 0.888 . . . . 0.0 112.209 -170.563 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -107.87 -25.07 11.39 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 113.91 -1.496 . . . . 0.0 109.365 175.751 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 15.0 m -131.4 171.15 18.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 125.328 1.451 . . . . 0.0 108.664 176.67 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 22.1 m -64.72 116.87 32.85 Favored Pre-proline 0 CA--C 1.55 0.974 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 171.533 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.43 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 37.0 Cg_endo -66.71 145.56 75.91 Favored 'Trans proline' 0 C--N 1.372 1.773 0 C-N-CA 121.506 1.471 . . . . 0.0 110.388 174.393 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.451 ' HB2' HE22 ' A' ' 41' ' ' GLN . 42.2 mm-40 -64.52 -28.98 70.02 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.241 0.616 . . . . 0.0 111.406 -176.138 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.601 ' HB3' HH11 ' A' ' 74' ' ' ARG . 0.9 OUTLIER -103.17 18.24 22.19 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.468 1.107 . . . . 0.0 111.616 -173.901 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.43 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 6.7 p30 -56.65 -32.4 65.32 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 124.385 1.074 . . . . 0.0 113.018 -175.274 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.46 ' HA ' ' HB2' ' A' ' 76' ' ' GLU . 2.1 pp20? -76.38 -18.16 59.01 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.704 0.802 . . . . 0.0 112.515 -171.17 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.601 HH11 ' HB3' ' A' ' 71' ' ' ASP . 41.0 mtp180 -67.4 -26.68 66.55 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.018 0.927 . . . . 0.0 111.312 174.063 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -104.01 -4.36 23.43 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 114.463 -1.244 . . . . 0.0 111.017 -176.042 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.46 ' HB2' ' HA ' ' A' ' 73' ' ' GLU . 37.9 tt0 -61.96 -32.2 72.61 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 124.579 1.152 . . . . 0.0 112.474 -173.692 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 32.0 t -92.13 3.91 54.29 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.392 0.677 . . . . 0.0 111.836 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.663 ' HG3' HG22 ' A' ' 55' ' ' ILE . 39.8 mmt180 -117.61 166.3 12.56 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.718 0.807 . . . . 0.0 111.446 -177.036 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -79.35 94.24 5.46 Favored 'General case' 0 C--O 1.244 0.789 0 C-N-CA 123.675 0.79 . . . . 0.0 110.673 -177.245 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.498 ' HA ' ' HB ' ' A' ' 61' ' ' ILE . 60.8 t -104.97 141.35 20.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 124.151 0.98 . . . . 0.0 110.727 -178.369 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -114.52 88.71 2.92 Favored 'General case' 0 C--O 1.24 0.553 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 174.436 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -84.59 120.97 26.97 Favored 'General case' 0 C--N 1.346 0.442 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.363 -174.523 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.434 HD12 ' HB3' ' A' ' 87' ' ' ASP . 48.5 pt -125.24 -179.33 2.35 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 124.434 1.094 . . . . 0.0 109.466 177.491 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 24.1 p -76.83 148.22 36.68 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.533 168.464 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.521 HD13 ' HB2' ' A' ' 11' ' ' CYS . 4.7 tt -62.51 -28.64 69.98 Favored 'General case' 0 N--CA 1.481 1.098 0 O-C-N 124.046 0.841 . . . . 0.0 111.27 179.47 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -64.3 -44.92 90.14 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.285 0.634 . . . . 0.0 111.266 176.26 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.434 ' HB3' HD12 ' A' ' 83' ' ' ILE . 24.3 t70 -59.98 -31.47 69.94 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.542 0.737 . . . . 0.0 110.649 -177.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.19 -26.61 64.92 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.943 0.897 . . . . 0.0 112.922 179.482 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 57.0 mt -85.24 -40.1 14.55 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.964 0 C-N-CA 123.111 0.564 . . . . 0.0 110.459 -179.11 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.44 -56.1 3.45 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 122.793 0.437 . . . . 0.0 111.795 -176.625 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -95.46 20.53 9.35 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.843 0.857 . . . . 0.0 110.959 -170.296 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.508 ' HA ' HD12 ' A' ' 95' ' ' ILE . . . -43.22 -62.34 1.08 Allowed 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 124.607 1.163 . . . . 0.0 114.132 -172.575 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.21 -34.59 75.35 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.028 178.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.07 -43.04 99.38 Favored Glycine 0 C--N 1.351 1.407 0 O-C-N 124.495 1.122 . . . . 0.0 112.758 178.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.508 HD12 ' HA ' ' A' ' 92' ' ' ALA . 22.2 mt -62.37 -57.96 9.71 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 C-N-CA 124.185 0.994 . . . . 0.0 109.973 -177.951 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.43 HG13 HD11 ' A' ' 5' ' ' LEU . 2.0 mp -58.4 -45.71 89.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 O-C-N 124.093 0.87 . . . . 0.0 110.608 -175.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 2.5 pptp? -69.72 -27.62 65.13 Favored 'General case' 0 N--CA 1.48 1.047 0 O-C-N 123.605 0.565 . . . . 0.0 111.556 -177.368 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 38.9 mm-40 -62.91 -42.55 99.83 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 174.347 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 13.1 mt -78.43 -33.36 17.22 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.387 -175.194 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -54.79 -53.69 51.87 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.604 1.162 . . . . 0.0 111.281 171.619 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -72.16 -33.77 67.97 Favored 'General case' 0 N--CA 1.48 1.064 0 O-C-N 123.594 0.559 . . . . 0.0 111.25 -175.337 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 71.1 mtm -64.29 -49.3 72.34 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 122.937 0.495 . . . . 0.0 110.592 177.134 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 36.8 mt -67.05 -42.16 88.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 C-N-CA 123.232 0.613 . . . . 0.0 110.302 177.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.88 -12.56 61.61 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 122.925 0.49 . . . . 0.0 111.843 -179.082 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 29.9 t -92.4 -39.71 11.28 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 122.609 0.364 . . . . 0.0 110.804 176.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -78.71 -28.18 45.07 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.757 0.423 . . . . 0.0 111.458 -177.311 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.7 mm-40 -84.35 -41.33 16.87 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.175 0.59 . . . . 0.0 109.876 178.454 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 76.3 mm-40 . . . . . 0 C--O 1.255 1.35 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.632 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.9 mtt . . . . . 0 N--CA 1.48 1.049 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.7 t -72.13 90.96 1.23 Allowed 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 176.534 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.63 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 13.4 pttt -65.96 174.25 2.57 Favored 'General case' 0 C--O 1.247 0.962 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.179 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.514 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.2 tmtp? -142.96 142.48 31.66 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 121.102 0.477 . . . . 0.0 109.81 -171.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.474 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.0 tt -131.34 136.17 47.86 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 176.084 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.411 HG22 ' HE2' ' A' ' 4' ' ' LYS . 17.1 pt -126.72 159.1 36.76 Favored 'Isoleucine or valine' 0 C--O 1.239 0.509 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 170.306 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.619 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -145.28 168.91 19.32 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 176.534 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.427 HD21 ' OE1' ' A' ' 41' ' ' GLN . 4.3 tt -144.88 112.09 6.02 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 -176.915 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.522 ' HA ' ' O ' ' A' ' 64' ' ' SER . 49.9 m -101.25 109.65 21.54 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.068 0.947 . . . . 0.0 109.12 176.385 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.42 ' HB3' HG12 ' A' ' 65' ' ' VAL . . . -127.47 115.81 19.46 Favored 'General case' 0 N--CA 1.489 1.513 0 CA-C-O 120.839 0.352 . . . . 0.0 110.674 -178.459 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.559 ' HB2' HD13 ' A' ' 85' ' ' LEU . 44.0 t -123.43 142.93 40.06 Favored Pre-proline 0 N--CA 1.476 0.855 0 C-N-CA 123.926 0.89 . . . . 0.0 110.247 -176.501 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -72.58 -16.64 26.97 Favored 'Trans proline' 0 C--N 1.37 1.687 0 C-N-CA 122.938 2.425 . . . . 0.0 113.093 174.404 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 82.8 mtp -72.67 -54.91 7.72 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.393 0.677 . . . . 0.0 111.078 -179.172 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.413 ' HA2' ' H ' ' A' ' 43' ' ' ALA . . . 161.3 -177.76 37.5 Favored Glycine 0 C--N 1.342 0.875 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.845 -175.713 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 39.9 mt -75.19 -14.44 60.54 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -177.399 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.41 -49.73 76.42 Favored 'General case' 0 C--O 1.249 1.066 0 CA-C-O 121.337 0.589 . . . . 0.0 111.086 177.168 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.402 ' ND1' HD22 ' A' ' 85' ' ' LEU . 5.8 t-160 -64.98 -40.24 94.67 Favored 'General case' 0 C--O 1.248 1.004 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.224 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 32.7 p -67.3 -36.43 81.49 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.307 -178.329 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.8 m-30 -69.26 -32.84 72.31 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.127 0.571 . . . . 0.0 111.453 -178.338 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 62.5 mtm -67.93 -38.2 82.58 Favored 'General case' 0 N--CA 1.483 1.175 0 O-C-N 123.175 0.297 . . . . 0.0 110.81 175.76 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -69.7 -40.53 76.26 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.364 174.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.7 -37.1 81.81 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.899 0.88 . . . . 0.0 110.562 -178.517 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.477 ' O ' ' HG3' ' A' ' 27' ' ' GLU . 32.6 tt0 -62.52 -53.01 61.14 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.846 175.661 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.45 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -64.75 -47.5 77.98 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 115.587 -0.733 . . . . 0.0 112.183 -173.074 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 85.1 mt -64.43 -34.46 78.25 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.07 0.548 . . . . 0.0 111.431 178.543 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.505 ' O ' HG23 ' A' ' 30' ' ' VAL . 38.3 tt0 -61.92 -54.76 37.5 Favored 'General case' 0 C--N 1.349 0.578 0 O-C-N 123.686 0.616 . . . . 0.0 109.894 177.618 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.567 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 44.9 mt-10 -49.42 -52.12 30.78 Favored 'General case' 0 N--CA 1.48 1.048 0 O-C-N 124.632 1.207 . . . . 0.0 110.73 179.54 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.417 ' HB1' ' HA ' ' A' ' 93' ' ' ALA . . . -56.18 -52.05 65.81 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.807 1.243 . . . . 0.0 112.098 -179.664 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.38 -22.52 66.25 Favored 'General case' 0 CA--C 1.55 0.947 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 179.505 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 26' ' ' GLU . 55.8 t -76.25 -37.5 32.08 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.256 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 178.597 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.567 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 16.2 mm-40 -76.48 -19.89 57.55 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 114.725 -1.125 . . . . 0.0 110.475 178.802 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -78.44 -19.0 54.11 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.672 0.789 . . . . 0.0 111.198 172.705 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 97.01 1.24 59.75 Favored Glycine 0 C--N 1.349 1.263 0 N-CA-C 115.2 0.84 . . . . 0.0 115.2 165.799 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.63 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -108.24 173.58 6.26 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-N 117.85 0.825 . . . . 0.0 112.089 176.255 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.514 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 34.2 tt0 -71.07 145.91 49.6 Favored 'General case' 0 C--N 1.35 0.612 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.656 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.493 HG21 ' HA ' ' A' ' 26' ' ' GLU . 7.4 p -135.34 128.64 48.72 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 122.741 0.416 . . . . 0.0 111.165 -179.566 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.5 tptt -135.75 115.55 13.02 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 176.44 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.619 HG12 ' HB3' ' A' ' 7' ' ' ALA . 49.3 mt -117.09 113.42 42.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 N-CA-C 111.995 0.369 . . . . 0.0 111.995 -176.16 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -75.62 147.81 39.25 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.894 0.878 . . . . 0.0 109.221 171.177 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.443 HG22 ' HB2' ' A' ' 9' ' ' CYS . 13.6 p -134.57 123.93 24.65 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.156 0.983 . . . . 0.0 109.208 -176.852 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.469 ' HG2' HG23 ' A' ' 46' ' ' ILE . 23.7 mt-30 -125.62 136.5 53.33 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 -176.928 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -163.59 -160.42 11.58 Favored Glycine 0 N--CA 1.465 0.605 0 C-N-CA 121.851 -0.214 . . . . 0.0 112.677 -179.1 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.413 ' H ' ' HA2' ' A' ' 14' ' ' GLY . . . -60.91 -28.77 69.16 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.957 0.903 . . . . 0.0 111.787 177.235 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -86.27 2.35 47.54 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.021 0.928 . . . . 0.0 111.51 -178.759 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 94.22 -157.48 22.65 Favored Glycine 0 C--N 1.34 0.773 0 N-CA-C 112.134 -0.386 . . . . 0.0 112.134 -176.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.469 HG23 ' HG2' ' A' ' 41' ' ' GLN . 40.8 mt -106.44 144.86 14.94 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 C-N-CA 123.601 0.76 . . . . 0.0 110.306 -172.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -143.02 148.12 36.23 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.005 1.322 . . . . 0.0 108.822 -174.175 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 10.1 t30 58.86 40.96 22.14 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 124.362 1.065 . . . . 0.0 110.517 175.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 9.5 tpp180 -47.35 133.28 12.62 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.763 1.625 . . . . 0.0 113.069 -172.476 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 47.5 mt -83.35 126.75 33.03 Favored 'General case' 0 C--O 1.242 0.693 0 C-N-CA 123.879 0.872 . . . . 0.0 110.383 173.292 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.408 ' O ' HG13 ' A' ' 55' ' ' ILE . 37.0 p -88.79 164.5 15.21 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.664 178.323 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.74 -30.37 67.45 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.148 0.579 . . . . 0.0 110.963 175.628 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.405 ' O ' ' HG3' ' A' ' 57' ' ' GLU . 29.2 tt0 -66.91 -48.48 68.57 Favored 'General case' 0 C--N 1.355 0.819 0 C-N-CA 122.972 0.509 . . . . 0.0 110.57 175.36 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -50.84 -44.96 59.47 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 123.504 0.721 . . . . 0.0 111.355 177.75 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.408 HG13 ' O ' ' A' ' 51' ' ' THR . 26.4 mt -72.5 -35.68 51.99 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.051 0 CA-C-N 114.449 -1.25 . . . . 0.0 111.107 -177.152 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.45 -37.17 77.22 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.49 0.716 . . . . 0.0 111.172 179.41 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.405 ' HG3' ' O ' ' A' ' 53' ' ' GLN . 57.6 mt-10 -75.13 -33.46 61.57 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.746 0.818 . . . . 0.0 110.773 177.723 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -54.93 99.81 0.03 OUTLIER 'General case' 0 C--N 1.355 0.81 0 O-C-N 124.699 1.249 . . . . 0.0 112.315 -172.315 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 23.8 m -63.19 -32.9 74.4 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-N 114.531 -1.213 . . . . 0.0 109.241 168.602 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.481 HG23 HG21 ' A' ' 99' ' ' ILE . 81.5 mt -133.71 139.04 49.6 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 C-N-CA 124.367 1.067 . . . . 0.0 109.827 -179.265 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.6 mt -131.39 130.55 62.94 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 173.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.3 mp -116.25 126.09 73.58 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 172.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 14.8 m170 -99.98 86.09 3.19 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 167.271 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.522 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 20.0 p -80.41 81.87 6.57 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 114.633 -1.167 . . . . 0.0 108.94 174.363 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.42 HG12 ' HB3' ' A' ' 10' ' ' ALA . 29.8 m -129.87 165.05 30.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.225 -170.377 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -121.98 -14.83 7.95 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.445 1.098 . . . . 0.0 109.318 170.567 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 9.4 m -127.97 177.05 6.45 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 125.013 1.325 . . . . 0.0 109.516 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 37.2 m -75.9 118.47 71.34 Favored Pre-proline 0 CA--C 1.545 0.75 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 173.353 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.54 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 48.4 Cg_endo -65.97 146.81 83.63 Favored 'Trans proline' 0 C--N 1.373 1.82 0 C-N-CA 122.141 1.894 . . . . 0.0 111.18 175.239 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -65.33 -41.06 94.36 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.341 0.657 . . . . 0.0 110.624 -177.264 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -88.39 15.2 8.14 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 115.349 -0.841 . . . . 0.0 112.146 -175.536 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.54 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 6.0 p30 -55.69 -28.62 56.56 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 123.859 0.864 . . . . 0.0 112.041 -177.144 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.563 ' HG3' ' HG3' ' A' ' 74' ' ' ARG . 8.9 pt-20 -56.53 -37.22 70.18 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 124.694 1.198 . . . . 0.0 112.343 175.907 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.563 ' HG3' ' HG3' ' A' ' 73' ' ' GLU . 81.4 mtt85 -80.11 -17.05 53.61 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.815 1.246 . . . . 0.0 112.079 -176.713 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.517 ' HB3' HG21 ' A' ' 80' ' ' VAL . 66.6 m-85 -107.4 -2.68 20.31 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.574 0.749 . . . . 0.0 110.999 178.041 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -55.06 -49.04 72.62 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.494 1.118 . . . . 0.0 112.663 -172.528 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 81.0 p -91.6 0.51 57.49 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.127 0.571 . . . . 0.0 112.379 -176.536 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -104.62 161.52 14.06 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.276 0.63 . . . . 0.0 111.202 -170.347 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 -72.67 93.57 1.65 Allowed 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.355 0.662 . . . . 0.0 110.929 -175.74 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.517 HG21 ' HB3' ' A' ' 75' ' ' PHE . 44.2 t -116.85 133.01 64.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 123.206 0.602 . . . . 0.0 110.86 -175.077 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 66.1 m-85 -105.84 91.3 3.69 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.776 1.23 . . . . 0.0 108.553 177.125 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -78.88 110.12 13.78 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.611 0.764 . . . . 0.0 110.87 -175.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.445 HG13 ' HA ' ' A' ' 64' ' ' SER . 42.1 pt -117.31 -173.78 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 124.471 1.109 . . . . 0.0 109.561 176.043 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 40.4 p -86.8 149.73 24.64 Favored 'General case' 0 C--O 1.239 0.539 0 CA-C-O 121.071 0.462 . . . . 0.0 110.376 170.449 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.559 HD13 ' HB2' ' A' ' 11' ' ' CYS . 7.2 tt -64.52 -30.61 71.64 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.779 177.149 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -64.47 -43.79 93.1 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.879 176.289 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -63.74 -28.84 70.16 Favored 'General case' 0 N--CA 1.479 1.015 0 O-C-N 123.516 0.51 . . . . 0.0 110.629 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.1 -32.89 74.82 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.739 0.816 . . . . 0.0 112.292 177.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 64.6 mt -79.96 -42.69 22.28 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.835 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.414 -177.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -85.85 -47.34 9.77 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -175.086 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -106.15 25.45 10.98 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 124.081 0.952 . . . . 0.0 110.736 -170.199 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.45 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -41.92 -60.79 1.29 Allowed 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 124.253 1.021 . . . . 0.0 113.372 -175.144 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.417 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . . . -65.0 -34.1 77.64 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.602 -178.97 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.69 -45.8 93.6 Favored Glycine 0 C--N 1.346 1.103 0 O-C-N 124.183 0.927 . . . . 0.0 112.253 -178.62 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 22.6 mt -60.1 -57.09 13.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 124.445 1.098 . . . . 0.0 110.266 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.9 mp -56.42 -50.05 74.24 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 O-C-N 123.945 0.778 . . . . 0.0 110.846 -178.39 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.87 -27.98 67.14 Favored 'General case' 0 N--CA 1.485 1.298 0 O-C-N 123.389 0.431 . . . . 0.0 111.304 -176.245 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.419 ' O ' ' HG3' ' A' ' 102' ' ' MET . 48.4 mm-40 -65.65 -40.78 92.82 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.316 0.646 . . . . 0.0 109.896 175.365 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.481 HG21 HG23 ' A' ' 60' ' ' ILE . 32.7 mt -75.83 -34.05 27.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 N-CA-C 109.152 -0.685 . . . . 0.0 109.152 -176.815 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -60.54 -50.34 73.92 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 114.419 -1.264 . . . . 0.0 111.147 174.249 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -72.19 -33.3 67.55 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 122.751 0.42 . . . . 0.0 110.969 -176.47 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.419 ' HG3' ' O ' ' A' ' 98' ' ' GLU . 69.3 mtm -63.63 -58.2 7.69 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 122.751 0.42 . . . . 0.0 110.148 177.689 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 63.4 mt -62.38 -41.29 91.17 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.929 0 O-C-N 123.893 0.746 . . . . 0.0 110.587 -179.385 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.22 -32.52 74.24 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 122.541 0.337 . . . . 0.0 111.562 179.703 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 38.5 t -73.52 -37.43 65.65 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-O 120.887 0.375 . . . . 0.0 110.717 -176.561 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -85.16 -25.77 27.23 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.808 -177.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -85.6 -40.17 16.53 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 122.811 0.444 . . . . 0.0 111.516 178.799 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 81.8 mm-40 . . . . . 0 CA--C 1.55 0.978 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 174.943 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.3 ttm . . . . . 0 N--CA 1.479 1.002 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.5 t -80.08 171.04 15.62 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.99 0.916 . . . . 0.0 110.245 174.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -101.08 -178.85 3.87 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.022 0.929 . . . . 0.0 110.782 -174.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.534 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 3.8 tmtp? -144.03 143.67 31.29 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -173.749 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.483 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.0 tt -134.56 142.18 46.9 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 177.851 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.416 HD13 ' HA ' ' A' ' 55' ' ' ILE . 21.6 pt -133.39 168.43 24.13 Favored 'Isoleucine or valine' 0 C--O 1.243 0.742 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 170.773 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.622 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -152.3 169.99 21.15 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.342 175.384 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.4 tt -140.24 112.19 7.57 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 106.811 -1.551 . . . . 0.0 106.811 178.096 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.529 ' HB2' HG22 ' A' ' 40' ' ' THR . 68.9 m -102.05 109.35 21.04 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 177.263 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.447 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -128.71 113.79 15.81 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 122.759 0.424 . . . . 0.0 111.273 -176.915 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.74 ' SG ' HD13 ' A' ' 85' ' ' LEU . 2.2 m -130.98 146.61 62.9 Favored Pre-proline 0 N--CA 1.474 0.727 0 C-N-CA 123.481 0.712 . . . . 0.0 110.111 174.038 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -88.39 15.76 2.01 Favored 'Trans proline' 0 C--N 1.37 1.694 0 C-N-CA 123.331 2.688 . . . . 0.0 111.427 175.246 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 16.9 tpt -138.27 76.13 1.56 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.455 1.102 . . . . 0.0 109.16 178.426 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.77 132.31 4.25 Favored Glycine 0 C--N 1.34 0.802 0 CA-C-N 115.123 -0.944 . . . . 0.0 114.186 167.25 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 22.4 mt -66.39 -22.45 66.24 Favored 'General case' 0 C--O 1.216 -0.707 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 163.608 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.21 -40.09 73.48 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.316 0.646 . . . . 0.0 110.921 171.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.496 ' ND1' HD22 ' A' ' 85' ' ' LEU . 4.5 t-80 -68.99 -45.13 71.39 Favored 'General case' 0 C--O 1.245 0.865 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 178.39 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 35.5 p -66.19 -30.0 70.38 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.798 -178.511 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -80.12 -27.21 39.18 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.181 0.593 . . . . 0.0 111.418 -178.175 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 66.6 mtm -66.7 -38.72 87.32 Favored 'General case' 0 N--CA 1.482 1.142 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 171.098 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -72.55 -40.15 66.92 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.518 176.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.61 -51.58 58.54 Favored 'General case' 0 C--O 1.217 -0.635 0 C-N-CA 123.851 0.86 . . . . 0.0 109.979 -177.333 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.421 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 6.8 tp-100 -62.81 -38.89 92.49 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 123.766 0.666 . . . . 0.0 110.52 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.584 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -62.42 -53.43 54.94 Favored 'General case' 0 CA--C 1.551 1.013 0 O-C-N 123.642 0.589 . . . . 0.0 111.419 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 93.4 mt -66.47 -29.86 70.07 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 123.491 0.716 . . . . 0.0 111.295 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.557 ' HA ' HG21 ' A' ' 36' ' ' VAL . 38.4 tt0 -64.84 -54.73 26.51 Favored 'General case' 0 C--N 1.346 0.449 0 C-N-CA 123.581 0.753 . . . . 0.0 109.807 -179.559 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.492 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 12.7 mm-40 -55.21 -49.09 72.82 Favored 'General case' 0 N--CA 1.479 1.025 0 O-C-N 124.505 1.128 . . . . 0.0 110.355 178.64 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.78 -46.68 81.35 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.656 1.183 . . . . 0.0 111.795 -178.102 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.78 -28.96 68.05 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 115.147 -0.933 . . . . 0.0 112.681 177.073 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 26' ' ' GLU . 56.1 t -72.86 -37.35 54.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 179.148 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 9.1 mm-40 -72.21 -26.98 62.26 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.641 178.616 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.45 -32.85 72.05 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.294 0.638 . . . . 0.0 110.902 172.801 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 104.33 18.8 12.42 Favored Glycine 0 C--N 1.346 1.121 0 N-CA-C 114.606 0.602 . . . . 0.0 114.606 169.359 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -122.19 -179.85 4.3 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.174 0.59 . . . . 0.0 111.334 175.51 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.534 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 12.2 tp10 -73.31 152.53 40.91 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.093 178.448 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.557 HG21 ' HA ' ' A' ' 26' ' ' GLU . 7.3 p -142.45 128.41 17.81 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 C-N-CA 123.296 0.638 . . . . 0.0 110.796 178.897 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.8 tptt -136.87 114.82 11.4 Favored 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 176.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.622 HG12 ' HB3' ' A' ' 7' ' ' ALA . 50.6 mt -119.17 116.39 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 122.746 0.418 . . . . 0.0 111.786 -173.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -87.08 119.81 27.69 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.894 0.877 . . . . 0.0 110.024 175.467 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.529 HG22 ' HB2' ' A' ' 9' ' ' CYS . 26.7 p -99.71 109.21 21.68 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.679 0.792 . . . . 0.0 111.144 178.606 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.447 ' O ' ' HA ' ' A' ' 10' ' ' ALA . 46.4 mt-30 -96.93 139.4 33.02 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.425 0.69 . . . . 0.0 110.095 173.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -164.89 175.73 40.78 Favored Glycine 0 C--N 1.341 0.806 0 N-CA-C 111.882 -0.487 . . . . 0.0 111.882 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.85 -12.33 60.35 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 122.625 0.37 . . . . 0.0 111.504 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -77.71 -28.22 50.85 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.27 0.628 . . . . 0.0 110.147 171.11 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 143.26 -169.79 25.68 Favored Glycine 0 C--N 1.346 1.137 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.391 -177.62 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 64.5 mt -113.29 145.5 19.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 123.123 0.569 . . . . 0.0 109.465 176.34 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -142.86 151.31 40.94 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.349 0.659 . . . . 0.0 110.197 -176.305 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.432 ' HB3' ' O ' ' A' ' 38' ' ' ILE . 10.4 t30 58.74 45.88 15.05 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 125.017 1.327 . . . . 0.0 110.075 178.173 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.6 tpp180 -52.21 120.77 5.83 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.111 1.364 . . . . 0.0 112.16 -175.002 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 37.5 mt -64.11 146.12 54.75 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.276 1.03 . . . . 0.0 110.979 172.619 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 67.2 p -104.29 167.3 9.84 Favored 'General case' 0 C--O 1.244 0.77 0 C-N-CA 123.304 0.642 . . . . 0.0 110.145 175.631 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.99 -35.27 74.66 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.049 0.54 . . . . 0.0 110.321 174.67 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 -60.98 -51.84 67.54 Favored 'General case' 0 CA--C 1.546 0.81 0 CA-C-N 114.393 -1.276 . . . . 0.0 110.53 174.792 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 31.3 m-20 -53.67 -46.28 70.59 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 123.633 0.773 . . . . 0.0 112.261 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.556 HG22 ' HG3' ' A' ' 78' ' ' ARG . 23.0 mt -73.2 -31.01 32.81 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.078 0 O-C-N 123.834 0.708 . . . . 0.0 110.974 -175.708 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.64 -37.57 70.84 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.229 0.612 . . . . 0.0 111.103 177.247 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -77.33 -26.42 52.12 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.032 0.933 . . . . 0.0 111.118 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -56.93 99.65 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.063 0.945 . . . . 0.0 112.431 -175.002 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 27.4 m -63.56 -37.9 89.09 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 115.156 -0.929 . . . . 0.0 108.901 168.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.533 HG23 HG21 ' A' ' 99' ' ' ILE . 80.5 mt -128.45 140.71 48.48 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.767 179.369 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.447 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 33.2 mt -131.3 137.23 56.02 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 173.006 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.2 mp -123.29 112.84 35.2 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 173.048 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 9.9 m170 -89.91 84.03 6.19 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-O 121.815 0.817 . . . . 0.0 108.972 171.646 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.454 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 23.4 p -83.27 84.58 7.44 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 114.302 -1.317 . . . . 0.0 108.926 177.907 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.418 HG12 ' HB3' ' A' ' 10' ' ' ALA . 34.6 m -127.88 163.61 31.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 121.535 0.684 . . . . 0.0 111.988 -170.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -113.67 -28.78 7.34 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.761 1.224 . . . . 0.0 108.98 174.455 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 12.9 m -124.18 162.67 25.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 125.18 1.392 . . . . 0.0 108.591 176.73 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 55.4 m -68.67 116.52 41.56 Favored Pre-proline 0 CA--C 1.549 0.912 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 174.329 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.536 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 31.1 Cg_endo -64.35 150.43 88.29 Favored 'Trans proline' 0 C--N 1.375 1.97 0 C-N-CA 122.466 2.111 . . . . 0.0 112.081 178.346 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -67.45 -30.95 70.81 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.589 0.756 . . . . 0.0 110.261 178.691 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.508 ' HB3' ' HD3' ' A' ' 74' ' ' ARG . 3.8 m-20 -94.13 12.73 25.51 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 114.42 -1.264 . . . . 0.0 112.162 -174.907 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.536 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 59.5 t30 -60.22 -35.29 75.1 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.097 0.959 . . . . 0.0 112.471 -174.695 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.96 -17.86 62.04 Favored 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -175.651 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.508 ' HD3' ' HB3' ' A' ' 71' ' ' ASP . 58.3 mtp180 -64.41 -25.96 68.25 Favored 'General case' 0 N--CA 1.485 1.304 0 CA-C-O 121.427 0.632 . . . . 0.0 111.631 174.525 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -100.69 17.85 20.84 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.652 1.181 . . . . 0.0 110.556 -175.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -50.18 -52.09 38.39 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 125.356 1.462 . . . . 0.0 113.105 -174.223 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 21.6 t -99.41 5.62 46.27 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.409 0.683 . . . . 0.0 112.082 -171.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.556 ' HG3' HG22 ' A' ' 55' ' ' ILE . 34.7 mmt180 -106.18 145.78 31.09 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.473 0.709 . . . . 0.0 111.063 -173.34 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -68.65 99.58 1.02 Allowed 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.718 0.807 . . . . 0.0 110.923 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.447 ' HA ' ' HB ' ' A' ' 61' ' ' ILE . 57.5 t -109.69 128.25 65.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 123.515 0.726 . . . . 0.0 110.322 -178.75 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 73.3 m-85 -98.25 92.51 5.75 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 124.423 1.089 . . . . 0.0 108.16 174.363 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -85.76 129.86 34.71 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.473 -175.687 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.436 HG13 ' HA ' ' A' ' 64' ' ' SER . 41.7 pt -137.45 -172.78 0.78 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.844 0 C-N-CA 124.926 1.29 . . . . 0.0 108.86 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 26.2 p -84.98 149.98 25.23 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.061 0.458 . . . . 0.0 109.969 167.531 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.74 HD13 ' SG ' ' A' ' 11' ' ' CYS . 8.2 tt -65.42 -29.04 69.68 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.578 177.639 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.488 ' HG2' ' HE3' ' A' ' 90' ' ' LYS . 35.7 tt0 -59.99 -46.06 90.71 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.638 173.703 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -62.41 -32.67 73.54 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.327 0.651 . . . . 0.0 110.633 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.37 -32.64 74.12 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.584 0.754 . . . . 0.0 112.365 176.679 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 94.3 mt -78.21 -50.72 18.93 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 123.491 0.716 . . . . 0.0 110.713 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.488 ' HE3' ' HG2' ' A' ' 86' ' ' GLN . 18.6 ptpt -82.56 -33.36 28.14 Favored 'General case' 0 N--CA 1.484 1.26 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -172.126 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -120.5 22.99 11.06 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.896 0.879 . . . . 0.0 110.442 -168.317 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.584 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -42.33 -60.28 1.54 Allowed 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 124.353 1.061 . . . . 0.0 113.428 -174.575 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.42 -36.96 85.45 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.072 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -62.13 -47.55 89.06 Favored Glycine 0 C--N 1.355 1.618 0 O-C-N 124.479 1.112 . . . . 0.0 112.078 -177.41 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.402 ' O ' HG13 ' A' ' 99' ' ' ILE . 23.2 mt -55.79 -58.66 4.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 124.598 1.159 . . . . 0.0 110.333 177.809 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.8 mp -55.25 -51.3 57.14 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 O-C-N 124.246 0.966 . . . . 0.0 111.043 -177.227 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.74 -29.53 68.78 Favored 'General case' 0 N--CA 1.486 1.357 0 O-C-N 123.417 0.448 . . . . 0.0 112.163 -175.357 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 59.7 mm-40 -71.25 -32.41 68.72 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.153 0.581 . . . . 0.0 110.381 177.785 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.533 HG21 HG23 ' A' ' 60' ' ' ILE . 48.0 mt -78.22 -36.23 20.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.33 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -57.86 -48.48 79.66 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 114.446 -1.252 . . . . 0.0 111.275 177.47 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -74.22 -34.93 63.83 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 123.92 0.762 . . . . 0.0 111.44 -178.173 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 64.5 mtm -64.58 -50.82 65.74 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 122.679 0.392 . . . . 0.0 110.615 178.276 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 39.2 mt -66.41 -42.45 90.47 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.383 178.157 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.24 -28.23 69.21 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 117.683 0.22 . . . . 0.0 111.049 178.648 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 36.8 t -75.03 -41.52 59.1 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 122.044 -0.41 . . . . 0.0 110.364 -178.136 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -78.56 -34.77 46.77 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 122.84 0.456 . . . . 0.0 111.469 -177.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 14.3 mm-40 -82.67 -43.37 16.99 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.072 0.549 . . . . 0.0 111.81 -174.539 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 . . . . . 0 CA--C 1.554 1.112 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 177.546 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.2 mtt . . . . . 0 N--CA 1.484 1.245 0 N-CA-C 109.919 -0.401 . . . . 0.0 109.919 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 55.8 p -78.92 82.55 5.1 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-O 121.616 0.722 . . . . 0.0 110.543 -179.196 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.524 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 4.7 pttt -66.18 -174.42 0.26 Allowed 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.915 0.886 . . . . 0.0 110.669 172.86 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.529 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 5.0 tmtp? -143.71 144.2 31.75 Favored 'General case' 0 N--CA 1.481 1.091 0 CA-C-O 121.454 0.645 . . . . 0.0 110.66 -175.099 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.499 ' N ' ' HD3' ' A' ' 4' ' ' LYS . 8.8 tt -130.8 135.67 47.97 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 125.246 1.418 . . . . 0.0 107.902 175.04 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.439 HG13 HG23 ' A' ' 61' ' ' ILE . 20.3 pt -126.1 161.94 30.7 Favored 'Isoleucine or valine' 0 C--O 1.242 0.693 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 171.656 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.631 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -148.94 166.61 28.09 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 122.96 0.504 . . . . 0.0 110.015 175.674 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.467 HD21 ' HG3' ' A' ' 41' ' ' GLN . 4.1 tt -136.58 123.38 21.24 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 178.268 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.56 ' HA ' ' O ' ' A' ' 64' ' ' SER . 78.0 m -112.51 112.63 24.31 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 123.61 0.764 . . . . 0.0 109.244 177.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.428 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -126.27 120.74 30.74 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 122.855 0.462 . . . . 0.0 111.547 -176.51 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.801 ' SG ' HD13 ' A' ' 85' ' ' LEU . 1.4 m -127.31 144.64 51.45 Favored Pre-proline 0 N--CA 1.485 1.323 0 C-N-CA 123.957 0.903 . . . . 0.0 111.45 -178.924 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -74.53 -23.61 14.7 Favored 'Trans proline' 0 C--N 1.379 2.176 0 C-N-CA 122.869 2.379 . . . . 0.0 113.161 177.773 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 76.9 mtm -76.11 -41.28 50.72 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 173.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 138.08 -156.03 23.65 Favored Glycine 0 C--N 1.347 1.173 0 N-CA-C 114.675 0.63 . . . . 0.0 114.675 172.304 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.3 mt -75.18 -18.48 60.16 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 114.783 1.401 . . . . 0.0 114.783 -164.603 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.98 -48.65 80.82 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-O 121.466 0.65 . . . . 0.0 110.761 178.594 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -66.18 -39.25 89.57 Favored 'General case' 0 C--O 1.246 0.868 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.264 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.407 HG21 ' O ' ' A' ' 41' ' ' GLN . 40.8 p -67.89 -36.34 80.07 Favored 'General case' 0 C--N 1.349 0.581 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.444 -175.944 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -72.49 -25.24 61.34 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 123.389 0.43 . . . . 0.0 111.616 178.329 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 56.3 mtm -63.08 -45.44 92.11 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-O 120.87 0.367 . . . . 0.0 110.055 170.646 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -69.72 -38.07 76.78 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.423 177.536 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.94 -43.09 84.11 Favored 'General case' 0 C--O 1.216 -0.682 0 C-N-CA 123.599 0.76 . . . . 0.0 110.735 -177.205 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.411 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 8.4 tp-100 -66.06 -42.2 89.79 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.064 0.546 . . . . 0.0 110.23 -179.558 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.03 -49.61 67.11 Favored 'General case' 0 CA--C 1.556 1.179 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.988 -178.543 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.431 HD11 ' OG ' ' A' ' 64' ' ' SER . 86.6 mt -66.52 -32.6 74.05 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.184 0.594 . . . . 0.0 111.789 178.595 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.519 ' HA ' HG21 ' A' ' 36' ' ' VAL . 46.0 tt0 -59.89 -53.54 56.72 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 123.907 0.754 . . . . 0.0 109.686 179.069 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 23' ' ' GLN . 30.4 mm-40 -54.07 -52.4 61.06 Favored 'General case' 0 N--CA 1.477 0.888 0 O-C-N 124.719 1.262 . . . . 0.0 110.834 178.707 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.15 -45.84 79.5 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.515 1.126 . . . . 0.0 112.109 -177.247 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.21 -29.71 67.73 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 115.364 -0.834 . . . . 0.0 113.063 177.459 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.48 HG23 ' O ' ' A' ' 26' ' ' GLU . 52.2 t -72.63 -38.55 59.16 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.785 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -71.79 -23.35 61.56 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 114.548 -1.205 . . . . 0.0 111.061 178.281 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.49 -22.31 59.14 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.411 0.684 . . . . 0.0 111.657 176.058 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 105.06 0.34 41.49 Favored Glycine 0 C--N 1.352 1.423 0 CA-C-O 119.555 -0.581 . . . . 0.0 114.512 171.08 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.524 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.1 OUTLIER -113.38 -179.87 3.76 Favored 'General case' 0 N--CA 1.485 1.319 0 CA-C-N 117.642 0.721 . . . . 0.0 111.901 177.427 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.529 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 38.2 tt0 -79.06 152.76 30.68 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.053 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.519 HG21 ' HA ' ' A' ' 26' ' ' GLU . 11.0 p -132.18 141.68 44.74 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 123.647 0.779 . . . . 0.0 110.548 177.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 49.1 tptt -147.22 119.52 8.37 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 172.012 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.631 HG12 ' HB3' ' A' ' 7' ' ' ALA . 47.9 mt -120.74 112.45 36.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 C-N-CA 122.938 0.495 . . . . 0.0 111.954 -175.43 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 46.5 tt0 -80.98 117.13 21.33 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.467 0.707 . . . . 0.0 109.423 174.52 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.409 HG22 ' HB2' ' A' ' 9' ' ' CYS . 21.7 p -98.87 115.74 29.53 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.814 0.845 . . . . 0.0 110.177 178.794 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.467 ' HG3' HD21 ' A' ' 8' ' ' LEU . 11.0 mt-30 -108.64 151.43 26.15 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.414 0.686 . . . . 0.0 109.917 175.767 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -172.81 -177.14 41.93 Favored Glycine 0 C--N 1.337 0.596 0 CA-C-N 116.73 -0.214 . . . . 0.0 112.872 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.69 -19.23 65.14 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.637 0.775 . . . . 0.0 112.527 -179.337 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -79.61 -31.74 41.71 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.623 0.769 . . . . 0.0 110.775 174.533 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 143.18 -158.71 27.31 Favored Glycine 0 C--N 1.339 0.738 0 N-CA-C 111.184 -0.766 . . . . 0.0 111.184 -176.652 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.43 HG23 ' HG2' ' A' ' 41' ' ' GLN . 30.0 mt -117.62 154.99 19.47 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 123.031 0.532 . . . . 0.0 109.963 179.541 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -149.8 152.62 35.49 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.198 0.999 . . . . 0.0 109.937 -179.186 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 18.8 t30 60.99 42.02 13.26 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 124.72 1.208 . . . . 0.0 109.89 176.359 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 10.1 tpt180 -54.68 121.59 8.83 Favored 'General case' 0 C--N 1.356 0.853 0 C-N-CA 125.098 1.359 . . . . 0.0 112.157 -169.291 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 44.4 mt -67.31 144.27 55.96 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.805 0.842 . . . . 0.0 110.118 172.195 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.431 ' O ' HG13 ' A' ' 55' ' ' ILE . 31.6 p -111.53 172.46 6.88 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.822 0.849 . . . . 0.0 109.392 177.053 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.44 -30.07 68.23 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 122.862 0.465 . . . . 0.0 111.381 176.181 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -64.33 -47.54 79.01 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.827 0.851 . . . . 0.0 110.814 176.334 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -59.74 -45.04 93.44 Favored 'General case' 0 N--CA 1.48 1.041 0 O-C-N 123.858 0.724 . . . . 0.0 111.028 179.011 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.561 HG22 ' HG3' ' A' ' 78' ' ' ARG . 26.7 mt -73.23 -28.87 26.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 C-N-CA 123.671 0.788 . . . . 0.0 111.017 -176.125 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -74.74 -49.04 22.47 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.249 0.62 . . . . 0.0 111.13 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -81.16 -9.34 59.82 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.407 0.683 . . . . 0.0 111.753 -176.655 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.59 101.15 0.17 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.521 0.729 . . . . 0.0 111.299 179.17 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 24.0 m -61.53 -38.03 85.93 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 115.021 -0.99 . . . . 0.0 109.102 168.589 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.516 HG23 HG21 ' A' ' 99' ' ' ILE . 73.1 mt -130.32 140.4 48.95 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.767 0 CA-C-N 114.819 -1.082 . . . . 0.0 110.174 -179.316 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.439 HG23 HG13 ' A' ' 6' ' ' ILE . 20.5 mt -133.01 131.56 58.88 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 C-N-CA 123.685 0.794 . . . . 0.0 109.098 172.735 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.0 mp -119.84 134.77 62.3 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 173.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 7.5 m170 -109.35 85.43 2.1 Favored 'General case' 0 N--CA 1.487 1.419 0 CA-C-N 118.931 0.787 . . . . 0.0 109.339 168.45 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.56 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 19.4 m -77.78 82.11 4.18 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 114.288 -1.324 . . . . 0.0 109.595 175.011 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.404 ' O ' ' HA ' ' A' ' 84' ' ' THR . 21.6 m -127.26 152.67 35.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 121.47 0.652 . . . . 0.0 111.313 -172.426 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -103.13 -29.02 11.59 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.315 1.046 . . . . 0.0 108.936 174.77 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 16.4 m -133.9 163.35 37.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 125.479 1.512 . . . . 0.0 108.447 177.713 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 26.3 m -64.72 117.59 39.78 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 122.942 0.497 . . . . 0.0 110.618 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.437 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 37.9 Cg_endo -67.6 148.81 78.94 Favored 'Trans proline' 0 C--N 1.374 1.874 0 C-N-CA 122.149 1.9 . . . . 0.0 111.079 175.037 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -63.51 -33.12 74.88 Favored 'General case' 0 N--CA 1.483 1.223 0 CA-C-O 121.242 0.544 . . . . 0.0 110.572 -179.235 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.504 ' HB3' ' HD3' ' A' ' 74' ' ' ARG . 1.3 m-20 -94.9 16.23 16.58 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.322 1.049 . . . . 0.0 112.357 -174.921 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.437 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 5.1 p30 -60.37 -36.08 77.2 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.256 0.622 . . . . 0.0 112.403 -174.822 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.64 -21.15 63.57 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.761 0.824 . . . . 0.0 112.945 -174.12 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.504 ' HD3' ' HB3' ' A' ' 71' ' ' ASP . 77.1 mtp180 -62.66 -42.89 99.86 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-O 122.215 1.007 . . . . 0.0 110.286 174.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -89.91 -17.97 27.01 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 113.72 -1.582 . . . . 0.0 111.04 -172.164 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -63.5 -27.38 69.23 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.311 0.645 . . . . 0.0 110.488 178.538 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 45.1 t -62.89 -34.73 78.04 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 124.071 0.948 . . . . 0.0 111.554 172.736 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.561 ' HG3' HG22 ' A' ' 55' ' ' ILE . 20.7 mmt180 -95.39 -175.98 3.64 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.329 1.052 . . . . 0.0 111.62 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -94.44 120.29 34.45 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.576 0.751 . . . . 0.0 109.826 173.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 62.1 t -130.42 148.49 33.13 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.163 0 C-N-CA 124.213 1.005 . . . . 0.0 110.296 -174.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -107.68 90.89 3.44 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.02 0.928 . . . . 0.0 109.342 173.263 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -75.68 111.52 11.1 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.42 0.688 . . . . 0.0 110.362 178.28 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.462 HG13 ' HA ' ' A' ' 64' ' ' SER . 44.2 pt -119.36 -175.53 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 124.489 1.116 . . . . 0.0 109.16 175.15 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.404 ' HA ' ' O ' ' A' ' 65' ' ' VAL . 22.0 p -83.2 148.14 27.62 Favored 'General case' 0 C--O 1.238 0.455 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 168.86 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.801 HD13 ' SG ' ' A' ' 11' ' ' CYS . 5.8 tt -62.41 -26.9 68.73 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.665 0.786 . . . . 0.0 111.482 178.82 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.522 ' HG2' ' HE3' ' A' ' 90' ' ' LYS . 33.7 tt0 -67.04 -40.62 87.2 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 123.795 0.838 . . . . 0.0 111.171 175.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.432 ' HB3' HD12 ' A' ' 83' ' ' ILE . 22.8 t70 -61.52 -29.84 70.25 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.456 0.702 . . . . 0.0 111.067 178.495 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -70.31 -18.52 63.1 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.715 0.806 . . . . 0.0 112.998 178.752 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 66.2 mt -95.91 -40.58 10.94 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.826 0 C-N-CA 123.518 0.727 . . . . 0.0 110.392 -179.258 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.522 ' HE3' ' HG2' ' A' ' 86' ' ' GLN . 18.1 ptpt -88.67 -31.05 18.7 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.196 0.598 . . . . 0.0 112.361 -175.044 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -126.58 26.78 6.23 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.374 0.669 . . . . 0.0 110.185 -170.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -49.15 -61.12 2.25 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.817 0.847 . . . . 0.0 113.026 -174.238 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.24 -39.74 83.73 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.872 177.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -55.97 -47.38 80.29 Favored Glycine 0 C--N 1.353 1.517 0 O-C-N 124.886 1.366 . . . . 0.0 112.991 179.296 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 26.0 mt -58.32 -56.9 13.31 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 124.052 0.941 . . . . 0.0 110.053 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.8 mp -57.25 -50.62 76.12 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.185 0 O-C-N 124.034 0.834 . . . . 0.0 111.42 -176.095 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.65 -29.73 70.34 Favored 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -176.751 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -66.71 -38.44 86.74 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.487 0.715 . . . . 0.0 110.236 177.634 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.516 HG21 HG23 ' A' ' 60' ' ' ILE . 22.2 mt -77.92 -34.31 19.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 -177.669 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -61.14 -46.17 91.66 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.553 1.141 . . . . 0.0 111.821 177.158 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -74.53 -32.84 62.61 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 123.158 0.286 . . . . 0.0 111.465 -178.042 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 65.1 mtm -65.74 -45.57 82.11 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 122.638 0.375 . . . . 0.0 110.62 175.695 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 48.0 mt -65.93 -38.83 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 O-C-N 123.46 0.475 . . . . 0.0 109.938 176.424 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.36 -21.78 66.24 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.147 0.579 . . . . 0.0 111.371 177.416 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 44.6 t -88.58 -38.15 15.11 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 122.944 0.497 . . . . 0.0 111.199 -178.24 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -77.24 -25.48 51.61 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 122.396 0.278 . . . . 0.0 110.885 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 17.0 mm-40 -85.04 -50.24 7.62 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.02 0.528 . . . . 0.0 110.054 174.444 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 24.4 mm-40 . . . . . 0 CA--C 1.55 0.945 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 177.664 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 81.6 mtp . . . . . 0 N--CA 1.486 1.362 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.3 t -81.39 78.68 8.14 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 121.314 0.578 . . . . 0.0 110.216 -178.789 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 47.9 pttt -80.88 162.46 23.95 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 115.413 -0.812 . . . . 0.0 108.986 166.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.6 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.3 tmtp? -141.8 140.84 33.12 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 -172.873 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.467 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 10.1 tt -129.36 134.9 48.11 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 177.528 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.431 HD12 HD13 ' A' ' 50' ' ' LEU . 17.7 pt -128.01 165.17 27.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 173.744 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.618 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -152.48 169.08 23.48 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 122.775 0.43 . . . . 0.0 110.078 178.18 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.5 tt -139.73 114.28 9.25 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 -179.574 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.494 ' HA ' ' O ' ' A' ' 64' ' ' SER . 85.6 m -106.39 111.09 23.52 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 177.954 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.513 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -127.38 122.48 33.76 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 122.785 0.434 . . . . 0.0 111.235 -176.756 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.712 ' SG ' HD13 ' A' ' 85' ' ' LEU . 1.2 m -136.55 139.65 30.01 Favored Pre-proline 0 N--CA 1.474 0.74 0 C-N-CA 123.728 0.811 . . . . 0.0 109.878 176.398 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -75.91 -10.01 19.66 Favored 'Trans proline' 0 C--N 1.373 1.867 0 C-N-CA 122.856 2.371 . . . . 0.0 111.504 178.552 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 44.6 mtt -69.3 -56.97 5.98 Favored 'General case' 0 C--N 1.35 0.624 0 C-N-CA 124.93 1.292 . . . . 0.0 109.718 177.55 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 163.0 175.1 33.68 Favored Glycine 0 C--N 1.349 1.266 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.89 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 28.9 mt -69.89 -22.52 63.22 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.388 0.675 . . . . 0.0 112.759 -179.394 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -55.66 -44.65 77.45 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-O 120.956 0.408 . . . . 0.0 111.025 175.633 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -71.33 -36.5 71.57 Favored 'General case' 0 C--O 1.247 0.934 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.81 -178.537 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.414 ' HA ' HD11 ' A' ' 85' ' ' LEU . 44.8 p -70.97 -31.22 67.72 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.822 -178.396 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 -74.4 -28.13 60.95 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.298 0.639 . . . . 0.0 111.013 178.241 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 71.0 mtp -58.92 -51.26 70.81 Favored 'General case' 0 N--CA 1.483 1.189 0 CA-C-O 121.214 0.53 . . . . 0.0 109.838 169.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.01 -40.08 94.37 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.771 177.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.93 -37.11 78.7 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.876 0.87 . . . . 0.0 111.461 -176.413 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.424 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 8.4 tp-100 -64.5 -48.13 76.34 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.264 0.626 . . . . 0.0 109.715 178.273 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.465 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -63.11 -51.36 66.84 Favored 'General case' 0 CA--C 1.554 1.101 0 CA-C-N 115.221 -0.9 . . . . 0.0 111.934 -176.585 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 85.4 mt -63.91 -34.57 78.27 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.415 0.686 . . . . 0.0 112.048 -179.309 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.461 ' O ' HG23 ' A' ' 30' ' ' VAL . 39.0 tt0 -60.66 -56.72 17.9 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 123.979 0.799 . . . . 0.0 110.324 -179.022 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.482 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 21.3 mm-40 -56.96 -44.58 82.76 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 124.673 1.233 . . . . 0.0 111.196 -178.534 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.59 -49.45 77.42 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.839 0.855 . . . . 0.0 111.688 -179.57 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.15 -21.99 63.97 Favored 'General case' 0 CA--C 1.552 1.04 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 177.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.461 HG23 ' O ' ' A' ' 26' ' ' GLU . 42.3 t -73.61 -42.79 55.35 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.261 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 179.272 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 9.0 mm-40 -76.08 -20.3 57.82 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 114.559 -1.201 . . . . 0.0 110.814 -178.807 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -84.09 -14.6 50.0 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.719 0.808 . . . . 0.0 111.586 173.212 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 86.25 33.4 14.47 Favored Glycine 0 C--N 1.344 0.986 0 N-CA-C 114.792 0.677 . . . . 0.0 114.792 166.294 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -101.95 -179.19 3.93 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 117.781 0.791 . . . . 0.0 109.371 165.478 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.6 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 11.4 tp10 -87.71 132.31 34.17 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 156.618 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.467 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 8.7 p -117.47 135.74 56.88 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.27 0 CA-C-N 119.057 0.844 . . . . 0.0 110.667 -176.269 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.4 tptt -144.44 119.0 9.71 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.333 0.653 . . . . 0.0 109.278 177.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.618 HG12 ' HB3' ' A' ' 7' ' ' ALA . 46.6 mt -121.21 112.22 34.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 C-N-CA 123.082 0.553 . . . . 0.0 111.725 -173.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 49.0 tt0 -80.86 116.41 20.83 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.409 0.684 . . . . 0.0 110.115 175.737 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.404 HG22 ' HB2' ' A' ' 9' ' ' CYS . 22.6 p -97.26 114.31 26.04 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.841 0.856 . . . . 0.0 110.749 178.197 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.513 ' O ' ' HA ' ' A' ' 10' ' ' ALA . 45.7 mt-30 -105.09 137.27 43.11 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.918 0.887 . . . . 0.0 109.08 174.886 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -170.35 -165.84 28.33 Favored Glycine 0 C--N 1.345 1.041 0 C-N-CA 121.423 -0.417 . . . . 0.0 113.597 -177.561 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.99 -29.22 68.18 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.908 0.883 . . . . 0.0 112.601 -176.38 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -80.08 -11.25 59.78 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.283 0.633 . . . . 0.0 110.955 176.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 119.75 -157.35 15.57 Favored Glycine 0 C--N 1.345 1.075 0 N-CA-C 111.642 -0.583 . . . . 0.0 111.642 -179.537 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.405 HD12 HH22 ' A' ' 49' ' ' ARG . 55.4 mt -107.31 144.74 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 179.292 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -145.7 150.42 36.24 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.944 0.898 . . . . 0.0 109.514 -174.439 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.6 t30 60.64 43.87 12.08 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.554 1.142 . . . . 0.0 110.058 177.119 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.405 HH22 HD12 ' A' ' 46' ' ' ILE . 19.9 tpp180 -53.37 124.2 14.08 Favored 'General case' 0 C--N 1.357 0.921 0 C-N-CA 124.863 1.265 . . . . 0.0 112.796 -173.152 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.468 ' HB2' HH22 ' A' ' 74' ' ' ARG . 51.4 mt -69.9 140.45 53.12 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 114.49 -1.232 . . . . 0.0 110.96 170.859 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 70.1 p -101.86 164.74 11.57 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.627 0.771 . . . . 0.0 109.76 178.772 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.59 -32.13 64.94 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 122.913 0.485 . . . . 0.0 110.744 173.481 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 44.8 tt0 -61.9 -53.65 52.84 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.96 0.904 . . . . 0.0 110.962 173.304 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -57.68 -41.06 80.8 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 123.257 0.623 . . . . 0.0 111.886 -177.648 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.561 HG22 ' HG3' ' A' ' 78' ' ' ARG . 55.0 mt -72.08 -31.32 39.52 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.125 0 C-N-CA 123.77 0.828 . . . . 0.0 110.962 -177.654 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.72 -45.19 53.72 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.362 0.665 . . . . 0.0 111.337 176.539 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -65.7 -32.92 74.74 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.159 0.984 . . . . 0.0 111.121 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -51.92 102.6 0.05 OUTLIER 'General case' 0 CA--C 1.543 0.693 0 O-C-N 124.857 1.348 . . . . 0.0 112.322 -174.16 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 29.0 m -61.25 -37.96 84.99 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.089 165.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 91.7 mt -137.05 139.52 44.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 124.255 1.022 . . . . 0.0 110.371 -176.644 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.442 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 23.5 mt -126.05 141.21 46.36 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 172.6 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.0 mp -129.52 111.92 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 CA-C-N 118.248 0.476 . . . . 0.0 109.827 174.816 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' HIS . . . . . 0.411 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 12.7 m170 -87.74 85.67 7.08 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-O 121.618 0.723 . . . . 0.0 110.021 174.204 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.494 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 19.6 m -82.87 83.22 7.84 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 114.605 -1.179 . . . . 0.0 109.7 176.906 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.409 ' O ' ' HA ' ' A' ' 84' ' ' THR . 31.3 m -129.17 158.76 41.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 CA-C-O 121.668 0.747 . . . . 0.0 112.487 -170.482 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -113.97 -14.66 12.42 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.116 1.366 . . . . 0.0 109.445 175.116 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.3 m -134.1 150.24 31.03 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 125.786 1.635 . . . . 0.0 107.94 174.447 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 50.0 m -64.12 111.39 5.34 Favored Pre-proline 0 CA--C 1.548 0.903 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 174.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.531 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 33.4 Cg_endo -62.79 148.43 93.42 Favored 'Trans proline' 0 C--N 1.38 2.187 0 C-N-CA 122.467 2.111 . . . . 0.0 112.223 -173.721 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -65.13 -32.46 74.16 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.645 -179.214 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -96.55 15.66 20.96 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 115.084 -0.962 . . . . 0.0 112.424 -175.12 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.531 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 51.6 t30 -58.16 -33.51 69.3 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 124.033 0.933 . . . . 0.0 112.137 -179.189 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.42 -23.54 65.55 Favored 'General case' 0 N--CA 1.485 1.283 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -175.836 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.468 HH22 ' HB2' ' A' ' 50' ' ' LEU . 40.7 mtp180 -64.51 -38.12 89.92 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.385 0.674 . . . . 0.0 112.021 174.44 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -91.13 -3.04 57.43 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-N 114.615 -1.175 . . . . 0.0 111.357 -174.676 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -60.46 -30.65 69.81 Favored 'General case' 0 CA--C 1.554 1.099 0 C-N-CA 124.471 1.108 . . . . 0.0 112.021 -176.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 52.7 p -74.95 -18.68 60.35 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 124.048 0.939 . . . . 0.0 112.802 179.641 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.561 ' HG3' HG22 ' A' ' 55' ' ' ILE . 19.9 mmt180 -116.7 168.62 10.04 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.594 0.757 . . . . 0.0 111.881 -166.173 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -76.95 102.65 6.5 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.719 0.808 . . . . 0.0 110.349 -178.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.442 ' HA ' ' HB ' ' A' ' 61' ' ' ILE . 58.1 t -112.75 129.28 68.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 123.427 0.691 . . . . 0.0 110.807 -177.47 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 -99.87 90.08 4.31 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.387 1.075 . . . . 0.0 108.41 176.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.411 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 47.3 mt-10 -79.29 126.87 31.35 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.953 -176.514 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.55 HD12 ' HB3' ' A' ' 87' ' ' ASP . 38.2 pt -140.91 -172.9 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 C-N-CA 125.278 1.431 . . . . 0.0 109.137 178.729 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.409 ' HA ' ' O ' ' A' ' 65' ' ' VAL . 34.4 p -85.21 153.89 22.33 Favored 'General case' 0 C--N 1.346 0.45 0 CA-C-O 121.071 0.463 . . . . 0.0 110.324 168.476 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.712 HD13 ' SG ' ' A' ' 11' ' ' CYS . 7.6 tt -63.99 -27.54 69.19 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.039 176.179 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.471 ' HG2' ' HE2' ' A' ' 90' ' ' LYS . 35.7 tt0 -64.34 -42.96 96.0 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.864 0.866 . . . . 0.0 111.48 176.226 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.55 ' HB3' HD12 ' A' ' 83' ' ' ILE . 30.1 t70 -62.12 -30.86 71.32 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.462 0.705 . . . . 0.0 111.131 -179.843 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.46 -27.44 67.03 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.852 0.861 . . . . 0.0 112.885 178.762 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 37.6 mt -88.11 -45.96 15.83 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 C-N-CA 123.01 0.524 . . . . 0.0 109.996 -178.357 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.471 ' HE2' ' HG2' ' A' ' 86' ' ' GLN . 0.2 OUTLIER -78.82 -38.06 39.08 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 122.942 0.497 . . . . 0.0 112.089 -175.423 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -122.25 25.34 9.01 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.377 0.671 . . . . 0.0 110.56 -167.325 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.465 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -47.07 -59.37 3.18 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.401 0.68 . . . . 0.0 112.499 -176.186 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.06 -37.4 76.96 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 114.781 -1.1 . . . . 0.0 111.109 178.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.55 -50.7 60.03 Favored Glycine 0 C--N 1.354 1.548 0 O-C-N 124.578 1.174 . . . . 0.0 112.62 -178.151 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.407 ' O ' HG13 ' A' ' 99' ' ' ILE . 33.4 mt -54.38 -57.38 6.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 124.463 1.105 . . . . 0.0 110.126 -179.082 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.0 mp -56.8 -51.36 68.33 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.986 0 O-C-N 124.192 0.932 . . . . 0.0 111.021 -176.534 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.48 -28.12 68.32 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -176.838 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 35.7 mm-40 -70.91 -33.2 70.3 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.554 0.742 . . . . 0.0 110.652 178.413 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 95' ' ' ILE . 19.4 mt -82.14 -33.19 11.38 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 178.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -57.0 -49.76 74.8 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.479 1.112 . . . . 0.0 111.091 174.31 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -74.12 -33.93 63.75 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 123.576 0.548 . . . . 0.0 111.7 -177.046 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 66.8 mtm -63.13 -53.55 51.76 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 122.173 0.189 . . . . 0.0 110.6 175.342 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 21.7 mt -64.57 -39.32 85.2 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 O-C-N 123.821 0.701 . . . . 0.0 110.674 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.82 -42.08 99.57 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 122.263 0.225 . . . . 0.0 110.833 178.456 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 14.8 t -69.78 -35.4 74.85 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 122.703 0.401 . . . . 0.0 111.166 -172.397 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -81.18 -28.69 34.86 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 122.811 0.444 . . . . 0.0 111.618 179.169 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -87.26 -21.78 25.59 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.078 0.551 . . . . 0.0 112.033 -178.538 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 . . . . . 0 N--CA 1.481 1.089 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 175.032 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.0 ttp . . . . . 0 N--CA 1.485 1.305 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.8 p -81.48 90.7 6.24 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-O 121.315 0.578 . . . . 0.0 109.545 177.134 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 37.8 pttt -95.91 170.46 9.28 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.516 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.575 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.2 tmtp? -142.42 134.49 27.36 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 -175.859 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.441 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.9 tt -127.08 136.82 52.69 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 179.091 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 19.6 pt -128.22 164.23 30.42 Favored 'Isoleucine or valine' 0 C--O 1.243 0.724 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 173.515 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.607 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -152.28 165.74 33.98 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.877 177.504 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.515 HD21 ' HG3' ' A' ' 41' ' ' GLN . 3.2 tt -137.34 109.95 7.51 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 -179.413 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.509 ' HA ' ' O ' ' A' ' 64' ' ' SER . 64.1 m -102.25 113.25 26.37 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 123.725 0.81 . . . . 0.0 108.966 177.472 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.415 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -129.01 124.08 34.01 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 122.703 0.401 . . . . 0.0 111.032 -176.887 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.738 ' SG ' HD13 ' A' ' 85' ' ' LEU . 1.3 m -144.17 148.88 43.13 Favored Pre-proline 0 N--CA 1.477 0.891 0 C-N-CA 123.753 0.821 . . . . 0.0 110.552 178.814 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -81.61 -7.16 12.62 Favored 'Trans proline' 0 C--N 1.373 1.863 0 C-N-CA 122.725 2.283 . . . . 0.0 111.411 176.612 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 55.0 mtt -70.52 -20.83 62.8 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.68 1.192 . . . . 0.0 110.991 177.393 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.17 -178.59 17.89 Favored Glycine 0 C--N 1.344 1.007 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.943 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 39.2 mt -72.33 -22.55 61.16 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 112.832 0.679 . . . . 0.0 112.832 -175.326 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.66 -43.53 93.91 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-N 118.484 0.584 . . . . 0.0 111.479 178.074 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.4 t-160 -70.07 -39.63 75.52 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.391 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.444 ' HA ' HD11 ' A' ' 85' ' ' LEU . 48.7 p -68.45 -28.08 66.73 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.419 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.1 m-30 -75.7 -28.23 58.55 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.599 0.76 . . . . 0.0 111.185 177.272 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 78.7 mtp -61.26 -46.14 91.59 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-O 121.303 0.573 . . . . 0.0 109.654 171.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.93 -38.05 69.93 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 114.888 -1.051 . . . . 0.0 111.507 178.373 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.23 -42.32 93.5 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.65 0.78 . . . . 0.0 110.837 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.407 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 24.2 tp60 -66.22 -43.49 86.52 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 122.812 0.445 . . . . 0.0 109.991 178.265 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.546 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -60.27 -56.53 20.42 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.912 -177.102 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.414 HD11 ' OG ' ' A' ' 64' ' ' SER . 96.6 mt -65.59 -30.49 71.23 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.789 0.835 . . . . 0.0 111.894 -179.275 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.515 ' HA ' HG21 ' A' ' 36' ' ' VAL . 35.5 tt0 -60.03 -55.37 34.77 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 123.733 0.646 . . . . 0.0 110.054 176.504 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.552 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 55.4 mm-40 -53.03 -51.12 62.72 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 124.513 1.133 . . . . 0.0 110.518 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.74 -49.8 72.1 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.454 1.102 . . . . 0.0 112.032 -177.609 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.94 -23.57 64.17 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 113.508 0.929 . . . . 0.0 113.508 177.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' ' 26' ' ' GLU . 49.0 t -75.87 -43.23 39.75 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 -179.707 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.552 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 24.6 mm-40 -69.81 -33.36 72.24 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 114.486 -1.234 . . . . 0.0 110.134 179.32 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -77.35 -19.21 56.63 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.558 0.743 . . . . 0.0 111.707 176.28 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 89.67 39.16 6.32 Favored Glycine 0 C--N 1.342 0.861 0 N-CA-C 114.722 0.649 . . . . 0.0 114.722 166.445 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -104.53 170.27 7.99 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 165.197 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.575 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 45.4 tt0 -78.99 129.45 34.46 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 156.048 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.515 HG21 ' HA ' ' A' ' 26' ' ' GLU . 12.2 p -113.97 137.5 46.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 CA-C-N 118.336 0.516 . . . . 0.0 110.01 -175.626 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 47.8 tptt -144.38 113.33 6.8 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 177.53 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.607 HG12 ' HB3' ' A' ' 7' ' ' ALA . 61.3 mt -118.3 110.96 32.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 122.55 0.34 . . . . 0.0 111.418 -175.321 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -74.29 142.1 45.26 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 123.805 0.691 . . . . 0.0 109.136 171.396 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 14.0 p -128.0 117.55 21.9 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.745 0.818 . . . . 0.0 109.219 -176.817 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.515 ' HG3' HD21 ' A' ' 8' ' ' LEU . 42.3 mt-30 -110.17 128.85 55.7 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 178.428 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -152.79 -176.37 25.28 Favored Glycine 0 C--N 1.336 0.564 0 N-CA-C 112.113 -0.395 . . . . 0.0 112.113 -177.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.51 -27.67 69.43 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.711 0.805 . . . . 0.0 111.695 -179.531 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -72.57 -36.32 68.16 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.972 0.909 . . . . 0.0 110.751 177.205 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 146.64 -159.42 27.99 Favored Glycine 0 C--N 1.347 1.155 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.054 -177.052 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 76.1 mt -111.57 131.96 61.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 123.397 0.679 . . . . 0.0 109.58 178.07 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -128.29 150.47 50.04 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.458 1.103 . . . . 0.0 109.691 -177.569 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 17.0 t30 60.63 41.42 15.32 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 124.61 1.164 . . . . 0.0 110.259 176.482 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 18.7 tpp180 -47.35 125.39 8.01 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 125.496 1.519 . . . . 0.0 113.142 -174.492 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 42.2 mt -75.09 127.93 34.35 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.778 173.526 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 50.1 p -87.34 161.2 18.06 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.423 176.534 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -57.48 -29.63 64.41 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 122.971 0.509 . . . . 0.0 111.47 175.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -73.06 -37.1 66.95 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.648 0.779 . . . . 0.0 111.378 178.449 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -62.02 -40.83 97.04 Favored 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 110.332 -0.247 . . . . 0.0 110.332 174.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.567 HG22 ' HG3' ' A' ' 78' ' ' ARG . 31.9 mt -73.6 -30.04 28.43 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.991 0 O-C-N 124.206 0.941 . . . . 0.0 110.888 -178.891 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.97 -48.99 31.75 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.598 0.759 . . . . 0.0 111.173 179.303 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -84.23 -4.38 58.79 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.593 0.757 . . . . 0.0 112.025 -177.533 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.91 104.19 0.82 Allowed 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.912 0.387 . . . . 0.0 110.58 177.362 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 26.1 m -60.64 -37.66 82.23 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.226 167.353 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 73.0 mt -135.65 142.45 39.32 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 C-N-CA 123.527 0.731 . . . . 0.0 110.646 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.406 HD13 ' HD2' ' A' ' 75' ' ' PHE . 23.4 mt -129.17 135.79 61.09 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 C-N-CA 124.105 0.962 . . . . 0.0 108.446 171.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -125.82 112.69 31.44 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 C-N-CA 123.106 0.562 . . . . 0.0 109.586 174.659 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' HIS . . . . . 0.459 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 16.4 m170 -88.25 86.22 7.04 Favored 'General case' 0 N--CA 1.485 1.319 0 CA-C-N 118.833 0.742 . . . . 0.0 109.45 172.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.509 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 23.1 m -82.92 81.62 8.54 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-N 114.808 -1.087 . . . . 0.0 109.466 176.774 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 28.0 m -126.88 159.05 37.25 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-O 121.677 0.751 . . . . 0.0 112.252 -170.548 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -117.54 -21.57 8.52 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.106 1.362 . . . . 0.0 108.822 173.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 12.3 m -126.04 156.83 36.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 125.106 1.362 . . . . 0.0 108.197 175.203 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 38.7 m -65.79 118.29 50.23 Favored Pre-proline 0 CA--C 1.546 0.812 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 177.2 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.545 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 56.2 Cg_endo -69.49 146.38 61.67 Favored 'Trans proline' 0 C--N 1.373 1.839 0 C-N-CA 121.683 1.589 . . . . 0.0 110.705 175.385 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -62.69 -48.28 79.99 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-O 121.538 0.685 . . . . 0.0 111.196 -175.358 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -94.76 26.58 3.47 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 114.76 -1.109 . . . . 0.0 111.789 -170.364 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.545 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 6.5 p30 -60.19 -27.75 67.41 Favored 'General case' 0 CA--C 1.557 1.237 0 C-N-CA 124.616 1.166 . . . . 0.0 112.043 -178.557 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.98 -13.1 60.01 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.06 0.944 . . . . 0.0 112.809 -177.334 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -69.53 -23.28 63.57 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-O 121.34 0.591 . . . . 0.0 110.66 171.687 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.406 ' HD2' HD13 ' A' ' 61' ' ' ILE . 27.3 m-85 -104.21 7.72 36.08 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 124.932 1.293 . . . . 0.0 110.563 -177.042 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -56.6 -52.47 64.72 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 124.883 1.273 . . . . 0.0 112.584 -171.069 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 48.4 t -86.79 -2.6 58.69 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.193 0.997 . . . . 0.0 112.046 -175.032 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.567 ' HG3' HG22 ' A' ' 55' ' ' ILE . 25.2 mmt180 -103.41 159.72 15.33 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.925 0.89 . . . . 0.0 110.12 -173.706 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -77.1 99.2 5.28 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-O 121.222 0.534 . . . . 0.0 111.211 -176.291 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 41.6 t -112.44 142.02 26.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 123.982 0.913 . . . . 0.0 110.501 -177.697 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -116.94 93.29 4.13 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.487 1.115 . . . . 0.0 108.656 177.075 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.459 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 42.1 mt-10 -81.81 114.53 20.5 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.598 -176.589 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.529 HD12 ' HB3' ' A' ' 87' ' ' ASP . 45.2 pt -125.46 -173.78 0.95 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.882 0 C-N-CA 124.704 1.201 . . . . 0.0 109.008 177.244 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 40.4 p -80.88 152.52 28.09 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-O 120.935 0.397 . . . . 0.0 110.0 168.184 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.738 HD13 ' SG ' ' A' ' 11' ' ' CYS . 6.7 tt -62.59 -26.09 68.42 Favored 'General case' 0 CA--C 1.551 1.012 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.724 173.473 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.59 ' HG2' ' HE2' ' A' ' 90' ' ' LYS . 34.6 tt0 -64.98 -45.6 84.97 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.733 0.813 . . . . 0.0 111.292 176.387 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.529 ' HB3' HD12 ' A' ' 83' ' ' ILE . 20.3 t70 -61.57 -30.71 70.84 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.375 0.67 . . . . 0.0 111.102 -178.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.97 -43.42 95.83 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.514 0.726 . . . . 0.0 111.794 175.722 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 75.3 mt -68.45 -41.22 83.16 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.926 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.271 -177.164 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.59 ' HE2' ' HG2' ' A' ' 86' ' ' GLN . 0.2 OUTLIER -87.35 -53.22 4.95 Favored 'General case' 0 N--CA 1.485 1.299 0 CA-C-O 120.964 0.412 . . . . 0.0 111.938 -175.607 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -102.73 28.15 6.36 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.3 1.04 . . . . 0.0 110.667 -166.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.546 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -43.56 -62.5 1.06 Allowed 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.835 0.854 . . . . 0.0 112.922 -175.272 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.24 -39.17 85.79 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.177 -0.92 . . . . 0.0 110.958 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.412 ' O ' ' HG2' ' A' ' 98' ' ' GLU . . . -58.79 -53.91 42.35 Favored Glycine 0 C--N 1.353 1.508 0 O-C-N 124.72 1.262 . . . . 0.0 112.828 -178.162 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 25.8 mt -51.18 -55.74 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 124.481 1.113 . . . . 0.0 110.624 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.8 mp -57.96 -50.61 77.37 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.112 0 O-C-N 124.199 0.937 . . . . 0.0 111.298 -176.308 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.36 -27.42 66.23 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 122.91 0.484 . . . . 0.0 112.174 -176.359 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.412 ' HG2' ' O ' ' A' ' 94' ' ' GLY . 57.7 mm-40 -67.15 -38.75 86.03 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.232 0.613 . . . . 0.0 109.753 176.811 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.41 ' O ' HG13 ' A' ' 103' ' ' ILE . 21.1 mt -77.06 -37.17 25.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -52.13 -51.72 56.11 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 124.735 1.214 . . . . 0.0 111.981 174.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -71.46 -33.14 69.06 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 123.505 0.503 . . . . 0.0 111.218 -177.01 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 71.0 mtm -67.49 -39.24 85.21 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 122.617 0.367 . . . . 0.0 111.042 175.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.478 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 9.3 mt -70.08 -42.8 79.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 176.871 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.37 -21.2 66.23 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.242 0.617 . . . . 0.0 111.23 179.586 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 26.3 t -85.19 -42.18 14.95 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 122.931 0.492 . . . . 0.0 110.09 179.011 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.478 ' HG2' ' HA ' ' A' ' 103' ' ' ILE . 13.1 pt-20 -76.35 -23.3 54.19 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 122.897 0.479 . . . . 0.0 111.599 -178.05 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.9 mm-40 -90.02 -39.86 12.68 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.122 0.569 . . . . 0.0 110.535 177.821 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 80.3 mm-40 . . . . . 0 CA--C 1.554 1.104 0 CA-C-O 118.587 -0.72 . . . . 0.0 109.495 179.891 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.9 ptt? . . . . . 0 N--CA 1.483 1.188 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.8 m -73.73 91.44 1.91 Allowed 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.373 0.669 . . . . 0.0 110.394 -179.237 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.673 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 27.9 pttt -82.18 170.12 15.81 Favored 'General case' 0 C--O 1.245 0.838 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.04 176.056 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.592 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.9 tmtp? -143.75 143.68 31.49 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.477 -172.606 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.477 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.0 tt -128.01 131.13 49.22 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 174.687 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 18.7 pt -122.98 161.72 24.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 108.482 -0.932 . . . . 0.0 108.482 170.097 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.586 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -146.48 171.34 15.21 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.001 176.444 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.5 tt -146.48 117.31 7.66 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 -178.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.516 ' HA ' ' O ' ' A' ' 64' ' ' SER . 56.2 m -104.73 112.86 26.11 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.932 0.893 . . . . 0.0 109.239 176.883 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.531 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -128.36 117.24 21.08 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 122.496 0.318 . . . . 0.0 111.183 -178.206 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.767 ' SG ' HD13 ' A' ' 85' ' ' LEU . 1.3 m -138.78 141.78 31.77 Favored Pre-proline 0 N--CA 1.484 1.226 0 C-N-CA 123.89 0.876 . . . . 0.0 110.868 178.186 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -82.94 -7.66 11.21 Favored 'Trans proline' 0 C--N 1.375 1.928 0 C-N-CA 123.434 2.756 . . . . 0.0 111.533 176.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 47.9 ttm -65.12 -30.15 71.07 Favored 'General case' 0 C--N 1.354 0.764 0 C-N-CA 124.738 1.215 . . . . 0.0 110.318 170.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 125.79 -176.08 17.43 Favored Glycine 0 C--N 1.346 1.126 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.407 179.176 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 48.9 mt -78.17 -21.75 49.72 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 -173.038 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.82 -41.96 88.06 Favored 'General case' 0 N--CA 1.488 1.463 0 CA-C-N 118.922 0.783 . . . . 0.0 110.898 178.667 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.429 ' ND1' HD22 ' A' ' 85' ' ' LEU . 4.9 t-80 -67.55 -44.63 77.83 Favored 'General case' 0 C--O 1.247 0.94 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.165 -179.603 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 50.1 p -65.76 -36.43 83.53 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 114.816 -1.084 . . . . 0.0 110.916 -178.34 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -68.62 -30.82 69.64 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.34 0.656 . . . . 0.0 111.352 -179.182 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 64.7 mtm -68.28 -40.55 81.77 Favored 'General case' 0 N--CA 1.485 1.293 0 CA-C-O 120.473 0.178 . . . . 0.0 111.1 175.266 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.63 -38.48 83.94 Favored 'General case' 0 N--CA 1.485 1.29 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.133 175.232 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.8 -39.35 80.17 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.084 0.953 . . . . 0.0 110.975 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -62.71 -50.91 69.24 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.672 0.789 . . . . 0.0 109.513 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.15 -50.63 69.66 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 124.265 0.978 . . . . 0.0 111.956 -175.296 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 68.2 mt -63.93 -34.22 77.48 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 122.95 0.5 . . . . 0.0 111.743 179.048 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.44 ' O ' HG23 ' A' ' 30' ' ' VAL . 42.4 tt0 -63.39 -54.12 41.75 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 122.463 0.305 . . . . 0.0 110.313 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -51.28 -50.74 58.7 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 124.616 1.198 . . . . 0.0 111.445 179.357 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.421 ' HB3' HD12 ' A' ' 96' ' ' ILE . . . -67.48 -35.85 79.96 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 115.177 -0.92 . . . . 0.0 112.195 -176.756 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.04 -25.84 59.01 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.073 0.549 . . . . 0.0 111.716 178.208 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.44 HG23 ' O ' ' A' ' 26' ' ' GLU . 53.7 t -71.73 -39.37 68.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 175.205 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -65.87 -29.52 69.98 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 114.688 -1.142 . . . . 0.0 111.088 174.521 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -82.49 1.5 37.38 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 123.45 0.7 . . . . 0.0 112.41 177.623 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.96 -45.93 1.77 Allowed Glycine 0 C--N 1.353 1.503 0 N-CA-C 114.423 0.529 . . . . 0.0 114.423 165.489 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.673 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.1 OUTLIER -71.56 175.72 5.34 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -174.418 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.592 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 37.8 tt0 -77.07 144.03 38.83 Favored 'General case' 0 C--N 1.351 0.638 0 CA-C-N 114.446 -1.252 . . . . 0.0 109.111 178.515 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.477 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 9.3 p -128.66 135.92 61.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 122.66 0.384 . . . . 0.0 110.944 -178.612 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.9 tptt -142.46 113.35 7.5 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.248 0.619 . . . . 0.0 109.482 174.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.586 HG12 ' HB3' ' A' ' 7' ' ' ALA . 40.7 mt -117.54 112.78 40.24 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 122.854 0.462 . . . . 0.0 111.536 -176.376 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.532 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 32.0 tt0 -84.59 124.14 31.1 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.176 0.591 . . . . 0.0 110.288 177.262 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 24.9 p -100.95 105.27 16.49 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.871 0.868 . . . . 0.0 110.413 177.213 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.531 ' O ' ' HA ' ' A' ' 10' ' ' ALA . 40.0 mt-30 -95.35 141.83 28.45 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 172.219 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -162.19 -176.95 34.81 Favored Glycine 0 N--CA 1.464 0.564 0 CA-C-O 120.019 -0.323 . . . . 0.0 112.718 -177.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.6 -28.91 67.6 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.73 0.812 . . . . 0.0 111.807 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -72.69 -43.93 62.45 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.147 0.979 . . . . 0.0 110.363 175.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 148.69 -158.58 27.72 Favored Glycine 0 C--N 1.345 1.044 0 CA-C-N 115.257 -0.883 . . . . 0.0 112.007 -175.083 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 64.8 mt -106.82 138.6 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 123.699 0.8 . . . . 0.0 110.146 -175.665 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -140.02 151.23 45.29 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.903 0.881 . . . . 0.0 109.191 -177.384 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 21.7 t30 57.57 48.27 14.61 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 124.507 1.123 . . . . 0.0 109.702 -177.016 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 32.0 tpt180 -48.4 123.36 6.46 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 126.228 1.811 . . . . 0.0 113.704 -173.09 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.532 ' HG ' ' HB2' ' A' ' 39' ' ' GLU . 52.2 mt -75.17 135.54 41.08 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 124.086 0.954 . . . . 0.0 110.318 170.595 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 44.4 p -103.77 173.03 6.48 Favored 'General case' 0 C--O 1.244 0.808 0 C-N-CA 124.164 0.985 . . . . 0.0 109.38 177.536 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.09 -33.81 73.93 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 122.813 0.445 . . . . 0.0 110.759 175.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -63.96 -44.75 91.83 Favored 'General case' 0 C--N 1.359 0.982 0 O-C-N 124.066 0.854 . . . . 0.0 110.944 178.228 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -57.99 -47.84 81.81 Favored 'General case' 0 N--CA 1.48 1.045 0 O-C-N 123.8 0.688 . . . . 0.0 110.983 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.546 HG22 ' HG3' ' A' ' 78' ' ' ARG . 14.2 mt -74.94 -28.83 21.57 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 O-C-N 123.741 0.65 . . . . 0.0 111.256 -177.191 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.94 -44.17 70.11 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.561 0.744 . . . . 0.0 111.401 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -89.36 -9.02 51.97 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.322 0.649 . . . . 0.0 111.602 -176.762 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.35 96.74 0.11 Allowed 'General case' 0 C--N 1.351 0.67 0 C-N-CA 123.548 0.739 . . . . 0.0 111.647 -177.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 26.3 m -62.58 -35.99 81.25 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 114.836 -1.075 . . . . 0.0 109.745 172.508 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.456 HG23 HG21 ' A' ' 99' ' ' ILE . 79.8 mt -131.55 137.18 55.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 CA-C-N 114.883 -1.053 . . . . 0.0 109.209 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 30.1 mt -131.23 133.66 62.14 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 175.278 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -124.95 111.11 26.72 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 174.808 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 11.8 m170 -89.19 85.49 6.65 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-O 121.576 0.703 . . . . 0.0 109.626 173.198 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.516 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 18.5 p -79.29 81.27 5.58 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-N 114.531 -1.213 . . . . 0.0 108.973 175.138 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.406 ' O ' ' HA ' ' A' ' 84' ' ' THR . 35.9 m -126.51 159.72 35.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 121.631 0.729 . . . . 0.0 111.553 -171.027 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -128.89 -3.22 5.21 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.068 1.347 . . . . 0.0 109.275 176.722 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.8 m -138.71 158.25 30.31 Favored 'Isoleucine or valine' 0 C--N 1.349 0.564 0 C-N-CA 125.912 1.685 . . . . 0.0 107.356 168.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 39.2 m -63.41 118.43 43.78 Favored Pre-proline 0 CA--C 1.547 0.828 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 175.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.479 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 58.9 Cg_endo -67.37 146.44 75.05 Favored 'Trans proline' 0 C--N 1.377 2.054 0 C-N-CA 122.095 1.863 . . . . 0.0 110.686 179.596 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.458 ' HB2' HE22 ' A' ' 41' ' ' GLN . 9.1 mm-40 -61.82 -38.79 89.47 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-O 121.752 0.787 . . . . 0.0 110.752 -176.866 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -94.57 16.54 15.19 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 114.514 -1.221 . . . . 0.0 112.417 -172.041 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.479 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 4.1 p30 -54.11 -26.59 28.2 Favored 'General case' 0 CA--C 1.565 1.541 0 C-N-CA 123.965 0.906 . . . . 0.0 110.766 174.404 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -56.13 -45.52 79.52 Favored 'General case' 0 CA--C 1.565 1.52 0 C-N-CA 125.836 1.654 . . . . 0.0 112.702 171.765 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 58.7 mtt85 -71.02 -17.77 62.61 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 124.6 1.16 . . . . 0.0 112.656 -176.775 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.539 ' HB3' HG21 ' A' ' 80' ' ' VAL . 77.1 m-85 -103.23 19.12 20.22 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.048 0.939 . . . . 0.0 110.991 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 13.7 tp10 -57.33 -56.51 20.91 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.409 1.083 . . . . 0.0 112.305 -174.734 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 64.8 p -86.2 -9.78 55.93 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.674 0.789 . . . . 0.0 112.453 -174.325 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.546 ' HG3' HG22 ' A' ' 55' ' ' ILE . 38.5 mmt180 -91.37 157.11 17.28 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 123.357 0.663 . . . . 0.0 111.927 -170.827 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -82.14 97.96 8.46 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.668 0.787 . . . . 0.0 109.751 -178.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.539 HG21 ' HB3' ' A' ' 75' ' ' PHE . 41.6 t -110.73 118.43 57.22 Favored 'Isoleucine or valine' 0 C--O 1.24 0.602 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.96 -174.854 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -86.39 89.41 7.87 Favored 'General case' 0 C--O 1.24 0.574 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 172.516 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -84.52 125.37 32.34 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.157 -177.527 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.627 HD12 ' HB3' ' A' ' 87' ' ' ASP . 39.0 pt -135.2 -175.37 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 125.024 1.33 . . . . 0.0 109.224 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.406 ' HA ' ' O ' ' A' ' 65' ' ' VAL . 24.8 p -79.57 151.35 30.71 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.847 0.356 . . . . 0.0 110.475 168.241 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.767 HD13 ' SG ' ' A' ' 11' ' ' CYS . 6.5 tt -61.88 -32.15 72.49 Favored 'General case' 0 N--CA 1.48 1.059 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.492 176.066 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 31.2 tt0 -59.83 -43.55 94.51 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.794 0.838 . . . . 0.0 111.181 175.21 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.627 ' HB3' HD12 ' A' ' 83' ' ' ILE . 5.1 t70 -60.31 -31.67 70.5 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.95 0.9 . . . . 0.0 110.773 -176.621 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.93 -28.74 63.67 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.468 0.707 . . . . 0.0 112.831 178.686 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 86.0 mt -77.92 -48.14 24.01 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.874 0 C-N-CA 123.041 0.536 . . . . 0.0 110.32 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -80.31 -43.17 21.71 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.075 0.55 . . . . 0.0 112.323 -176.25 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -114.46 27.86 9.16 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.507 0.723 . . . . 0.0 110.557 -168.084 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -45.38 -60.08 2.34 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 124.063 0.945 . . . . 0.0 112.781 -177.449 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.66 -41.38 94.9 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 114.074 -1.421 . . . . 0.0 110.702 177.318 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -62.81 -42.1 99.74 Favored Glycine 0 C--N 1.354 1.566 0 O-C-N 124.391 1.057 . . . . 0.0 113.301 -173.34 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.403 ' O ' HG13 ' A' ' 99' ' ' ILE . 19.7 mt -63.25 -57.51 11.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 123.909 0.884 . . . . 0.0 108.682 179.45 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.421 HD12 ' HB3' ' A' ' 28' ' ' ALA . 82.6 mt -58.61 -45.77 90.44 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 CA-C-N 114.04 -1.437 . . . . 0.0 111.722 -174.726 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -33.07 73.5 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 122.755 0.422 . . . . 0.0 111.365 -177.531 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -67.5 -37.56 83.01 Favored 'General case' 0 C--N 1.355 0.809 0 O-C-N 123.614 0.571 . . . . 0.0 110.404 177.762 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.456 HG21 HG23 ' A' ' 60' ' ' ILE . 57.1 mt -75.14 -34.94 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 -177.128 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -63.37 -49.5 73.59 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 114.892 -1.049 . . . . 0.0 111.374 176.081 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -73.57 -30.7 63.19 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-O 119.613 -0.232 . . . . 0.0 111.307 -177.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.453 ' O ' ' HG2' ' A' ' 106' ' ' GLU . 68.3 mtm -65.47 -61.97 1.8 Allowed 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 175.165 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 41.3 mt -58.58 -48.49 85.44 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 O-C-N 123.932 0.77 . . . . 0.0 111.419 -176.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.83 -37.55 88.01 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -175.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 15.3 t -80.88 -23.47 39.0 Favored 'General case' 0 N--CA 1.484 1.275 0 CA-C-N 117.763 0.256 . . . . 0.0 111.643 -172.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' A' ' 102' ' ' MET . 11.6 pt-20 -86.79 -41.69 13.89 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 122.549 0.34 . . . . 0.0 111.058 176.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -73.26 -35.62 66.23 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.025 0.53 . . . . 0.0 110.905 -177.465 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 76.3 mm-40 . . . . . 0 CA--C 1.55 0.965 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 175.217 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.2 mtt . . . . . 0 N--CA 1.482 1.13 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 55.2 p -72.57 94.99 1.76 Allowed 'General case' 0 CA--C 1.546 0.8 0 CA-C-O 121.481 0.658 . . . . 0.0 109.701 177.203 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.639 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 18.1 pttt -73.57 -177.38 2.66 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-N 114.793 -1.094 . . . . 0.0 111.684 -178.892 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.462 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.4 tmtp? -142.2 141.0 32.52 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-O 121.029 0.442 . . . . 0.0 109.834 -173.555 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.474 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 8.9 tt -128.4 139.58 52.3 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 176.199 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.427 HD12 HD13 ' A' ' 50' ' ' LEU . 18.3 pt -131.08 169.48 21.58 Favored 'Isoleucine or valine' 0 C--O 1.244 0.77 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 172.187 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.619 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -155.22 167.74 29.35 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.22 176.47 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.402 ' HA ' ' O ' ' A' ' 39' ' ' GLU . 3.8 tt -138.53 115.23 10.65 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 178.127 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.53 ' HA ' ' O ' ' A' ' 64' ' ' SER . 65.1 m -105.33 112.53 25.67 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.567 0.747 . . . . 0.0 109.045 176.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.444 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -126.51 128.26 46.62 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 122.718 0.407 . . . . 0.0 111.641 -176.387 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.75 ' SG ' HD13 ' A' ' 85' ' ' LEU . 20.9 m -125.82 151.15 70.65 Favored Pre-proline 0 N--CA 1.476 0.83 0 C-N-CA 124.24 1.016 . . . . 0.0 109.989 175.516 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -82.15 -0.54 10.32 Favored 'Trans proline' 0 C--N 1.374 1.897 0 C-N-CA 122.757 2.304 . . . . 0.0 112.099 173.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 46.6 ttm -99.4 -62.36 1.25 Allowed 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.307 1.043 . . . . 0.0 110.458 -173.535 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 179.52 -178.22 48.57 Favored Glycine 0 C--N 1.347 1.168 0 CA-C-N 115.96 -0.564 . . . . 0.0 113.336 -176.7 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 74.6 mt -82.32 -17.13 46.84 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 -174.379 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.6 -45.99 91.92 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-N 118.69 0.677 . . . . 0.0 110.998 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 8.0 t-160 -68.88 -36.6 78.28 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.406 -179.277 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.459 ' HA ' HD11 ' A' ' 85' ' ' LEU . 36.2 p -68.81 -30.31 68.85 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.566 179.643 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.496 ' HA ' ' HB3' ' A' ' 22' ' ' ALA . 19.8 m-85 -77.48 -22.35 51.43 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.467 0.707 . . . . 0.0 111.681 177.048 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 77.6 mtp -66.49 -44.33 82.93 Favored 'General case' 0 N--CA 1.486 1.336 0 CA-C-O 121.322 0.582 . . . . 0.0 109.471 171.379 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.73 -37.49 70.58 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 114.687 -1.142 . . . . 0.0 111.101 176.068 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.496 ' HB3' ' HA ' ' A' ' 19' ' ' PHE . . . -70.32 -34.01 72.19 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.437 0.695 . . . . 0.0 110.85 -179.318 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.1 tt0 -61.85 -55.37 30.5 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.342 0.657 . . . . 0.0 109.328 173.323 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.68 -44.37 86.42 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 114.372 -1.286 . . . . 0.0 112.447 -170.232 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.437 HD11 ' OG ' ' A' ' 64' ' ' SER . 96.2 mt -70.04 -34.77 73.66 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 122.745 0.418 . . . . 0.0 111.323 178.299 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.482 ' O ' HG23 ' A' ' 30' ' ' VAL . 36.8 tt0 -60.49 -55.45 33.3 Favored 'General case' 0 C--N 1.354 0.796 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 178.61 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -54.14 -50.2 67.47 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 124.579 1.174 . . . . 0.0 110.886 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.4 -45.1 92.43 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.162 0.985 . . . . 0.0 112.201 -176.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.58 -24.81 61.15 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 178.423 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 26' ' ' GLU . 40.6 t -70.43 -43.04 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 175.582 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -62.63 -34.04 76.24 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 114.588 -1.187 . . . . 0.0 111.064 178.193 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.68 -42.28 95.47 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.478 0.711 . . . . 0.0 111.65 177.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 135.09 -43.96 1.21 Allowed Glycine 0 C--N 1.348 1.207 0 CA-C-N 116.861 -0.154 . . . . 0.0 113.206 174.307 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.639 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -71.6 177.88 3.85 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 -177.266 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.462 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 30.2 tt0 -78.66 154.66 30.0 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 115.083 -0.962 . . . . 0.0 109.505 178.881 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.474 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 7.1 p -134.94 136.61 51.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 123.226 0.61 . . . . 0.0 110.138 176.733 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 45.9 tptt -143.69 113.83 7.32 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 175.427 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.619 HG12 ' HB3' ' A' ' 7' ' ' ALA . 41.5 mt -116.01 109.85 29.6 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 C-N-CA 122.654 0.382 . . . . 0.0 111.844 -174.232 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.402 ' O ' ' HA ' ' A' ' 8' ' ' LEU . 32.7 tt0 -76.08 135.63 39.88 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 172.067 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.401 HG22 ' HB2' ' A' ' 9' ' ' CYS . 12.2 p -118.93 119.04 33.16 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 123.657 0.783 . . . . 0.0 109.65 -177.24 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.471 HE22 ' HB2' ' A' ' 70' ' ' GLU . 40.4 mt-30 -109.65 137.68 47.11 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 123.796 0.838 . . . . 0.0 109.969 179.153 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -164.45 176.31 40.36 Favored Glycine 0 C--O 1.243 0.664 0 N-CA-C 112.136 -0.386 . . . . 0.0 112.136 179.025 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.72 -19.79 66.03 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.292 0.637 . . . . 0.0 112.034 -179.205 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -74.56 -40.32 61.73 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.159 0.584 . . . . 0.0 110.876 173.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 156.06 -158.02 28.28 Favored Glycine 0 C--N 1.343 0.97 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.004 -176.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.42 HD12 HH22 ' A' ' 49' ' ' ARG . 74.6 mt -124.12 137.98 55.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 C-N-CA 123.316 0.647 . . . . 0.0 109.769 177.364 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -132.98 152.42 51.95 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.178 0.991 . . . . 0.0 109.636 -178.666 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.1 t30 63.58 36.82 10.74 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 124.24 1.016 . . . . 0.0 110.238 175.057 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.42 HH22 HD12 ' A' ' 46' ' ' ILE . 20.2 tpp180 -45.26 122.51 3.47 Favored 'General case' 0 C--N 1.362 1.117 0 C-N-CA 126.088 1.755 . . . . 0.0 112.762 -175.675 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.427 HD13 HD12 ' A' ' 6' ' ' ILE . 41.1 mt -76.2 147.17 38.59 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.264 172.851 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 17.1 p -104.86 171.88 7.08 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 175.204 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.7 -29.33 70.58 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 122.664 0.386 . . . . 0.0 111.231 175.065 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -64.94 -46.93 79.55 Favored 'General case' 0 C--N 1.354 0.781 0 O-C-N 123.759 0.662 . . . . 0.0 110.243 176.101 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -56.25 -46.09 79.78 Favored 'General case' 0 N--CA 1.484 1.267 0 O-C-N 123.928 0.768 . . . . 0.0 111.403 179.02 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.607 HG22 ' HG3' ' A' ' 78' ' ' ARG . 28.6 mt -74.19 -31.49 29.46 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 O-C-N 123.925 0.765 . . . . 0.0 111.121 -174.708 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.25 -50.02 30.5 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.164 0.585 . . . . 0.0 111.093 178.668 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -79.95 -9.56 59.69 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.4 0.68 . . . . 0.0 111.652 -176.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.82 103.25 0.42 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.297 0.639 . . . . 0.0 110.538 176.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 30.2 m -61.85 -36.08 80.16 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.656 170.516 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.497 HG23 HG21 ' A' ' 99' ' ' ILE . 79.8 mt -132.36 141.44 45.26 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.292 179.308 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.422 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 21.9 mt -132.12 140.78 47.07 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 123.856 0.862 . . . . 0.0 108.887 171.634 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.2 mp -126.03 116.65 46.51 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.329 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 173.514 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' HIS . . . . . 0.426 ' HE1' ' HA ' ' A' ' 72' ' ' ASN . 5.2 m170 -92.32 86.21 5.64 Favored 'General case' 0 N--CA 1.486 1.334 0 CA-C-O 121.739 0.78 . . . . 0.0 109.834 173.339 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.53 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 22.7 m -82.43 78.91 9.01 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 114.381 -1.282 . . . . 0.0 109.956 178.679 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.447 HG11 ' HG3' ' A' ' 69' ' ' PRO . 34.2 m -125.35 157.14 34.61 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 CA-C-O 121.858 0.837 . . . . 0.0 111.721 -170.074 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -107.77 -23.3 12.14 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 114.17 -1.377 . . . . 0.0 109.483 178.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 15.8 m -136.86 179.64 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 125.051 1.341 . . . . 0.0 108.757 178.008 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 86.8 m -69.98 116.02 39.82 Favored Pre-proline 0 CA--C 1.549 0.938 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 172.467 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.592 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 58.1 Cg_endo -73.31 146.8 40.82 Favored 'Trans proline' 0 C--N 1.373 1.857 0 C-N-CA 122.406 2.07 . . . . 0.0 110.859 175.833 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.471 ' HB2' HE22 ' A' ' 41' ' ' GLN . 14.2 mm-40 -67.36 -23.76 65.63 Favored 'General case' 0 N--CA 1.482 1.175 0 CA-C-O 121.219 0.533 . . . . 0.0 111.338 -175.478 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -101.6 10.06 40.57 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.152 -176.36 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.592 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 8.4 t30 -56.45 -34.83 67.23 Favored 'General case' 0 N--CA 1.495 1.814 0 C-N-CA 123.499 0.72 . . . . 0.0 112.021 179.592 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -57.96 -22.24 48.18 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 125.264 1.425 . . . . 0.0 113.314 179.157 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 43.1 mtp180 -86.03 -28.51 24.09 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.409 1.083 . . . . 0.0 112.537 -176.807 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.411 ' HE2' HD13 ' A' ' 50' ' ' LEU . 58.0 m-85 -99.98 -17.77 17.37 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.702 0.801 . . . . 0.0 111.969 -173.249 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -59.08 -29.49 67.38 Favored 'General case' 0 CA--C 1.559 1.292 0 C-N-CA 124.098 0.959 . . . . 0.0 113.282 -168.017 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 14.2 t -85.16 0.41 51.81 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.522 0.729 . . . . 0.0 112.142 -178.786 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.607 ' HG3' HG22 ' A' ' 55' ' ' ILE . 36.8 mmt180 -114.67 168.53 9.8 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.0 0.92 . . . . 0.0 110.081 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -75.65 86.45 2.7 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-O 121.785 0.802 . . . . 0.0 110.28 -178.352 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.422 ' HA ' ' HB ' ' A' ' 61' ' ' ILE . 60.2 t -101.56 125.94 55.53 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 CA-C-N 114.619 -1.173 . . . . 0.0 110.109 179.415 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -98.74 89.53 4.38 Favored 'General case' 0 C--O 1.24 0.592 0 N-CA-C 107.4 -1.333 . . . . 0.0 107.4 174.19 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -78.86 125.33 29.23 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.051 -177.206 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.454 HD12 ' HB3' ' A' ' 87' ' ' ASP . 46.4 pt -128.62 -174.06 1.1 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.856 0 C-N-CA 124.491 1.116 . . . . 0.0 109.379 177.388 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 23.3 p -84.36 149.3 26.13 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 109.908 -0.405 . . . . 0.0 109.908 166.82 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.75 HD13 ' SG ' ' A' ' 11' ' ' CYS . 7.6 tt -61.65 -31.03 71.12 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.865 179.209 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -61.51 -42.98 99.61 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 123.403 0.681 . . . . 0.0 110.938 176.459 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.454 ' HB3' HD12 ' A' ' 83' ' ' ILE . 9.2 t70 -62.8 -31.88 72.96 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.569 0.748 . . . . 0.0 110.913 -179.157 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.54 -14.5 63.05 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.836 0.854 . . . . 0.0 112.906 179.566 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 47.5 mt -96.76 -56.6 5.07 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 123.662 0.785 . . . . 0.0 109.536 178.101 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -77.82 -30.37 51.08 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 -173.301 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -118.35 15.25 13.9 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.443 0.697 . . . . 0.0 110.55 -175.051 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.489 ' HA ' HD12 ' A' ' 95' ' ' ILE . . . -41.97 -57.91 2.26 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 124.49 1.116 . . . . 0.0 113.467 -173.871 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.82 -41.19 97.48 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.944 179.11 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -58.93 -44.08 96.34 Favored Glycine 0 C--N 1.35 1.345 0 O-C-N 124.343 1.027 . . . . 0.0 112.339 -179.439 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.489 HD12 ' HA ' ' A' ' 92' ' ' ALA . 22.3 mt -59.42 -58.53 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 124.144 0.978 . . . . 0.0 110.272 -179.517 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.7 mp -54.37 -51.14 51.72 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 O-C-N 124.175 0.922 . . . . 0.0 110.832 -176.677 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.48 -29.82 69.36 Favored 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -175.431 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -68.34 -36.55 79.42 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 177.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.497 HG21 HG23 ' A' ' 60' ' ' ILE . 38.3 mt -76.91 -36.45 25.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 -177.89 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -57.38 -52.58 64.8 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 114.502 -1.226 . . . . 0.0 111.063 177.291 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -71.05 -32.15 68.78 Favored 'General case' 0 CA--C 1.546 0.805 0 O-C-N 123.671 0.607 . . . . 0.0 111.838 -176.514 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 70.7 mtm -66.06 -53.83 33.46 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 122.837 0.455 . . . . 0.0 110.954 177.425 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 40.7 mt -67.7 -33.38 61.5 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.837 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.714 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -72.21 -25.36 61.63 Favored 'General case' 0 C--O 1.212 -0.917 0 CA-C-O 119.666 -0.207 . . . . 0.0 111.066 177.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 21.0 t -78.04 -38.76 43.85 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 118.01 0.368 . . . . 0.0 110.88 -178.304 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -72.32 -37.56 68.89 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 122.354 0.262 . . . . 0.0 111.159 178.763 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -84.08 -31.15 25.48 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 122.932 0.493 . . . . 0.0 111.355 -177.501 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 65.9 mm-40 . . . . . 0 C--O 1.25 1.111 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.124 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.6 ttt . . . . . 0 N--CA 1.483 1.215 0 N-CA-C 110.431 -0.211 . . . . 0.0 110.431 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.8 p -65.75 98.67 0.41 Allowed 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 123.233 0.613 . . . . 0.0 111.509 -176.752 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.561 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 14.6 pttt -91.67 178.49 5.91 Favored 'General case' 0 C--O 1.256 1.395 0 C-N-CA 123.828 0.851 . . . . 0.0 111.192 178.186 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.567 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 3.7 tmtp? -149.64 141.49 23.73 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.126 -172.428 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.476 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.6 tt -128.48 139.05 52.53 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 176.154 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.417 HD12 HD13 ' A' ' 50' ' ' LEU . 16.0 pt -130.14 165.46 30.24 Favored 'Isoleucine or valine' 0 C--O 1.241 0.625 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 168.941 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.571 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -152.16 169.11 23.24 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 176.304 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.1 tt -140.97 109.69 6.02 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -178.413 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.565 ' HA ' ' O ' ' A' ' 64' ' ' SER . 66.8 m -101.05 107.61 19.1 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.938 0.895 . . . . 0.0 109.463 176.848 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -125.9 115.31 19.74 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 122.852 0.461 . . . . 0.0 110.096 -177.672 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.573 ' SG ' ' HB3' ' A' ' 13' ' ' MET . 25.7 t -123.04 139.06 30.77 Favored Pre-proline 0 N--CA 1.476 0.846 0 C-N-CA 123.034 0.533 . . . . 0.0 110.664 -175.567 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -74.39 -15.9 22.12 Favored 'Trans proline' 0 C--N 1.374 1.911 0 C-N-CA 123.151 2.568 . . . . 0.0 112.848 170.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.573 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 44.2 ttm -69.05 -57.13 5.85 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.557 0.743 . . . . 0.0 110.282 177.779 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 164.85 171.47 31.13 Favored Glycine 0 C--O 1.245 0.812 0 CA-C-N 114.886 -1.052 . . . . 0.0 111.813 -177.675 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 81.0 mt -67.5 -20.01 65.4 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.246 0.619 . . . . 0.0 111.941 178.547 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -57.06 -45.35 83.32 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-O 121.047 0.451 . . . . 0.0 110.996 175.361 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 7.7 t-160 -73.01 -36.06 66.93 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.432 -178.928 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.433 ' HA ' HD11 ' A' ' 85' ' ' LEU . 37.4 p -64.41 -37.79 88.77 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.563 179.505 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.404 ' HA ' ' HB3' ' A' ' 22' ' ' ALA . 21.4 m-85 -75.18 -23.42 57.72 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.416 0.687 . . . . 0.0 111.926 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 83.8 mtp -61.32 -48.45 81.3 Favored 'General case' 0 N--CA 1.484 1.262 0 CA-C-O 121.173 0.511 . . . . 0.0 110.064 169.088 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.89 -38.91 73.05 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.951 178.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.404 ' HB3' ' HA ' ' A' ' 19' ' ' PHE . . . -68.48 -39.83 81.18 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.934 0.893 . . . . 0.0 111.225 -176.606 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.452 ' O ' ' HG3' ' A' ' 27' ' ' GLU . 16.2 tt0 -65.37 -50.35 65.89 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 123.482 0.489 . . . . 0.0 110.241 176.77 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.87 -48.98 79.35 Favored 'General case' 0 CA--C 1.551 1.013 0 O-C-N 123.829 0.705 . . . . 0.0 112.213 -174.918 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 73.4 mt -64.84 -37.07 86.4 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 122.97 0.508 . . . . 0.0 111.587 177.221 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.482 ' O ' HG23 ' A' ' 30' ' ' VAL . 41.3 tt0 -59.88 -55.23 36.79 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 123.35 0.406 . . . . 0.0 110.25 -179.039 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.534 ' O ' ' HG3' ' A' ' 31' ' ' GLU . 44.6 mt-10 -52.84 -53.11 53.49 Favored 'General case' 0 N--CA 1.475 0.825 0 O-C-N 124.616 1.198 . . . . 0.0 111.159 -179.584 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -62.01 -37.48 85.02 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.721 -176.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.56 -24.11 49.91 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.164 0.585 . . . . 0.0 112.503 179.822 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 26' ' ' GLU . 40.6 t -64.14 -43.87 97.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 172.748 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.534 ' HG3' ' O ' ' A' ' 27' ' ' GLU . 25.9 mt-10 -80.13 -20.78 44.16 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 113.506 -1.679 . . . . 0.0 111.643 -176.086 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.65 -16.54 62.27 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.373 0.669 . . . . 0.0 111.221 174.488 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 116.11 -19.01 13.79 Favored Glycine 0 C--N 1.354 1.579 0 N-CA-C 114.53 0.572 . . . . 0.0 114.53 167.64 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.561 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -106.02 -179.58 3.98 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 113.323 0.861 . . . . 0.0 113.323 -173.481 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.567 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 10.8 tp10 -75.77 150.27 37.81 Favored 'General case' 0 C--N 1.355 0.812 0 CA-C-N 114.479 -1.237 . . . . 0.0 109.021 175.419 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.476 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 7.1 p -137.4 132.94 46.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 122.921 0.489 . . . . 0.0 110.238 177.917 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 48.2 tptt -142.11 112.82 7.3 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 179.132 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.571 HG12 ' HB3' ' A' ' 7' ' ' ALA . 45.5 mt -118.6 111.08 32.3 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 -173.785 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -75.55 139.68 42.27 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.829 0.851 . . . . 0.0 109.74 174.007 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.408 HG22 ' HB2' ' A' ' 9' ' ' CYS . 17.0 p -123.1 111.68 16.83 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.881 0.872 . . . . 0.0 109.463 -178.293 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.471 HE22 ' HB2' ' A' ' 70' ' ' GLU . 41.9 mt-30 -105.74 146.38 29.87 Favored 'General case' 0 C--O 1.243 0.744 0 CA-C-O 121.174 0.511 . . . . 0.0 111.376 -177.428 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -169.78 169.24 41.97 Favored Glycine 0 C--N 1.342 0.866 0 CA-C-N 114.917 -1.038 . . . . 0.0 111.752 175.721 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.94 -24.76 67.85 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.556 0.743 . . . . 0.0 111.741 -179.573 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -72.42 -39.93 67.5 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.201 0.6 . . . . 0.0 110.603 174.659 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 163.93 -173.73 40.0 Favored Glycine 0 C--N 1.344 1.027 0 CA-C-N 116.214 -0.448 . . . . 0.0 113.333 -179.516 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 78.2 mt -122.63 134.82 64.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.215 1.006 . . . . 0.0 108.836 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -128.89 152.76 48.18 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.931 0.892 . . . . 0.0 109.628 -179.144 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 10.3 t30 60.21 40.45 18.03 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 124.364 1.066 . . . . 0.0 109.977 176.667 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 17.4 tpp180 -47.58 124.54 7.18 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 125.854 1.662 . . . . 0.0 113.118 -175.724 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.417 HD13 HD12 ' A' ' 6' ' ' ILE . 55.0 mt -77.81 132.91 38.26 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.318 1.047 . . . . 0.0 110.6 173.3 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 43.0 p -96.68 169.77 9.65 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.721 177.171 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.09 -34.89 70.66 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 122.904 0.482 . . . . 0.0 111.204 175.486 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 19.9 tt0 -65.23 -46.74 79.38 Favored 'General case' 0 C--N 1.352 0.716 0 O-C-N 123.717 0.636 . . . . 0.0 110.463 178.117 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -53.66 -44.79 69.94 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 123.362 0.665 . . . . 0.0 111.71 179.267 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 45.8 mt -71.74 -32.73 46.11 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.94 0 O-C-N 124.302 1.002 . . . . 0.0 110.935 -177.47 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.35 -41.55 69.62 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.467 0.707 . . . . 0.0 111.42 178.02 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -72.3 -32.38 66.52 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.99 0.916 . . . . 0.0 111.003 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.73 102.56 0.07 Allowed 'General case' 0 N--CA 1.471 0.622 0 O-C-N 124.568 1.168 . . . . 0.0 112.587 -173.056 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 26.9 m -61.88 -38.59 88.87 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 124.049 0.94 . . . . 0.0 109.429 168.043 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.452 HG23 HG21 ' A' ' 99' ' ' ILE . 70.6 mt -128.44 139.78 50.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.092 -178.44 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.407 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 25.9 mt -131.21 133.49 62.38 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.286 0 C-N-CA 123.821 0.848 . . . . 0.0 108.919 171.401 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.1 mp -121.9 112.5 35.18 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.339 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 174.786 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' HIS . . . . . 0.511 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 9.4 m170 -86.48 86.04 7.33 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-O 121.678 0.751 . . . . 0.0 109.15 173.42 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.565 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 15.0 m -81.25 78.98 7.99 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 114.074 -1.421 . . . . 0.0 109.222 177.452 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 35.3 m -127.5 157.98 39.04 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-O 121.688 0.756 . . . . 0.0 111.537 -169.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -117.11 -10.38 10.87 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.524 1.13 . . . . 0.0 109.418 175.164 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 4.0 m -141.84 162.3 20.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 125.699 1.6 . . . . 0.0 108.498 173.825 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 47.0 m -61.83 114.93 12.76 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 123.286 0.634 . . . . 0.0 110.162 175.62 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.547 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 69.1 Cg_endo -70.53 151.54 64.75 Favored 'Trans proline' 0 C--N 1.377 2.055 0 C-N-CA 122.241 1.961 . . . . 0.0 110.87 178.083 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.471 ' HB2' HE22 ' A' ' 41' ' ' GLN . 11.6 mm-40 -67.57 -45.49 75.45 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-O 121.216 0.531 . . . . 0.0 111.107 -172.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -89.64 14.4 11.74 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.746 0.818 . . . . 0.0 112.305 -169.869 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.547 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 5.2 p30 -55.47 -27.35 47.77 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 124.83 1.252 . . . . 0.0 112.817 -176.313 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -56.89 -33.6 67.06 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.958 1.303 . . . . 0.0 113.03 -177.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -72.58 -38.15 67.97 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.929 0.892 . . . . 0.0 110.812 -175.515 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -77.09 -12.78 59.99 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 114.447 -1.251 . . . . 0.0 111.456 -174.721 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -54.48 -33.28 59.44 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 124.663 1.185 . . . . 0.0 112.352 178.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 73.5 p -73.83 -19.42 60.74 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 -177.686 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 40.6 mmt180 -115.46 170.25 8.55 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.756 0.822 . . . . 0.0 111.803 -170.845 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -76.9 93.94 3.84 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.412 0.685 . . . . 0.0 110.177 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.407 ' HA ' ' HB ' ' A' ' 61' ' ' ILE . 48.3 t -99.0 139.76 20.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.25 177.818 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -116.5 91.14 3.5 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 179.382 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.511 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 49.1 mt-10 -81.14 123.93 28.82 Favored 'General case' 0 C--N 1.35 0.623 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.756 -175.569 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.633 HD12 ' HB3' ' A' ' 87' ' ' ASP . 45.5 pt -131.33 179.57 4.22 Favored 'Isoleucine or valine' 0 C--O 1.248 1.02 0 C-N-CA 125.112 1.365 . . . . 0.0 108.764 178.227 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 3.2 m -80.34 151.59 29.4 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 109.138 -0.689 . . . . 0.0 109.138 167.06 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.545 HD13 ' HB2' ' A' ' 11' ' ' CYS . 7.8 tt -62.86 -29.95 71.13 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.18 0.592 . . . . 0.0 111.591 -178.019 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.536 ' HG2' ' HE2' ' A' ' 90' ' ' LYS . 34.5 tt0 -64.83 -37.01 86.18 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.095 0.558 . . . . 0.0 111.397 179.133 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.633 ' HB3' HD12 ' A' ' 83' ' ' ILE . 5.3 t70 -61.88 -34.06 75.32 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.881 0.872 . . . . 0.0 110.366 -179.411 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -72.23 -11.63 60.81 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.883 0.873 . . . . 0.0 113.017 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 84.2 mt -96.43 -53.0 8.59 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 123.641 0.776 . . . . 0.0 109.723 178.27 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.536 ' HE2' ' HG2' ' A' ' 86' ' ' GLN . 0.2 OUTLIER -72.97 -42.46 63.31 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.456 0.702 . . . . 0.0 111.834 -176.453 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -117.81 26.67 9.52 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.343 1.057 . . . . 0.0 110.098 -167.856 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.49 -58.89 3.68 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.667 0.787 . . . . 0.0 112.956 -174.393 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -64.66 -33.92 77.08 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.103 177.849 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.44 ' O ' ' HG2' ' A' ' 98' ' ' GLU . . . -60.5 -52.24 53.8 Favored Glycine 0 C--N 1.354 1.579 0 O-C-N 124.474 1.109 . . . . 0.0 112.269 -178.89 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 22.1 mt -55.73 -53.8 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 124.653 1.181 . . . . 0.0 109.933 -179.143 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 88.8 mt -57.05 -51.34 70.24 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.954 0 CA-C-N 114.47 -1.241 . . . . 0.0 111.638 -177.074 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.03 -30.44 69.66 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -178.355 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' A' ' 94' ' ' GLY . 31.2 mm-40 -63.15 -41.35 99.26 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.4 0.68 . . . . 0.0 109.751 177.107 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.452 HG21 HG23 ' A' ' 60' ' ' ILE . 58.5 mt -76.23 -35.25 27.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 -177.74 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -60.77 -48.14 83.14 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.024 0.93 . . . . 0.0 111.516 178.706 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -70.25 -36.85 74.75 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.952 -179.176 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 62.3 mtm -69.4 -52.01 31.02 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.905 0.482 . . . . 0.0 111.645 -178.033 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 20.0 mt -59.89 -49.08 85.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 O-C-N 123.677 0.611 . . . . 0.0 110.43 178.658 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.34 -28.21 69.85 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -178.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 32.8 t -81.4 -35.57 30.58 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 122.789 0.435 . . . . 0.0 111.551 -178.056 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -81.7 -30.27 32.64 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 122.368 0.267 . . . . 0.0 111.48 -178.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -76.45 -46.53 26.56 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 122.474 0.309 . . . . 0.0 110.457 178.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 86.9 mm-40 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.877 -0.583 . . . . 0.0 110.316 179.605 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.0 tmm? . . . . . 0 N--CA 1.482 1.145 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 44.0 p -73.49 84.8 1.52 Allowed 'General case' 0 CA--C 1.548 0.889 0 CA-C-O 121.357 0.599 . . . . 0.0 111.184 -177.365 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 48.7 pttt -86.16 159.6 19.46 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.642 0.777 . . . . 0.0 110.249 177.677 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.574 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.7 tmtp? -145.34 132.85 20.81 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 -169.261 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.521 HD11 HG13 ' A' ' 96' ' ' ILE . 10.4 tt -121.23 135.16 55.18 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 107.705 -1.22 . . . . 0.0 107.705 176.145 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.57 HD12 HD13 ' A' ' 50' ' ' LEU . 15.9 pt -127.92 161.27 36.33 Favored 'Isoleucine or valine' 0 C--O 1.242 0.705 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 174.75 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.598 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -152.62 167.54 28.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.12 178.654 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.544 HD21 ' HG3' ' A' ' 41' ' ' GLN . 2.5 tt -140.73 114.97 9.26 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 -178.344 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.546 ' HA ' ' O ' ' A' ' 64' ' ' SER . 56.2 m -107.08 113.14 26.42 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.817 0.847 . . . . 0.0 108.973 176.82 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -128.87 123.89 33.84 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 122.596 0.358 . . . . 0.0 111.225 -177.517 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.76 ' SG ' HD13 ' A' ' 85' ' ' LEU . 1.2 m -133.55 149.77 73.09 Favored Pre-proline 0 N--CA 1.479 0.996 0 C-N-CA 124.022 0.929 . . . . 0.0 110.362 177.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -79.52 -11.86 14.12 Favored 'Trans proline' 0 C--N 1.375 1.928 0 C-N-CA 122.596 2.197 . . . . 0.0 112.013 176.657 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 21.8 mmt -73.33 -50.61 21.16 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.309 1.043 . . . . 0.0 110.348 -176.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 158.66 -175.18 35.75 Favored Glycine 0 C--N 1.346 1.105 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.107 -179.287 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 74.3 mt -78.6 -16.47 57.34 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.111 0.564 . . . . 0.0 112.357 -176.607 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -57.69 -51.52 69.21 Favored 'General case' 0 C--O 1.25 1.088 0 CA-C-O 121.29 0.567 . . . . 0.0 111.309 177.877 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.438 ' ND1' HD22 ' A' ' 85' ' ' LEU . 4.3 t-80 -67.06 -38.54 85.97 Favored 'General case' 0 C--O 1.248 1.017 0 CA-C-N 114.866 -1.061 . . . . 0.0 110.213 -176.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 44.8 p -67.98 -35.68 78.76 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.968 -178.49 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -70.59 -26.77 63.67 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 122.839 0.455 . . . . 0.0 111.789 178.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 38.1 mtm -68.56 -43.06 77.41 Favored 'General case' 0 N--CA 1.484 1.233 0 CA-C-N 117.717 0.235 . . . . 0.0 110.603 174.009 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.91 -41.94 95.16 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.768 174.845 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.73 -43.8 98.14 Favored 'General case' 0 C--O 1.216 -0.705 0 CA-C-N 115.201 -0.909 . . . . 0.0 110.743 179.005 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.438 ' O ' ' HG3' ' A' ' 27' ' ' GLU . 9.0 tp-100 -62.71 -44.47 96.14 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.245 0.618 . . . . 0.0 110.816 -178.316 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.535 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -68.02 -49.18 63.1 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.65 -175.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 98.6 mt -64.24 -31.21 72.32 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.241 0.616 . . . . 0.0 111.694 177.716 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.507 ' O ' HG23 ' A' ' 30' ' ' VAL . 30.7 tt0 -63.09 -56.41 17.14 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.632 0.773 . . . . 0.0 110.17 179.113 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.438 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 49.7 mt-10 -55.05 -46.73 75.37 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 124.187 0.929 . . . . 0.0 110.657 -179.525 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.24 -51.01 71.54 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.322 1.049 . . . . 0.0 111.625 -178.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.14 -22.73 65.77 Favored 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 113.788 1.032 . . . . 0.0 113.788 178.053 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.507 HG23 ' O ' ' A' ' 26' ' ' GLU . 52.1 t -76.56 -43.66 34.87 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 178.748 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -68.45 -26.73 65.65 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 114.831 -1.077 . . . . 0.0 110.354 176.465 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.401 ' HB1' ' HE1' ' A' ' 34' ' ' TYR . . . -76.52 -26.48 55.26 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.211 1.004 . . . . 0.0 111.636 176.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 102.75 15.03 25.63 Favored Glycine 0 C--N 1.349 1.277 0 N-CA-C 114.654 0.622 . . . . 0.0 114.654 168.819 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.401 ' HE1' ' HB1' ' A' ' 32' ' ' ALA . 1.7 m-85 -95.54 162.54 13.59 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-N 117.844 0.822 . . . . 0.0 109.549 176.028 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.574 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 43.4 tt0 -74.0 126.19 29.94 Favored 'General case' 0 C--O 1.222 -0.373 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 160.732 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.48 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 12.5 p -115.11 132.66 63.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-N 118.772 0.715 . . . . 0.0 111.093 -172.68 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 49.3 tptt -142.33 117.55 10.12 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 179.678 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.598 HG12 ' HB3' ' A' ' 7' ' ' ALA . 55.9 mt -121.1 112.02 33.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -174.535 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.467 ' HG3' ' HA ' ' A' ' 49' ' ' ARG . 41.9 tt0 -71.09 138.91 50.13 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.249 1.02 . . . . 0.0 109.176 172.882 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 7.0 p -128.52 122.1 30.34 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 123.895 0.878 . . . . 0.0 108.911 -177.764 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.852 HE22 ' H ' ' A' ' 71' ' ' ASP . 24.5 mt-30 -122.04 151.75 40.51 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.622 0.725 . . . . 0.0 111.675 -176.218 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -161.31 173.1 37.68 Favored Glycine 0 C--O 1.241 0.554 0 CA-C-N 114.086 -1.415 . . . . 0.0 110.239 172.254 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.02 -16.45 63.72 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 122.919 0.487 . . . . 0.0 110.993 176.817 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -75.7 -34.82 60.43 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 123.821 0.848 . . . . 0.0 110.674 172.067 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 154.26 -176.99 31.91 Favored Glycine 0 C--N 1.348 1.198 0 CA-C-N 116.348 -0.387 . . . . 0.0 113.163 178.292 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.492 HG23 ' HG2' ' A' ' 41' ' ' GLN . 44.1 mt -108.73 156.15 9.44 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 124.434 1.094 . . . . 0.0 109.677 -178.187 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -151.2 149.61 29.63 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.821 0.848 . . . . 0.0 109.514 178.67 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.6 t30 60.4 34.68 20.6 Favored 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 124.135 0.974 . . . . 0.0 110.623 173.079 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.467 ' HA ' ' HG3' ' A' ' 39' ' ' GLU . 23.8 ttp180 -63.2 138.64 58.61 Favored 'General case' 0 C--N 1.351 0.652 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 -168.256 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.57 HD13 HD12 ' A' ' 6' ' ' ILE . 57.8 mt -80.4 121.55 25.86 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 113.747 -1.57 . . . . 0.0 111.504 -177.833 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 43.8 p -87.62 166.92 14.35 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 114.675 -1.148 . . . . 0.0 110.229 -177.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -53.13 -34.03 54.95 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.636 0.774 . . . . 0.0 111.898 179.056 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -68.28 -48.19 65.67 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 123.906 0.754 . . . . 0.0 111.271 178.829 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -58.85 -41.88 88.04 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.398 0.679 . . . . 0.0 111.236 -178.517 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.5 HG22 ' HG3' ' A' ' 78' ' ' ARG . 41.1 mt -76.09 -35.39 28.63 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.299 -173.834 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.82 -43.81 62.23 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.23 0.612 . . . . 0.0 111.181 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -85.44 -1.31 56.9 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.436 0.694 . . . . 0.0 111.985 -177.669 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.98 110.2 4.33 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.034 0.534 . . . . 0.0 111.202 178.69 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 16.4 m -61.55 -36.0 79.35 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 124.299 1.04 . . . . 0.0 110.082 167.012 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.535 HG23 HG21 ' A' ' 99' ' ' ILE . 55.6 mt -135.26 143.13 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 C-N-CA 123.885 0.874 . . . . 0.0 110.416 -179.381 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 23.0 mt -135.17 123.49 39.67 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 123.776 0.83 . . . . 0.0 109.165 173.608 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.2 mp -111.65 140.61 30.31 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.332 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 173.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' HIS . . . . . 0.541 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 6.9 m170 -114.36 84.89 2.13 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 168.473 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.546 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 15.9 m -81.39 81.98 7.36 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 114.821 -1.081 . . . . 0.0 109.483 176.002 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 30.2 m -125.33 162.72 27.49 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-O 121.782 0.801 . . . . 0.0 112.114 -171.724 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -114.98 -28.35 7.05 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 114.029 -1.441 . . . . 0.0 108.776 173.588 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 22.8 m -137.11 168.6 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 125.371 1.469 . . . . 0.0 108.955 178.588 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 62.1 m -66.42 119.28 61.24 Favored Pre-proline 0 CA--C 1.551 1.013 0 C-N-CA 123.191 0.597 . . . . 0.0 111.02 179.615 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.5 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 57.9 Cg_endo -72.68 146.3 43.1 Favored 'Trans proline' 0 C--N 1.371 1.718 0 C-N-CA 122.406 2.07 . . . . 0.0 111.12 170.285 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -64.77 -31.98 73.46 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 123.12 0.568 . . . . 0.0 111.826 -175.102 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.852 ' H ' HE22 ' A' ' 41' ' ' GLN . 6.4 m-20 -102.81 25.6 9.06 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.461 0.704 . . . . 0.0 111.731 -177.9 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.5 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 5.8 p30 -60.89 -27.65 68.31 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.088 0.555 . . . . 0.0 110.726 174.792 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -59.94 -27.28 66.66 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 125.19 1.396 . . . . 0.0 112.985 177.344 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 81.6 mtt180 -68.59 -21.01 64.54 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.285 0.634 . . . . 0.0 111.85 178.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.468 ' HB3' HG21 ' A' ' 80' ' ' VAL . 32.3 m-85 -111.31 7.26 20.96 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.371 1.069 . . . . 0.0 111.236 -174.593 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -53.56 -47.61 69.89 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.761 1.224 . . . . 0.0 113.279 -172.392 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 94.4 p -101.55 4.2 40.81 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.277 0.631 . . . . 0.0 112.348 -174.005 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.5 ' HG3' HG22 ' A' ' 55' ' ' ILE . 29.8 mmt180 -101.65 162.67 12.73 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 122.685 0.394 . . . . 0.0 111.062 -174.216 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -76.7 91.37 3.45 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.357 0.663 . . . . 0.0 110.644 -177.002 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.468 HG21 ' HB3' ' A' ' 75' ' ' PHE . 31.3 t -109.78 148.96 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 123.815 0.846 . . . . 0.0 110.724 -175.873 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -121.24 89.85 3.21 Favored 'General case' 0 C--N 1.348 0.509 0 C-N-CA 124.448 1.099 . . . . 0.0 108.706 -178.063 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.541 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 41.9 mt-10 -79.07 122.49 26.28 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.372 -175.082 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.44 HG13 ' HA ' ' A' ' 64' ' ' SER . 46.1 pt -135.69 -176.55 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.85 0 C-N-CA 124.962 1.305 . . . . 0.0 108.954 178.254 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 23.8 p -81.4 152.48 27.42 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-O 120.878 0.37 . . . . 0.0 110.211 170.244 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.76 HD13 ' SG ' ' A' ' 11' ' ' CYS . 6.3 tt -63.86 -29.82 70.97 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.064 175.716 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -63.9 -44.75 92.05 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.85 176.039 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -60.63 -32.12 71.29 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 122.921 0.488 . . . . 0.0 110.973 -177.615 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.11 -35.87 81.66 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.05 0.94 . . . . 0.0 112.748 178.561 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 59.5 mt -76.41 -38.11 31.96 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 O-C-N 123.648 0.593 . . . . 0.0 110.621 -176.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.21 -56.94 3.11 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 122.894 0.478 . . . . 0.0 112.069 -177.675 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -98.21 29.78 3.4 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.11 0.964 . . . . 0.0 110.651 -169.574 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.535 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -43.74 -63.08 0.91 Allowed 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.35 1.06 . . . . 0.0 113.316 -176.535 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.96 -34.04 75.39 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.357 -179.53 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.444 ' O ' ' HG2' ' A' ' 98' ' ' GLU . . . -63.83 -47.48 85.77 Favored Glycine 0 C--N 1.353 1.52 0 O-C-N 124.127 0.892 . . . . 0.0 112.613 -179.321 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 19.1 mt -61.7 -53.54 46.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 123.947 0.899 . . . . 0.0 110.461 -177.424 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.521 HG13 HD11 ' A' ' 5' ' ' LEU . 1.9 mp -55.78 -51.04 64.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 O-C-N 124.015 0.822 . . . . 0.0 110.439 -178.615 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.72 -28.29 67.53 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 123.565 0.54 . . . . 0.0 111.781 -176.074 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 94' ' ' GLY . 63.6 mm-40 -62.0 -37.17 83.83 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.304 0.642 . . . . 0.0 109.857 174.34 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.535 HG21 HG23 ' A' ' 60' ' ' ILE . 33.7 mt -79.75 -37.84 18.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.622 -178.413 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.475 ' HG3' ' O ' ' A' ' 96' ' ' ILE . 32.2 mt-10 -60.17 -41.44 92.84 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.276 0.631 . . . . 0.0 110.974 178.191 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -74.55 -31.95 62.27 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 123.406 0.441 . . . . 0.0 110.988 -178.749 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 67.7 mtm -66.1 -37.95 87.02 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 122.562 0.345 . . . . 0.0 111.07 172.828 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.432 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 45.1 mt -69.89 -40.63 79.05 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.855 0 C-N-CA 123.161 0.584 . . . . 0.0 109.555 175.439 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.12 -18.61 64.68 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.503 0.721 . . . . 0.0 111.212 177.159 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 33.3 t -86.61 -41.48 14.23 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.421 0.688 . . . . 0.0 110.849 179.052 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.432 ' HG2' ' HA ' ' A' ' 103' ' ' ILE . 18.6 pt-20 -77.26 -28.4 53.54 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 122.828 0.451 . . . . 0.0 111.504 -176.801 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 79.1 mm-40 -87.99 -36.83 16.82 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 122.923 0.489 . . . . 0.0 111.044 -179.375 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 85.0 mm-40 . . . . . 0 N--CA 1.478 0.951 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 176.436 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.6 mtt . . . . . 0 N--CA 1.48 1.07 0 N-CA-C 110.484 -0.191 . . . . 0.0 110.484 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.8 t -64.08 99.6 0.27 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.789 0.836 . . . . 0.0 111.131 -177.665 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.583 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 17.1 pttt -106.08 176.73 5.07 Favored 'General case' 0 C--O 1.251 1.178 0 C-N-CA 123.514 0.726 . . . . 0.0 111.271 177.343 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.574 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.0 tmtp? -147.53 146.01 29.3 Favored 'General case' 0 CA--C 1.55 0.944 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.257 -172.104 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.426 ' N ' ' HD3' ' A' ' 4' ' ' LYS . 8.5 tt -132.8 135.74 45.86 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.608 1.163 . . . . 0.0 108.116 176.116 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 20.4 pt -125.51 162.8 27.77 Favored 'Isoleucine or valine' 0 C--O 1.242 0.682 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 170.134 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.579 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -150.81 170.54 19.01 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 122.986 0.514 . . . . 0.0 110.028 177.184 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.7 tt -143.91 121.92 12.1 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 107.489 -1.301 . . . . 0.0 107.489 -178.114 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.554 ' HA ' ' O ' ' A' ' 64' ' ' SER . 64.0 m -114.8 113.62 24.48 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.874 0.87 . . . . 0.0 108.984 178.274 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.417 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -126.88 117.83 23.38 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 -174.964 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.772 ' SG ' HD13 ' A' ' 85' ' ' LEU . 71.5 m -118.33 144.59 35.39 Favored Pre-proline 0 N--CA 1.481 1.095 0 C-N-CA 124.687 1.195 . . . . 0.0 110.039 176.5 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -80.81 -8.99 13.32 Favored 'Trans proline' 0 C--N 1.368 1.597 0 C-N-CA 122.658 2.239 . . . . 0.0 112.671 172.409 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 53.5 tpp -78.71 -66.7 0.83 Allowed 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.559 0.743 . . . . 0.0 109.873 176.676 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 179.92 -172.84 44.47 Favored Glycine 0 C--N 1.342 0.885 0 CA-C-N 115.569 -0.741 . . . . 0.0 112.24 -176.5 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 89.5 mt -82.39 -13.64 56.51 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.231 0.826 . . . . 0.0 113.231 -174.399 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.08 -49.92 75.24 Favored 'General case' 0 CA--C 1.556 1.207 0 CA-C-O 121.098 0.475 . . . . 0.0 112.163 -179.751 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.464 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 10.0 t-160 -67.88 -39.44 83.69 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.103 -178.915 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 30.9 p -65.56 -32.41 73.99 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.053 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 14.7 m-30 -73.76 -30.43 62.78 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.484 0.714 . . . . 0.0 112.109 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 67.8 mtm -70.18 -36.48 74.68 Favored 'General case' 0 N--CA 1.487 1.423 0 CA-C-O 120.674 0.274 . . . . 0.0 110.452 173.826 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.26 -38.13 75.07 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.754 173.88 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.84 -42.5 81.34 Favored 'General case' 0 C--O 1.214 -0.768 0 C-N-CA 123.735 0.814 . . . . 0.0 110.575 -179.157 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.468 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 5.7 tp-100 -64.79 -44.49 89.8 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 122.949 0.499 . . . . 0.0 109.875 177.672 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.625 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -62.45 -51.79 66.1 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.836 -176.295 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 98.5 mt -67.48 -29.98 69.57 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.581 0.752 . . . . 0.0 111.511 178.402 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.504 ' HA ' HG21 ' A' ' 36' ' ' VAL . 32.1 tt0 -60.36 -58.54 8.07 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 123.713 0.633 . . . . 0.0 109.432 176.377 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 23' ' ' GLN . 12.1 mm-40 -51.31 -50.35 59.53 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 124.746 1.279 . . . . 0.0 110.736 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.82 -49.73 72.47 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.596 1.159 . . . . 0.0 112.153 -179.359 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.53 -29.83 70.52 Favored 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 176.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.5 HG23 ' O ' ' A' ' 26' ' ' GLU . 53.2 t -72.45 -36.65 55.17 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -179.54 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 14.1 mm-40 -71.37 -31.43 67.3 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.466 1.106 . . . . 0.0 110.801 177.549 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.77 -23.23 60.79 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.749 0.819 . . . . 0.0 111.616 175.767 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.13 23.21 27.86 Favored Glycine 0 C--N 1.348 1.2 0 N-CA-C 114.953 0.741 . . . . 0.0 114.953 166.003 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.583 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -118.29 178.03 4.59 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.294 0.638 . . . . 0.0 110.889 169.821 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.574 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 43.0 tt0 -74.51 147.47 41.83 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.432 178.124 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.504 HG21 ' HA ' ' A' ' 26' ' ' GLU . 15.0 p -127.12 139.33 52.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 122.756 0.422 . . . . 0.0 110.176 178.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.2 tptt -145.96 110.04 4.94 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 173.364 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.579 HG12 ' HB3' ' A' ' 7' ' ' ALA . 47.3 mt -115.07 111.33 35.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 C-N-CA 122.734 0.413 . . . . 0.0 111.338 -176.68 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.46 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 32.7 tt0 -73.51 145.66 45.44 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.448 0.699 . . . . 0.0 109.195 169.415 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.431 HG22 ' HB2' ' A' ' 9' ' ' CYS . 13.3 p -129.69 113.96 15.41 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 123.699 0.799 . . . . 0.0 108.877 -179.839 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.49 HE22 ' HB2' ' A' ' 70' ' ' GLU . 45.2 mt-30 -105.21 143.64 33.11 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.264 0.626 . . . . 0.0 110.223 179.441 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.409 ' HA2' ' O ' ' A' ' 11' ' ' CYS . . . -162.17 163.05 34.7 Favored Glycine 0 C--N 1.336 0.544 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.928 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.51 -23.61 67.47 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.186 0.595 . . . . 0.0 110.924 173.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -73.52 -35.06 65.53 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 124.431 1.092 . . . . 0.0 111.278 175.598 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 160.4 -174.46 37.12 Favored Glycine 0 C--N 1.347 1.174 0 CA-C-N 116.135 -0.484 . . . . 0.0 112.332 -178.692 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 76.7 mt -123.36 134.9 64.95 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 123.439 0.696 . . . . 0.0 109.153 174.471 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -127.77 149.99 50.01 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.313 1.045 . . . . 0.0 109.675 -178.068 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 6.8 t30 61.7 40.13 13.5 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 124.504 1.122 . . . . 0.0 110.58 173.332 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 16.1 tpp180 -47.81 122.59 5.11 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 125.576 1.55 . . . . 0.0 112.603 -176.537 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.46 ' HG ' ' HB2' ' A' ' 39' ' ' GLU . 42.4 mt -69.39 133.6 47.99 Favored 'General case' 0 C--O 1.241 0.657 0 C-N-CA 124.419 1.088 . . . . 0.0 111.032 174.712 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 44.8 p -91.7 163.37 14.11 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 115.113 -0.948 . . . . 0.0 109.085 175.006 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.33 -26.46 66.59 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 122.527 0.331 . . . . 0.0 110.895 173.501 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -70.0 -43.34 71.59 Favored 'General case' 0 C--N 1.355 0.834 0 C-N-CA 123.788 0.835 . . . . 0.0 110.634 177.039 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 45.0 m-20 -58.18 -43.21 87.39 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 122.807 0.443 . . . . 0.0 110.677 176.24 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.401 HG22 ' HG3' ' A' ' 78' ' ' ARG . 22.9 mt -70.24 -27.76 33.2 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 O-C-N 123.986 0.804 . . . . 0.0 110.614 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.47 -40.51 42.85 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.916 0.886 . . . . 0.0 111.817 179.541 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -74.4 -32.0 62.54 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.903 0.881 . . . . 0.0 111.117 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -52.75 99.37 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.658 0 O-C-N 124.747 1.279 . . . . 0.0 113.099 -171.177 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 26.1 m -62.42 -34.5 76.87 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 123.551 0.741 . . . . 0.0 109.163 167.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.488 HG23 HG21 ' A' ' 99' ' ' ILE . 76.7 mt -132.33 140.54 47.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.397 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.408 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 21.8 mt -130.38 139.06 52.3 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 172.072 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -126.81 128.95 71.38 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 173.631 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -103.54 86.97 2.73 Favored 'General case' 0 N--CA 1.489 1.49 0 CA-C-N 118.853 0.751 . . . . 0.0 109.486 169.457 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.554 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 19.6 m -82.86 82.4 8.17 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 124.653 1.181 . . . . 0.0 109.631 175.505 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 26.9 m -127.8 163.88 30.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-O 121.643 0.735 . . . . 0.0 111.719 -169.835 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -117.73 -14.9 10.15 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 114.322 -1.308 . . . . 0.0 109.594 174.741 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 15.2 m -132.07 177.99 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 125.283 1.433 . . . . 0.0 109.359 178.356 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 81.1 m -72.76 114.89 34.5 Favored Pre-proline 0 CA--C 1.545 0.767 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 167.235 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.607 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 33.3 Cg_endo -68.94 146.65 65.99 Favored 'Trans proline' 0 C--N 1.374 1.908 0 C-N-CA 121.788 1.659 . . . . 0.0 110.574 174.747 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.49 ' HB2' HE22 ' A' ' 41' ' ' GLN . 20.1 mm-40 -65.13 -33.7 76.65 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-O 121.387 0.613 . . . . 0.0 111.142 -172.668 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -96.85 9.8 40.81 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.778 -174.68 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.607 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 8.5 t30 -55.28 -34.98 64.57 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 124.112 0.965 . . . . 0.0 112.016 179.016 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -59.55 -22.91 62.37 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 124.993 1.317 . . . . 0.0 113.444 177.711 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 29.3 mtp180 -87.13 -18.71 29.82 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.877 0.871 . . . . 0.0 111.103 -178.802 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.442 ' HB3' HG21 ' A' ' 80' ' ' VAL . 70.6 m-85 -102.56 7.71 39.99 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 124.191 0.996 . . . . 0.0 110.745 178.31 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.8 tp10 -57.48 -51.01 71.17 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 124.696 1.198 . . . . 0.0 112.453 -172.371 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 56.6 p -86.94 -10.55 52.99 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.226 0.61 . . . . 0.0 112.145 -177.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.401 ' HG3' HG22 ' A' ' 55' ' ' ILE . 26.6 mmt180 -89.72 157.3 18.03 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.59 0.756 . . . . 0.0 110.998 -177.109 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -78.28 95.73 5.09 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.491 0.716 . . . . 0.0 110.946 -174.845 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.442 HG21 ' HB3' ' A' ' 75' ' ' PHE . 44.6 t -110.85 140.91 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 123.398 0.679 . . . . 0.0 110.784 -177.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -109.53 91.3 3.59 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 124.511 1.124 . . . . 0.0 108.95 176.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -76.78 133.0 39.55 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.128 -177.213 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.407 HG13 ' HA ' ' A' ' 64' ' ' SER . 31.5 pt -145.06 -173.25 0.46 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.838 0 C-N-CA 125.371 1.468 . . . . 0.0 108.438 176.168 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 35.5 p -86.78 153.54 21.6 Favored 'General case' 0 C--O 1.24 0.591 0 CA-C-O 121.211 0.529 . . . . 0.0 110.274 169.78 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.772 HD13 ' SG ' ' A' ' 11' ' ' CYS . 6.0 tt -66.27 -29.75 70.04 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.702 176.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -59.31 -45.93 89.97 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 123.884 0.874 . . . . 0.0 110.957 172.23 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -62.35 -33.35 74.55 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 123.894 0.746 . . . . 0.0 110.981 -179.181 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.463 ' HB2' ' HB3' ' A' ' 64' ' ' SER . . . -63.54 -31.51 72.7 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.79 0.836 . . . . 0.0 112.557 179.594 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 74.1 mt -79.21 -57.05 5.72 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.218 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.72 -47.43 53.95 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 115.865 -0.607 . . . . 0.0 112.167 -173.68 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -105.16 22.91 14.51 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.156 0.983 . . . . 0.0 110.962 -170.483 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.625 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -39.42 -61.98 0.73 Allowed 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 124.796 1.238 . . . . 0.0 113.985 -174.86 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.65 -30.82 69.61 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 114.564 -1.198 . . . . 0.0 111.345 -178.242 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.54 -45.24 95.2 Favored Glycine 0 C--N 1.35 1.342 0 O-C-N 123.942 0.776 . . . . 0.0 111.939 179.251 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 13.5 mt -60.79 -56.05 20.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.338 1.055 . . . . 0.0 110.471 -179.608 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.7 mp -56.23 -49.76 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 O-C-N 123.781 0.675 . . . . 0.0 111.011 -178.374 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.62 -27.69 66.25 Favored 'General case' 0 N--CA 1.485 1.318 0 O-C-N 123.294 0.371 . . . . 0.0 111.342 -176.77 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -62.33 -42.03 99.05 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.418 0.687 . . . . 0.0 109.856 175.62 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.488 HG21 HG23 ' A' ' 60' ' ' ILE . 25.9 mt -76.83 -36.46 26.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 -176.01 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -61.77 -44.14 97.47 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-N 114.539 -1.209 . . . . 0.0 111.794 176.449 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -76.4 -29.52 57.13 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 123.123 0.264 . . . . 0.0 110.904 -176.449 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 69.0 mtm -69.0 -54.12 16.92 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 122.749 0.42 . . . . 0.0 110.313 176.051 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 62.5 mt -60.36 -45.92 95.8 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 123.165 0.586 . . . . 0.0 110.263 178.529 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.495 ' O ' ' HG2' ' A' ' 108' ' ' GLN . . . -56.08 -48.5 75.97 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 122.869 0.467 . . . . 0.0 110.811 179.375 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 22.9 t -63.73 -43.01 97.8 Favored 'General case' 0 N--CA 1.48 1.038 0 O-C-N 123.785 0.678 . . . . 0.0 111.614 -171.498 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -74.54 -23.84 58.86 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.887 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -87.51 -19.05 28.48 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.655 0.382 . . . . 0.0 111.093 175.838 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.495 ' HG2' ' O ' ' A' ' 104' ' ' ALA . 86.0 mm-40 . . . . . 0 C--O 1.253 1.264 0 C-N-CA 123.369 0.668 . . . . 0.0 109.236 173.678 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.3 mpp? . . . . . 0 N--CA 1.485 1.314 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.0 t -102.41 179.07 4.41 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.331 0.653 . . . . 0.0 109.596 173.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.556 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 5.8 pttt -138.18 -168.12 2.3 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.961 0.905 . . . . 0.0 110.178 -168.782 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.575 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.6 tmtp? -145.14 144.08 30.7 Favored 'General case' 0 CA--C 1.556 1.208 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 -178.319 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.46 ' N ' ' HD3' ' A' ' 4' ' ' LYS . 9.1 tt -130.04 136.56 49.51 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.03 1.332 . . . . 0.0 107.583 174.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.469 HG13 HG23 ' A' ' 61' ' ' ILE . 21.4 pt -126.76 159.67 36.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 170.658 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.604 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -149.23 166.33 29.21 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 123.001 0.52 . . . . 0.0 110.107 177.052 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.584 HD21 ' HG3' ' A' ' 41' ' ' GLN . 3.1 tt -139.3 112.16 7.91 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 -178.963 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.565 ' HA ' ' O ' ' A' ' 64' ' ' SER . 62.9 m -99.94 114.31 27.48 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.9 0.88 . . . . 0.0 109.39 175.151 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.439 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -131.04 122.82 27.44 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 122.768 0.427 . . . . 0.0 111.208 -179.165 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.759 ' SG ' HD13 ' A' ' 85' ' ' LEU . 1.2 m -134.88 148.15 65.84 Favored Pre-proline 0 N--CA 1.478 0.945 0 C-N-CA 123.844 0.858 . . . . 0.0 110.619 178.495 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -79.57 -12.49 13.8 Favored 'Trans proline' 0 C--N 1.373 1.856 0 C-N-CA 122.74 2.294 . . . . 0.0 111.243 173.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 45.7 mtt -65.51 -42.59 91.88 Favored 'General case' 0 C--N 1.352 0.68 0 C-N-CA 125.086 1.354 . . . . 0.0 109.746 177.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 141.94 -177.94 21.04 Favored Glycine 0 C--N 1.348 1.233 0 CA-C-N 115.483 -0.781 . . . . 0.0 111.962 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 29.9 mt -73.36 -25.04 60.43 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -177.785 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.66 -41.99 91.84 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-O 121.091 0.472 . . . . 0.0 111.049 179.505 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.532 ' ND1' HD22 ' A' ' 85' ' ' LEU . 12.9 t-80 -67.77 -42.64 81.41 Favored 'General case' 0 C--O 1.251 1.133 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.282 179.305 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.424 ' HA ' HD11 ' A' ' 85' ' ' LEU . 43.5 p -66.5 -30.4 70.72 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 115.085 -0.961 . . . . 0.0 111.214 -179.567 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 18.8 m-30 -71.12 -32.66 69.28 Favored 'General case' 0 C--N 1.351 0.639 0 C-N-CA 123.317 0.647 . . . . 0.0 110.967 179.027 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 47.6 mtm -65.65 -39.3 91.25 Favored 'General case' 0 N--CA 1.486 1.335 0 CA-C-O 120.74 0.305 . . . . 0.0 110.713 176.126 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.22 -37.65 72.02 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.417 174.508 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.54 -38.55 91.4 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.717 0.807 . . . . 0.0 110.816 179.591 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 7.6 tp-100 -68.98 -45.65 70.08 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.027 0.531 . . . . 0.0 110.173 179.042 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.488 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -59.93 -57.21 13.86 Favored 'General case' 0 C--O 1.242 0.675 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.298 -177.785 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.429 HD11 ' OG ' ' A' ' 64' ' ' SER . 94.7 mt -64.2 -32.0 73.41 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.005 0.522 . . . . 0.0 111.852 -178.58 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.536 ' HA ' HG21 ' A' ' 36' ' ' VAL . 32.4 tt0 -61.64 -56.39 20.35 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 110.121 -0.326 . . . . 0.0 110.121 -179.283 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.476 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 44.5 mm-40 -54.02 -49.07 69.73 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 124.584 1.177 . . . . 0.0 111.502 179.229 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.42 ' HB3' HD12 ' A' ' 96' ' ' ILE . . . -65.48 -36.19 83.14 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.438 0.695 . . . . 0.0 112.099 -176.603 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.93 -24.13 58.45 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.06 0.544 . . . . 0.0 111.896 177.757 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 26' ' ' GLU . 54.5 t -68.68 -41.34 82.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 174.34 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.476 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 10.0 mm-40 -70.33 -25.9 63.51 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 114.027 -1.442 . . . . 0.0 111.185 179.363 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -82.77 -2.17 53.68 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 123.474 0.71 . . . . 0.0 112.407 178.229 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 87.84 17.72 57.57 Favored Glycine 0 C--N 1.35 1.346 0 N-CA-C 115.675 1.03 . . . . 0.0 115.675 164.034 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.556 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -130.16 175.37 8.97 Favored 'General case' 0 N--CA 1.484 1.263 0 CA-C-N 117.908 0.854 . . . . 0.0 112.639 175.579 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.575 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 37.0 tt0 -72.21 149.29 44.75 Favored 'General case' 0 C--N 1.353 0.737 0 CA-C-N 114.675 -1.148 . . . . 0.0 108.95 175.435 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.536 HG21 ' HA ' ' A' ' 26' ' ' GLU . 8.1 p -133.16 135.52 56.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 122.65 0.38 . . . . 0.0 110.2 -179.553 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 49.6 tptt -142.4 113.9 7.86 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 175.246 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.604 HG12 ' HB3' ' A' ' 7' ' ' ALA . 43.1 mt -116.78 110.35 31.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 122.838 0.455 . . . . 0.0 111.699 -176.325 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -74.0 144.97 44.94 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.421 0.688 . . . . 0.0 109.192 172.739 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 10.6 p -128.9 113.89 15.8 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.772 0.829 . . . . 0.0 109.46 -177.41 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.584 ' HG3' HD21 ' A' ' 8' ' ' LEU . 8.1 mt-30 -109.82 141.42 42.52 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 177.611 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -165.35 -177.22 37.58 Favored Glycine 0 C--O 1.241 0.593 0 N-CA-C 111.836 -0.506 . . . . 0.0 111.836 179.607 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.02 -31.9 70.38 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.366 0.666 . . . . 0.0 111.271 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -66.33 -40.38 89.85 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.447 0.699 . . . . 0.0 110.951 177.291 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 150.27 -158.6 27.75 Favored Glycine 0 C--N 1.344 1.023 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.989 -176.404 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 66.1 mt -116.14 137.48 49.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 C-N-CA 123.578 0.751 . . . . 0.0 109.556 179.063 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -136.83 151.11 48.77 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.111 0.964 . . . . 0.0 109.308 -176.099 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 17.2 t30 60.61 36.27 19.77 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 124.105 0.962 . . . . 0.0 110.242 177.386 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 14.5 tpp180 -43.59 125.63 4.1 Favored 'General case' 0 C--N 1.362 1.109 0 C-N-CA 126.292 1.837 . . . . 0.0 113.269 -174.902 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 50.1 mt -77.61 128.46 34.16 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.724 171.237 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 45.2 p -96.15 165.51 12.19 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.313 -0.858 . . . . 0.0 108.843 176.057 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.95 -29.94 67.51 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 122.697 0.399 . . . . 0.0 111.463 178.081 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.2 tp-100 -62.65 -41.47 99.06 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.839 0.856 . . . . 0.0 111.508 176.632 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.4 ' HB3' HG21 ' A' ' 6' ' ' ILE . 56.5 m-20 -63.81 -45.09 91.23 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 122.98 0.512 . . . . 0.0 110.545 176.835 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 10.5 mt -69.11 -28.54 39.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 O-C-N 123.836 0.71 . . . . 0.0 110.847 -178.233 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.68 -44.97 61.12 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.721 0.808 . . . . 0.0 111.216 -179.114 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -84.24 -11.19 56.89 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.303 0.641 . . . . 0.0 111.643 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.44 100.67 0.19 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.107 0.563 . . . . 0.0 111.83 -177.554 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 32.5 m -61.9 -40.94 97.17 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.218 168.595 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.529 HG23 HG21 ' A' ' 99' ' ' ILE . 68.4 mt -128.47 140.19 49.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.239 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.469 HG23 HG13 ' A' ' 6' ' ' ILE . 20.4 mt -131.21 133.8 62.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 171.75 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.4 mp -120.7 136.05 58.96 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 173.374 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' HIS . . . . . 0.484 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 8.5 m170 -107.76 86.37 2.29 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 167.544 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.565 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 33.9 m -79.22 79.91 5.62 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 114.529 -1.214 . . . . 0.0 109.208 175.598 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 36.0 m -127.54 161.09 35.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 121.553 0.692 . . . . 0.0 112.034 -169.642 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -118.34 -17.19 9.53 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.33 1.452 . . . . 0.0 108.751 174.043 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 11.8 m -133.93 160.1 42.07 Favored 'Isoleucine or valine' 0 C--N 1.35 0.621 0 C-N-CA 125.399 1.48 . . . . 0.0 109.096 175.54 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 41.6 m -69.78 109.98 5.69 Favored Pre-proline 0 CA--C 1.554 1.115 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 174.15 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -67.13 149.36 82.02 Favored 'Trans proline' 0 C--N 1.379 2.14 0 C-N-CA 122.381 2.054 . . . . 0.0 111.455 -177.544 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.402 ' H ' ' NE2' ' A' ' 41' ' ' GLN . 6.7 mm-40 -61.64 -31.64 71.75 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.223 0.609 . . . . 0.0 111.938 -171.561 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -104.14 21.24 16.85 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.482 0.713 . . . . 0.0 111.707 -175.71 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -60.66 -28.92 68.95 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.15 0.58 . . . . 0.0 111.841 -176.497 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -58.14 -32.59 68.32 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.164 0.985 . . . . 0.0 113.264 -179.103 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 74.4 mtt-85 -61.24 -38.53 87.01 Favored 'General case' 0 N--CA 1.483 1.224 0 CA-C-O 121.944 0.878 . . . . 0.0 110.52 177.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.445 ' HB3' HG21 ' A' ' 80' ' ' VAL . 41.0 m-85 -94.97 -19.83 19.89 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 113.794 -1.548 . . . . 0.0 111.001 -172.419 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -62.18 -30.08 70.81 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.171 0.988 . . . . 0.0 111.322 -176.649 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 22.6 t -81.53 -7.22 59.56 Favored 'General case' 0 CA--C 1.554 1.109 0 C-N-CA 123.824 0.849 . . . . 0.0 111.675 178.311 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 14.5 mmt85 -116.95 169.74 9.16 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.292 1.037 . . . . 0.0 110.24 -171.196 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -78.53 96.44 5.44 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.257 0.623 . . . . 0.0 110.801 -178.19 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.445 HG21 ' HB3' ' A' ' 75' ' ' PHE . 43.0 t -119.22 142.13 35.89 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 123.837 0.855 . . . . 0.0 110.674 -177.07 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 -108.8 94.01 4.82 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 177.781 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.484 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 38.8 mt-10 -83.06 114.17 21.11 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 115.267 -0.878 . . . . 0.0 110.956 -173.954 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.452 HG13 ' HA ' ' A' ' 64' ' ' SER . 45.6 pt -125.14 -173.84 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 124.74 1.216 . . . . 0.0 109.792 -179.017 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 20.3 p -83.55 149.14 26.78 Favored 'General case' 0 C--N 1.345 0.38 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.17 168.844 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.759 HD13 ' SG ' ' A' ' 11' ' ' CYS . 7.2 tt -63.68 -32.49 73.99 Favored 'General case' 0 N--CA 1.486 1.352 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.247 178.391 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.439 ' HG2' ' HE3' ' A' ' 90' ' ' LYS . 29.8 tt0 -61.22 -43.35 99.01 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.932 175.576 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -60.55 -31.31 70.42 Favored 'General case' 0 C--N 1.359 1.017 0 O-C-N 123.857 0.723 . . . . 0.0 110.825 179.765 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.49 -40.79 89.47 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.494 0.718 . . . . 0.0 111.908 177.186 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 63.0 mt -69.65 -42.01 80.33 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.899 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.57 -176.384 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.439 ' HE3' ' HG2' ' A' ' 86' ' ' GLN . 18.2 ptpt -87.56 -46.69 9.34 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 122.823 0.449 . . . . 0.0 112.191 -176.085 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -108.48 27.17 9.64 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 124.012 0.925 . . . . 0.0 110.946 -167.194 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.488 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -43.23 -57.96 2.73 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 124.383 1.073 . . . . 0.0 113.066 -177.448 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.37 -42.93 99.8 Favored 'General case' 0 C--N 1.344 0.357 0 CA-C-N 114.696 -1.138 . . . . 0.0 110.878 178.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -59.11 -47.6 89.99 Favored Glycine 0 C--N 1.352 1.462 0 O-C-N 124.269 0.98 . . . . 0.0 113.153 -176.239 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 14.4 mt -62.84 -55.75 21.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 123.946 0.898 . . . . 0.0 109.647 -177.375 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.42 HD12 ' HB3' ' A' ' 28' ' ' ALA . 69.2 mt -58.92 -46.62 91.25 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 CA-C-N 114.139 -1.391 . . . . 0.0 111.357 -175.165 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.54 -31.49 69.74 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 122.63 0.372 . . . . 0.0 110.645 -178.481 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -58.48 -44.02 89.18 Favored 'General case' 0 C--N 1.366 1.303 0 C-N-CA 123.369 0.668 . . . . 0.0 109.542 173.339 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.529 HG21 HG23 ' A' ' 60' ' ' ILE . 34.2 mt -76.41 -30.64 19.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.558 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 -174.598 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -62.5 -47.27 84.7 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.252 1.021 . . . . 0.0 111.772 175.558 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -74.35 -36.49 63.62 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 123.454 0.471 . . . . 0.0 110.624 -177.168 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 6.4 mtp -66.58 -52.83 41.12 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.179 0.991 . . . . 0.0 111.136 178.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.452 HD12 HG12 ' A' ' 60' ' ' ILE . 31.0 mt -66.33 -35.35 74.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.898 177.432 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.533 ' O ' ' HG2' ' A' ' 108' ' ' GLN . . . -58.61 -45.03 90.03 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 118.072 0.396 . . . . 0.0 110.377 174.662 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 22.7 t -67.56 -35.12 78.42 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.54 0.736 . . . . 0.0 111.312 -172.275 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.432 ' HG2' ' HA ' ' A' ' 103' ' ' ILE . 9.5 pt-20 -79.1 -28.45 43.01 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 116.763 -0.199 . . . . 0.0 111.307 177.171 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.433 ' HG2' ' O ' ' A' ' 103' ' ' ILE . 13.7 mm-40 -79.34 -11.35 59.93 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 122.541 0.336 . . . . 0.0 110.957 176.477 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.533 ' HG2' ' O ' ' A' ' 104' ' ' ALA . 80.4 mm-40 . . . . . 0 C--O 1.258 1.518 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 170.227 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.5 ttm . . . . . 0 N--CA 1.486 1.343 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 38.4 m -76.66 94.24 3.75 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 122.825 0.45 . . . . 0.0 110.199 178.133 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.404 ' HG2' ' H ' ' A' ' 3' ' ' LYS . 40.6 pttt -74.34 167.16 22.2 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.53 179.726 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.553 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.6 tmtp? -144.06 131.82 21.34 Favored 'General case' 0 N--CA 1.486 1.338 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 -172.095 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.464 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 10.4 tt -126.09 138.47 53.7 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 178.498 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 20.4 pt -128.68 164.16 31.49 Favored 'Isoleucine or valine' 0 C--O 1.241 0.644 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 171.803 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.576 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -152.02 168.35 25.49 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.037 178.129 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.8 tt -141.15 114.93 9.03 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 107.058 -1.46 . . . . 0.0 107.058 -177.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.545 ' HA ' ' O ' ' A' ' 64' ' ' SER . 61.4 m -106.72 113.06 26.34 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 176.791 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.411 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -127.41 127.49 44.23 Favored 'General case' 0 N--CA 1.497 1.922 0 C-N-CA 122.482 0.313 . . . . 0.0 111.836 -175.696 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.817 ' SG ' HD13 ' A' ' 85' ' ' LEU . 50.1 m -125.21 144.78 48.47 Favored Pre-proline 0 N--CA 1.478 0.935 0 C-N-CA 124.48 1.112 . . . . 0.0 110.609 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -75.82 -14.65 19.35 Favored 'Trans proline' 0 C--N 1.37 1.695 0 C-N-CA 122.379 2.053 . . . . 0.0 112.244 173.055 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 54.8 tpp -83.46 -71.76 0.49 Allowed 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.277 0.631 . . . . 0.0 110.531 178.899 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -171.43 -175.37 39.77 Favored Glycine 0 C--N 1.347 1.178 0 C-N-CA 121.807 -0.235 . . . . 0.0 113.351 -176.141 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 60.7 mt -82.37 -17.68 44.74 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -173.804 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.0 -43.6 91.51 Favored 'General case' 0 N--CA 1.487 1.418 0 CA-C-N 119.074 0.852 . . . . 0.0 111.253 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.439 ' ND1' ' SG ' ' A' ' 11' ' ' CYS . 18.2 t-160 -66.43 -43.04 86.75 Favored 'General case' 0 C--O 1.246 0.882 0 CA-C-N 115.015 -0.993 . . . . 0.0 110.199 178.912 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 31.8 p -66.42 -30.34 70.68 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 115.072 -0.967 . . . . 0.0 111.13 -178.22 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.1 m-30 -73.55 -32.11 64.01 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.328 0.651 . . . . 0.0 111.631 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 64.4 mtm -66.41 -38.98 88.68 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-O 120.788 0.328 . . . . 0.0 110.508 173.497 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.0 -40.58 82.99 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.89 174.265 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.36 -31.07 68.18 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.831 0.853 . . . . 0.0 110.963 -178.9 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 24.1 tp60 -67.8 -49.16 63.83 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.298 0.639 . . . . 0.0 109.404 177.062 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.548 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -66.3 -50.23 64.37 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-N 114.992 -1.004 . . . . 0.0 111.675 -174.889 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.418 HD11 ' OG ' ' A' ' 64' ' ' SER . 93.1 mt -64.46 -33.0 74.87 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.129 0.572 . . . . 0.0 111.643 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.45 ' O ' HG23 ' A' ' 30' ' ' VAL . 39.1 tt0 -58.3 -58.9 6.43 Favored 'General case' 0 C--N 1.353 0.747 0 O-C-N 123.838 0.711 . . . . 0.0 109.946 175.734 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -54.16 -47.37 72.03 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 124.602 1.189 . . . . 0.0 110.847 -177.541 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.13 -49.15 78.98 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.372 1.069 . . . . 0.0 111.991 -177.688 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.42 -21.4 61.99 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 113.329 0.862 . . . . 0.0 113.329 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.45 HG23 ' O ' ' A' ' 26' ' ' GLU . 54.1 t -77.6 -43.65 29.73 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.332 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 177.698 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -64.69 -32.44 74.12 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 114.902 -1.044 . . . . 0.0 110.36 174.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.24 -38.85 82.27 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.352 1.061 . . . . 0.0 111.344 175.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 109.32 22.17 6.93 Favored Glycine 0 C--N 1.342 0.908 0 CA-C-N 115.289 -0.869 . . . . 0.0 114.092 173.163 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.435 ' OH ' ' HG2' ' A' ' 100' ' ' GLU . 1.8 m-85 -95.63 162.95 13.4 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 117.974 0.887 . . . . 0.0 109.84 171.833 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.553 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 40.5 tt0 -75.98 122.82 24.76 Favored 'General case' 0 C--O 1.222 -0.361 0 N-CA-C 106.581 -1.637 . . . . 0.0 106.581 158.499 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.464 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 13.6 p -110.68 136.27 47.21 Favored 'Isoleucine or valine' 0 C--O 1.241 0.617 0 CA-C-N 118.173 0.442 . . . . 0.0 110.195 -173.16 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.1 tptt -143.77 113.84 7.3 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 178.003 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.576 HG12 ' HB3' ' A' ' 7' ' ' ALA . 38.1 mt -117.78 111.7 35.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 122.727 0.411 . . . . 0.0 111.488 -175.433 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -75.53 140.48 42.78 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.648 0.779 . . . . 0.0 109.193 169.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.401 HG22 ' HB2' ' A' ' 9' ' ' CYS . 19.8 p -123.38 121.94 37.05 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 123.642 0.777 . . . . 0.0 108.945 -179.494 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.515 HE22 ' HB2' ' A' ' 70' ' ' GLU . 41.1 mt-30 -116.18 151.96 34.66 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.396 0.679 . . . . 0.0 110.365 -178.565 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 179.74 178.33 48.39 Favored Glycine 0 C--N 1.336 0.547 0 CA-C-N 116.106 -0.497 . . . . 0.0 112.897 177.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.47 -25.87 68.46 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.53 0.732 . . . . 0.0 111.067 176.373 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -70.89 -36.08 72.59 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.821 0.848 . . . . 0.0 110.838 175.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 150.21 -162.47 29.24 Favored Glycine 0 C--N 1.349 1.26 0 CA-C-N 116.109 -0.496 . . . . 0.0 112.604 179.489 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 68.4 mt -120.87 136.86 56.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 124.009 0.924 . . . . 0.0 109.299 174.641 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -134.94 148.33 50.01 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.075 0.95 . . . . 0.0 109.244 -177.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 9.5 t30 61.92 42.75 9.9 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.501 1.12 . . . . 0.0 110.526 175.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -45.69 128.73 8.75 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 125.794 1.638 . . . . 0.0 113.686 -175.618 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 44.1 mt -80.47 136.86 36.4 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.583 1.153 . . . . 0.0 110.778 172.51 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 64.7 p -100.75 172.38 7.11 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.805 0.842 . . . . 0.0 110.375 179.811 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.75 -35.11 72.21 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.017 0.527 . . . . 0.0 111.201 174.403 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -58.94 -51.73 68.81 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.841 0.857 . . . . 0.0 111.112 175.115 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.437 ' O ' ' HB2' ' A' ' 58' ' ' ALA . 75.8 m-20 -59.9 -41.54 91.88 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.237 -175.499 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.441 HG22 ' HG3' ' A' ' 78' ' ' ARG . 50.6 mt -73.58 -42.96 55.52 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.243 0 C-N-CA 123.409 0.683 . . . . 0.0 111.676 -177.856 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.4 -39.4 71.18 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.215 0.606 . . . . 0.0 111.88 -173.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -93.02 -1.56 56.5 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.18 0.592 . . . . 0.0 111.549 -177.797 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.437 ' HB2' ' O ' ' A' ' 54' ' ' ASP . . . -64.45 110.11 2.17 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.056 0.542 . . . . 0.0 111.486 177.587 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 26.4 m -60.75 -37.77 82.91 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.083 0.953 . . . . 0.0 109.76 168.843 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.414 HD12 HD12 ' A' ' 5' ' ' LEU . 59.3 mt -134.47 144.65 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 C-N-CA 123.323 0.649 . . . . 0.0 110.857 177.208 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 21.6 mt -131.37 131.42 63.14 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 C-N-CA 124.07 0.948 . . . . 0.0 109.043 169.168 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -120.1 123.44 70.72 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 174.531 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' HIS . . . . . 0.534 ' HB2' ' HG3' ' A' ' 82' ' ' GLU . 18.1 m170 -97.62 84.06 3.33 Favored 'General case' 0 N--CA 1.488 1.457 0 CA-C-N 119.153 0.888 . . . . 0.0 109.736 170.75 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.545 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 28.4 m -79.25 82.83 5.36 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 114.649 -1.159 . . . . 0.0 109.535 175.15 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 32.1 m -127.43 158.1 38.87 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-O 121.379 0.609 . . . . 0.0 111.892 -170.395 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -103.86 -29.33 11.05 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.351 1.061 . . . . 0.0 109.037 174.749 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 13.6 m -131.62 169.11 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 125.066 1.346 . . . . 0.0 108.697 176.559 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 31.9 m -61.34 119.7 48.62 Favored Pre-proline 0 CA--C 1.551 1.014 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 174.469 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -68.23 151.53 76.65 Favored 'Trans proline' 0 C--N 1.373 1.829 0 C-N-CA 122.342 2.028 . . . . 0.0 110.643 173.872 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.515 ' HB2' HE22 ' A' ' 41' ' ' GLN . 10.2 mm-40 -63.46 -42.87 98.63 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-O 121.734 0.778 . . . . 0.0 109.84 -176.7 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -91.01 21.97 3.94 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 114.809 -1.087 . . . . 0.0 112.402 -173.528 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.413 ' HA ' ' HE1' ' A' ' 63' ' ' HIS . 7.1 p30 -56.01 -33.22 64.67 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.037 0.935 . . . . 0.0 112.613 -177.166 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.96 -18.32 50.7 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.944 0.898 . . . . 0.0 112.64 -174.836 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 3.7 mtp85 -67.01 -28.99 68.7 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-O 121.419 0.628 . . . . 0.0 110.705 176.422 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 47.1 m-85 -97.99 -5.51 33.95 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.235 1.014 . . . . 0.0 111.488 -174.928 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -60.12 -33.68 72.47 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.937 0.895 . . . . 0.0 111.898 -175.85 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 34.5 p -70.96 -13.37 61.99 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.82 0.848 . . . . 0.0 112.621 179.685 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.441 ' HG3' HG22 ' A' ' 55' ' ' ILE . 31.5 mmt180 -117.61 177.99 4.55 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 124.074 0.95 . . . . 0.0 111.185 -174.392 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -89.16 100.95 13.63 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.918 0.887 . . . . 0.0 110.402 -177.677 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 38.4 t -106.97 149.78 10.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.054 -179.51 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -125.09 90.75 3.29 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 124.133 0.973 . . . . 0.0 108.46 178.082 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.534 ' HG3' ' HB2' ' A' ' 63' ' ' HIS . 1.8 mp0 -78.0 131.88 37.57 Favored 'General case' 0 C--N 1.355 0.847 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.651 -178.131 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.522 HD12 ' HB3' ' A' ' 87' ' ' ASP . 37.3 pt -141.45 -172.5 0.59 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.765 0 C-N-CA 125.58 1.552 . . . . 0.0 107.786 179.315 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 32.0 p -83.03 152.54 25.35 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 121.129 0.49 . . . . 0.0 110.077 168.702 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.817 HD13 ' SG ' ' A' ' 11' ' ' CYS . 6.7 tt -65.91 -29.37 69.78 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.192 177.281 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.435 ' O ' ' HG2' ' A' ' 90' ' ' LYS . 29.7 tt0 -64.79 -39.45 93.62 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.049 0.54 . . . . 0.0 110.581 174.965 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.522 ' HB3' HD12 ' A' ' 83' ' ' ILE . 7.5 t70 -59.47 -32.85 70.63 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 124.106 0.962 . . . . 0.0 110.797 178.729 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.413 ' HB2' ' HB3' ' A' ' 64' ' ' SER . . . -66.03 -39.36 90.14 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.417 0.687 . . . . 0.0 112.106 177.194 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 75.3 mt -70.7 -43.07 77.73 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.84 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.724 -177.776 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.435 ' HG2' ' O ' ' A' ' 86' ' ' GLN . 0.2 OUTLIER -91.68 -44.21 9.15 Favored 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -173.169 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -106.52 22.8 15.24 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.845 0.858 . . . . 0.0 110.829 -169.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.548 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -42.3 -60.93 1.31 Allowed 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 124.071 0.948 . . . . 0.0 112.991 -175.81 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.63 -38.32 84.38 Favored 'General case' 0 C--N 1.348 0.506 0 CA-C-N 115.201 -0.909 . . . . 0.0 111.005 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -61.84 -50.2 68.29 Favored Glycine 0 C--N 1.353 1.482 0 O-C-N 124.415 1.072 . . . . 0.0 112.803 -177.354 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 17.2 mt -54.4 -58.01 4.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 124.228 1.011 . . . . 0.0 110.415 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.468 ' O ' ' HG3' ' A' ' 100' ' ' GLU . 2.1 mp -57.36 -54.68 27.61 Favored 'Isoleucine or valine' 0 C--N 1.36 1.028 0 O-C-N 124.391 1.057 . . . . 0.0 110.81 -175.813 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.28 -29.86 70.72 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -175.203 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -67.41 -39.0 85.49 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.402 0.681 . . . . 0.0 110.355 177.514 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 28.1 mt -75.71 -35.96 32.38 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.468 ' HG3' ' O ' ' A' ' 96' ' ' ILE . 28.4 mt-10 -60.31 -46.3 90.38 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.867 178.327 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -72.31 -31.02 65.33 Favored 'General case' 0 N--CA 1.48 1.03 0 O-C-N 123.594 0.559 . . . . 0.0 111.299 -177.039 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 71.0 mtm -64.4 -48.17 76.42 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-O 120.786 0.327 . . . . 0.0 110.584 173.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 63.9 mt -63.5 -46.17 95.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.038 176.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.24 -20.28 64.8 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.22 0.608 . . . . 0.0 111.627 -177.277 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 38.2 t -76.73 -41.33 45.49 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 122.65 0.38 . . . . 0.0 110.2 177.588 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -81.83 -21.59 37.53 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 122.925 0.49 . . . . 0.0 112.267 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 22.9 mm-40 -81.67 -47.66 12.7 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.311 0.644 . . . . 0.0 110.013 176.192 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 71.6 mm-40 . . . . . 0 C--O 1.251 1.16 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.988 -174.92 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.48 1.057 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.6 m -66.04 119.32 11.17 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 123.77 0.828 . . . . 0.0 111.482 -174.668 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 41.9 pttt -98.34 178.73 4.95 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.213 1.005 . . . . 0.0 111.298 -176.588 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.598 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.1 tmtp? -147.52 135.13 20.93 Favored 'General case' 0 CA--C 1.557 1.212 0 CA-C-O 121.291 0.567 . . . . 0.0 109.625 -173.647 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.453 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 10.1 tt -128.56 138.72 52.37 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.551 1.14 . . . . 0.0 108.339 178.007 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.511 HD12 HD13 ' A' ' 50' ' ' LEU . 20.2 pt -128.78 167.8 23.33 Favored 'Isoleucine or valine' 0 C--O 1.241 0.641 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 172.163 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.633 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -154.55 169.14 24.53 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.156 177.317 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.404 ' HA ' ' O ' ' A' ' 39' ' ' GLU . 4.6 tt -140.23 116.45 10.55 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 177.649 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.533 ' HA ' ' O ' ' A' ' 64' ' ' SER . 77.9 m -106.18 115.08 29.6 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 177.347 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.421 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -129.65 116.77 19.33 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 122.819 0.448 . . . . 0.0 111.542 -175.652 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.702 ' SG ' HD13 ' A' ' 85' ' ' LEU . 1.7 m -124.84 143.14 42.89 Favored Pre-proline 0 N--CA 1.479 1.017 0 C-N-CA 124.495 1.118 . . . . 0.0 109.471 175.479 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -77.2 -7.08 16.99 Favored 'Trans proline' 0 C--N 1.375 1.947 0 C-N-CA 122.561 2.174 . . . . 0.0 112.486 -178.479 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 58.3 mtt -79.78 -49.19 12.37 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.353 1.061 . . . . 0.0 110.038 -178.579 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 162.03 -168.63 37.15 Favored Glycine 0 C--N 1.343 0.93 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.679 -178.038 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 60.4 mt -82.96 -17.72 42.53 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 113.364 0.876 . . . . 0.0 113.364 -176.395 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.28 -45.09 95.93 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-O 121.482 0.658 . . . . 0.0 111.205 -178.654 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.2 t-160 -65.55 -40.87 93.33 Favored 'General case' 0 C--O 1.247 0.939 0 CA-C-N 114.646 -1.161 . . . . 0.0 110.214 -179.127 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 52.6 p -72.18 -31.79 66.25 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 114.402 -1.272 . . . . 0.0 111.027 -176.483 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 15.6 m-30 -68.92 -31.95 71.22 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.127 0.571 . . . . 0.0 111.043 178.197 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 54.5 mtm -67.76 -40.92 84.03 Favored 'General case' 0 N--CA 1.486 1.341 0 O-C-N 123.378 0.424 . . . . 0.0 110.883 174.872 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.97 -37.84 84.98 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.933 174.846 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.51 -38.98 81.41 Favored 'General case' 0 C--O 1.217 -0.653 0 C-N-CA 123.923 0.889 . . . . 0.0 110.797 179.257 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -63.69 -43.35 96.9 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.685 0.794 . . . . 0.0 110.158 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.662 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -61.05 -58.32 8.89 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 114.727 -1.124 . . . . 0.0 111.601 179.531 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 95.8 mt -66.92 -30.9 71.17 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.143 0.577 . . . . 0.0 112.164 -176.293 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.507 ' O ' HG23 ' A' ' 30' ' ' VAL . 36.7 tt0 -62.01 -61.29 2.59 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.062 0.545 . . . . 0.0 109.751 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.548 ' O ' ' HG3' ' A' ' 31' ' ' GLU . 16.5 mm-40 -51.01 -51.94 47.91 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 124.71 1.256 . . . . 0.0 111.661 179.754 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -62.85 -40.18 96.65 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.775 0.83 . . . . 0.0 112.572 -174.841 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.17 -27.91 61.05 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 122.895 0.478 . . . . 0.0 112.202 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.507 HG23 ' O ' ' A' ' 26' ' ' GLU . 77.7 t -64.1 -44.69 97.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 175.563 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.548 ' HG3' ' O ' ' A' ' 27' ' ' GLU . 18.9 mt-10 -70.23 -32.37 70.21 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 114.755 -1.111 . . . . 0.0 110.4 -179.555 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.78 -17.89 61.54 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.688 0.795 . . . . 0.0 111.636 176.774 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.81 22.17 11.34 Favored Glycine 0 C--N 1.346 1.114 0 N-CA-C 115.157 0.823 . . . . 0.0 115.157 165.018 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.438 ' CE2' HD12 ' A' ' 60' ' ' ILE . 0.0 OUTLIER -104.04 173.09 6.45 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-N 118.189 0.995 . . . . 0.0 110.522 172.159 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.598 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 43.2 tt0 -83.2 123.65 29.77 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 106.83 -1.544 . . . . 0.0 106.83 157.745 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.453 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 9.5 p -109.12 135.78 46.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 122.931 0.492 . . . . 0.0 110.247 -174.945 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 47.9 tptt -145.46 116.21 7.72 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 179.124 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.633 HG12 ' HB3' ' A' ' 7' ' ' ALA . 42.5 mt -120.19 110.92 30.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 122.896 0.478 . . . . 0.0 111.846 -172.587 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.404 ' O ' ' HA ' ' A' ' 8' ' ' LEU . 39.6 tt0 -79.38 118.89 21.69 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.401 0.68 . . . . 0.0 109.819 175.619 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 34.8 p -96.78 133.11 41.77 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.035 177.315 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.454 ' HG2' HG12 ' A' ' 46' ' ' ILE . 42.6 mt-30 -126.88 141.3 51.85 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.098 0.959 . . . . 0.0 109.537 178.307 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -173.33 177.97 45.49 Favored Glycine 0 C--N 1.335 0.524 0 CA-C-N 116.769 -0.196 . . . . 0.0 113.031 179.525 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.18 -25.94 67.37 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.899 0.88 . . . . 0.0 111.885 178.04 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -75.18 -33.54 61.47 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.74 0.816 . . . . 0.0 111.298 178.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 156.39 -160.52 30.25 Favored Glycine 0 C--N 1.348 1.207 0 O-C-N 123.371 0.42 . . . . 0.0 112.481 179.64 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.458 HG21 ' NH1' ' A' ' 49' ' ' ARG . 73.1 mt -127.12 135.27 64.04 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.244 0 C-N-CA 123.82 0.848 . . . . 0.0 108.885 172.178 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -136.95 155.0 50.29 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.205 0.602 . . . . 0.0 110.474 -175.662 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 20.4 t30 60.93 36.76 18.7 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.704 1.202 . . . . 0.0 110.15 177.144 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.458 ' NH1' HG21 ' A' ' 46' ' ' ILE . 19.1 tpp180 -48.66 123.23 6.5 Favored 'General case' 0 C--N 1.361 1.106 0 C-N-CA 125.157 1.383 . . . . 0.0 112.103 -174.747 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.511 HD13 HD12 ' A' ' 6' ' ' ILE . 39.8 mt -70.32 140.37 52.23 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 114.786 -1.097 . . . . 0.0 110.544 173.316 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.455 ' O ' HG13 ' A' ' 55' ' ' ILE . 52.9 p -94.84 161.04 14.33 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 172.557 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.11 -25.21 66.82 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 122.449 0.3 . . . . 0.0 110.813 174.418 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -65.88 -45.61 81.42 Favored 'General case' 0 C--N 1.354 0.791 0 O-C-N 124.035 0.834 . . . . 0.0 110.485 173.481 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 -57.86 -44.55 86.65 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.181 0.592 . . . . 0.0 110.943 176.421 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.575 HD11 HH21 ' A' ' 74' ' ' ARG . 12.5 mt -71.91 -29.78 34.65 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 O-C-N 124.106 0.879 . . . . 0.0 110.738 -176.049 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.78 -46.24 46.78 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.345 0.658 . . . . 0.0 110.828 177.832 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -67.26 -27.67 67.4 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.855 0.862 . . . . 0.0 111.553 178.186 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -56.19 99.04 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.514 0 O-C-N 124.476 1.11 . . . . 0.0 112.255 -175.074 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 29.1 m -60.99 -37.94 84.26 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 114.553 -1.203 . . . . 0.0 109.237 168.708 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.438 HD12 ' CE2' ' A' ' 34' ' ' TYR . 83.9 mt -134.22 140.18 46.61 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 C-N-CA 123.854 0.862 . . . . 0.0 110.262 179.805 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.43 HG23 HG13 ' A' ' 6' ' ' ILE . 24.9 mt -129.02 137.18 57.86 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 175.512 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.8 mp -128.4 113.09 28.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 CA-C-N 118.567 0.621 . . . . 0.0 110.104 175.362 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 6.1 m170 -88.24 86.08 7.02 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 121.388 0.614 . . . . 0.0 109.781 173.845 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.533 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 19.0 m -78.71 79.48 5.13 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 114.67 -1.15 . . . . 0.0 109.52 175.824 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.416 ' O ' ' HA ' ' A' ' 84' ' ' THR . 35.9 m -124.98 157.07 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 CA-C-O 121.869 0.842 . . . . 0.0 111.858 -170.265 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -112.59 -16.42 12.84 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 114.318 -1.31 . . . . 0.0 109.053 173.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 19.2 m -130.4 168.55 23.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 125.604 1.561 . . . . 0.0 109.234 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 64.9 m -78.61 112.95 30.53 Favored Pre-proline 0 CA--C 1.546 0.824 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 170.327 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.433 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 37.6 Cg_endo -63.76 150.26 88.86 Favored 'Trans proline' 0 C--N 1.376 2.009 0 C-N-CA 122.757 2.305 . . . . 0.0 112.367 -177.657 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -67.11 -23.98 65.88 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.176 0.59 . . . . 0.0 110.858 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -102.58 15.6 28.79 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.268 -0.878 . . . . 0.0 112.202 -177.825 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.433 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 25.6 t30 -53.35 -38.7 63.51 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.742 0.817 . . . . 0.0 111.777 179.482 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.55 -30.29 71.2 Favored 'General case' 0 N--CA 1.482 1.156 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 -176.595 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.575 HH21 HD11 ' A' ' 55' ' ' ILE . 43.5 mtp180 -62.55 -39.36 93.38 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-O 121.385 0.612 . . . . 0.0 111.842 174.555 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -97.37 -8.46 29.49 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.392 -175.76 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -64.63 -33.32 75.67 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.257 1.023 . . . . 0.0 111.115 -177.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 64.2 p -75.15 -17.13 60.46 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.656 0.782 . . . . 0.0 111.847 177.079 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.448 ' HG3' HG22 ' A' ' 55' ' ' ILE . 25.2 mmt180 -104.03 160.17 15.06 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.092 0.957 . . . . 0.0 111.091 -170.922 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -77.01 101.41 6.01 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.137 0.575 . . . . 0.0 110.145 174.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 80.9 t -111.9 138.7 39.65 Favored 'Isoleucine or valine' 0 C--O 1.238 0.493 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.395 -179.405 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -98.98 89.46 4.29 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 172.663 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -82.3 128.09 33.87 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.221 -176.363 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.529 HD12 ' HB3' ' A' ' 87' ' ' ASP . 47.2 pt -133.13 -171.78 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 C-N-CA 124.674 1.19 . . . . 0.0 108.953 178.773 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.416 ' HA ' ' O ' ' A' ' 65' ' ' VAL . 18.0 p -86.55 151.43 23.48 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 122.638 0.375 . . . . 0.0 110.262 168.554 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.702 HD13 ' SG ' ' A' ' 11' ' ' CYS . 6.4 tt -63.59 -30.76 71.83 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.59 178.617 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.466 ' HG2' ' HE2' ' A' ' 90' ' ' LYS . 9.4 tt0 -63.44 -41.61 98.67 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.49 175.531 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.529 ' HB3' HD12 ' A' ' 83' ' ' ILE . 8.8 t70 -61.53 -31.43 71.45 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.713 0.805 . . . . 0.0 111.097 -178.874 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.2 -45.43 88.34 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.262 0.625 . . . . 0.0 111.259 175.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 74.1 mt -67.05 -43.09 89.12 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.959 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.936 -176.842 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.466 ' HE2' ' HG2' ' A' ' 86' ' ' GLN . 0.2 OUTLIER -86.55 -38.25 17.36 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -174.981 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -119.62 30.89 6.83 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 122.943 0.497 . . . . 0.0 110.856 -166.277 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.662 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -45.68 -61.22 1.8 Allowed 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 123.817 0.847 . . . . 0.0 113.015 -176.352 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -58.03 -46.36 85.45 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.464 175.199 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.44 ' O ' ' HG2' ' A' ' 98' ' ' GLU . . . -54.97 -45.27 81.83 Favored Glycine 0 C--N 1.356 1.639 0 O-C-N 124.662 1.226 . . . . 0.0 113.931 -174.942 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 14.1 mt -62.61 -57.42 12.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 123.813 0.845 . . . . 0.0 109.378 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 96.5 mt -59.95 -44.85 95.43 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 CA-C-N 114.031 -1.44 . . . . 0.0 111.415 -172.759 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.69 -31.56 71.61 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.058 0.543 . . . . 0.0 111.936 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' A' ' 94' ' ' GLY . 51.4 mm-40 -63.85 -36.78 85.03 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 123.471 0.482 . . . . 0.0 110.2 176.138 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 16.0 mt -81.07 -32.39 12.42 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 -178.552 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -57.63 -50.89 71.65 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.448 1.099 . . . . 0.0 111.151 173.466 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -72.71 -35.09 67.52 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 123.647 0.592 . . . . 0.0 111.028 -176.83 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 64.4 mtm -63.47 -46.0 88.2 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 122.544 0.338 . . . . 0.0 110.43 177.549 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.426 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 19.7 mt -67.17 -40.85 86.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 O-C-N 123.631 0.582 . . . . 0.0 110.199 177.048 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.91 -24.72 67.61 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 122.933 0.493 . . . . 0.0 111.785 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 22.3 t -91.11 -33.43 15.46 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.087 0.555 . . . . 0.0 110.784 -176.111 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 0.426 ' HG2' ' HA ' ' A' ' 103' ' ' ILE . 13.2 pt-20 -81.42 -28.78 34.11 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 122.775 0.43 . . . . 0.0 110.876 -179.489 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 87.0 mm-40 -79.76 -36.46 37.17 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.031 0.533 . . . . 0.0 110.157 175.75 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 65.7 mm-40 . . . . . 0 CA--C 1.552 1.045 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 178.42 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.6 ttt . . . . . 0 N--CA 1.483 1.196 0 CA-C-O 120.686 0.279 . . . . 0.0 110.254 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.4 p -78.06 90.81 4.23 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 121.629 0.728 . . . . 0.0 109.535 178.188 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -89.72 -177.9 5.38 Favored 'General case' 0 C--O 1.252 1.209 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.423 -175.98 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.55 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.1 tmtp? -145.51 137.29 25.34 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 -178.783 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.413 ' N ' ' HD3' ' A' ' 4' ' ' LYS . 9.4 tt -122.88 135.2 54.43 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.651 1.18 . . . . 0.0 108.064 175.139 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.473 HG21 ' HB3' ' A' ' 54' ' ' ASP . 18.9 pt -125.92 160.96 32.08 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 170.283 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.615 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -149.68 164.47 35.13 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.934 176.681 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.5 tt -138.0 110.35 7.42 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 107.439 -1.319 . . . . 0.0 107.439 -177.335 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.525 ' HA ' ' O ' ' A' ' 64' ' ' SER . 60.2 m -99.18 107.5 19.86 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.065 0.946 . . . . 0.0 109.568 176.227 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -121.78 124.43 44.18 Favored 'General case' 0 N--CA 1.492 1.657 0 C-N-CA 122.566 0.346 . . . . 0.0 111.455 -177.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.792 ' SG ' HD13 ' A' ' 85' ' ' LEU . 36.9 m -127.76 146.27 58.17 Favored Pre-proline 0 N--CA 1.48 1.033 0 C-N-CA 123.847 0.859 . . . . 0.0 111.172 177.222 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -86.92 -13.78 4.49 Favored 'Trans proline' 0 C--N 1.369 1.629 0 C-N-CA 122.971 2.447 . . . . 0.0 111.984 168.825 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 23.0 mmt -79.54 -58.41 3.21 Favored 'General case' 0 C--N 1.355 0.813 0 C-N-CA 124.11 0.964 . . . . 0.0 110.298 -175.645 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -179.12 162.35 29.17 Favored Glycine 0 C--N 1.347 1.194 0 CA-C-N 115.564 -0.744 . . . . 0.0 112.77 -178.228 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 37.2 mt -70.81 -18.35 62.74 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.81 0.844 . . . . 0.0 111.714 178.768 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.42 -43.89 79.83 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-O 121.036 0.446 . . . . 0.0 110.903 174.375 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.461 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 3.9 t-160 -67.87 -41.7 82.45 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.234 -178.991 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.407 ' HA ' HD11 ' A' ' 85' ' ' LEU . 42.7 p -67.1 -36.33 81.72 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.429 -177.854 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.3 m-30 -72.45 -35.02 68.17 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.091 0.556 . . . . 0.0 111.394 -177.364 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 60.3 mtm -67.96 -35.82 79.03 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-O 120.592 0.234 . . . . 0.0 110.601 176.265 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -69.82 -41.56 74.82 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.386 0.674 . . . . 0.0 111.198 173.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.35 -39.76 89.38 Favored 'General case' 0 C--O 1.218 -0.571 0 C-N-CA 123.81 0.844 . . . . 0.0 110.899 -177.909 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -70.55 -41.49 72.41 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 123.624 0.578 . . . . 0.0 109.903 -179.369 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.554 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -62.89 -52.24 63.84 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.434 -178.919 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 82.9 mt -65.1 -33.42 75.98 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.319 0.647 . . . . 0.0 111.501 178.283 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.474 ' O ' HG23 ' A' ' 30' ' ' VAL . 40.1 tt0 -60.42 -58.39 8.72 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 123.973 0.796 . . . . 0.0 110.587 179.55 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.536 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 29.8 mm-40 -53.65 -48.38 69.45 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 124.387 1.055 . . . . 0.0 111.119 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -57.68 -46.6 84.06 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 124.043 0.839 . . . . 0.0 111.789 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.56 -28.56 67.06 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 123.721 0.808 . . . . 0.0 113.08 178.051 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 26' ' ' GLU . 42.9 t -70.2 -40.15 77.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.83 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.536 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 8.0 mm-40 -70.85 -24.59 62.55 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 114.635 -1.166 . . . . 0.0 111.297 178.816 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -77.77 -7.33 56.41 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.36 0.664 . . . . 0.0 111.964 177.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 83.69 24.69 49.0 Favored Glycine 0 C--N 1.351 1.389 0 N-CA-C 114.668 0.627 . . . . 0.0 114.668 165.666 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -128.96 178.76 6.16 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-N 117.328 0.564 . . . . 0.0 111.311 173.107 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.55 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 41.2 tt0 -78.5 140.36 38.59 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.325 178.746 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.43 HG21 ' HA ' ' A' ' 26' ' ' GLU . 13.9 p -120.33 143.63 31.61 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 122.88 0.472 . . . . 0.0 110.204 178.648 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 49.3 tptt -149.3 115.86 5.87 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 173.684 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.615 HG12 ' HB3' ' A' ' 7' ' ' ALA . 51.0 mt -121.03 114.57 43.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -176.832 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.431 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 34.7 tt0 -75.71 143.22 42.21 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.089 0.956 . . . . 0.0 109.167 171.763 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.492 HG22 ' HB2' ' A' ' 9' ' ' CYS . 1.9 p -127.93 103.54 7.31 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.087 0.555 . . . . 0.0 110.2 -179.132 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -94.56 137.56 33.53 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 122.852 0.461 . . . . 0.0 110.373 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -156.2 169.13 33.69 Favored Glycine 0 C--N 1.337 0.592 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.467 176.939 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.03 -29.36 69.67 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.545 0.738 . . . . 0.0 111.614 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -71.91 -39.35 69.58 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.036 0.935 . . . . 0.0 110.535 177.092 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 161.28 -177.55 37.57 Favored Glycine 0 C--N 1.345 1.066 0 CA-C-N 115.949 -0.569 . . . . 0.0 112.643 -178.334 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 73.6 mt -111.52 122.44 65.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 123.783 0.833 . . . . 0.0 110.08 179.175 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.441 ' HB3' ' OG1' ' A' ' 40' ' ' THR . 6.5 tp-100 -105.47 147.01 28.77 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.476 1.11 . . . . 0.0 110.688 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 17.8 t30 79.06 -51.92 0.44 Allowed 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 126.734 2.014 . . . . 0.0 111.582 172.455 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 21.6 tpp180 63.57 121.63 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.686 1.594 . . . . 0.0 113.549 173.088 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.431 ' HG ' ' HB2' ' A' ' 39' ' ' GLU . 45.1 mt -82.25 127.96 33.71 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.458 172.396 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.401 ' O ' HG13 ' A' ' 55' ' ' ILE . 43.8 p -90.2 160.74 16.06 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.039 176.475 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.24 -27.03 66.88 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 122.848 0.459 . . . . 0.0 111.481 177.088 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -69.29 -40.15 77.89 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.73 0.812 . . . . 0.0 111.113 175.16 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.473 ' HB3' HG21 ' A' ' 6' ' ' ILE . 53.7 m-20 -58.32 -47.75 82.72 Favored 'General case' 0 N--CA 1.483 1.212 0 O-C-N 123.35 0.406 . . . . 0.0 110.249 174.421 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.522 HG22 ' HG3' ' A' ' 78' ' ' ARG . 24.8 mt -68.47 -29.64 44.76 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.069 0 O-C-N 124.618 1.199 . . . . 0.0 111.024 -177.684 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.445 ' HA ' HH21 ' A' ' 78' ' ' ARG . . . -71.68 -49.05 43.2 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.68 0.792 . . . . 0.0 111.552 179.458 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -84.82 -12.54 53.37 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.421 0.688 . . . . 0.0 112.157 -175.938 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.9 99.0 0.11 Allowed 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.546 0.739 . . . . 0.0 111.834 -178.33 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 25.2 m -61.59 -34.86 76.35 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 124.268 1.027 . . . . 0.0 109.797 170.682 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.561 HG23 HG21 ' A' ' 99' ' ' ILE . 81.5 mt -130.45 138.14 54.51 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 C-N-CA 124.416 1.087 . . . . 0.0 109.61 179.55 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.401 HG23 HG13 ' A' ' 6' ' ' ILE . 34.8 mt -133.06 132.27 58.81 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.358 0 C-N-CA 123.721 0.809 . . . . 0.0 108.821 174.81 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -121.14 117.01 51.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 174.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 9.9 m170 -90.84 84.52 5.83 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-N 118.879 0.763 . . . . 0.0 108.972 170.01 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.525 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 20.7 p -83.22 81.83 8.53 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 114.674 -1.148 . . . . 0.0 108.763 176.905 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 34.8 m -128.57 158.31 40.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 CA-C-O 121.699 0.762 . . . . 0.0 111.957 -168.661 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -111.71 -11.9 13.93 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.013 1.325 . . . . 0.0 109.363 172.898 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 11.5 m -135.47 151.73 30.59 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 125.397 1.479 . . . . 0.0 108.909 178.574 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 25.6 m -65.3 110.79 4.77 Favored Pre-proline 0 CA--C 1.55 0.976 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 173.087 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -62.66 153.3 72.91 Favored 'Trans proline' 0 C--N 1.379 2.137 0 C-N-CA 122.342 2.028 . . . . 0.0 112.912 -174.005 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -76.58 -25.4 53.93 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.444 0.698 . . . . 0.0 111.001 -177.236 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -96.02 10.43 37.48 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.813 0.845 . . . . 0.0 111.252 179.127 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.5 -32.95 69.29 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 124.074 0.95 . . . . 0.0 111.354 -174.984 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.421 ' HA ' ' HB2' ' A' ' 76' ' ' GLU . 0.4 OUTLIER -65.66 -24.87 67.12 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.154 0.581 . . . . 0.0 112.359 178.777 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 77.3 mtt180 -70.5 -23.37 62.65 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.254 0.622 . . . . 0.0 111.646 173.194 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.416 ' HB3' HG21 ' A' ' 80' ' ' VAL . 56.8 m-85 -105.37 2.43 28.77 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.148 0.979 . . . . 0.0 111.301 -179.501 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.421 ' HB2' ' HA ' ' A' ' 73' ' ' GLU . 29.2 tt0 -61.61 -50.39 72.77 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.876 0.87 . . . . 0.0 111.909 -172.446 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 69.7 p -82.71 0.26 44.22 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.054 0.541 . . . . 0.0 111.841 -178.651 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.522 ' HG3' HG22 ' A' ' 55' ' ' ILE . 15.8 mmt180 -102.4 149.32 24.48 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.634 0.774 . . . . 0.0 110.71 176.343 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -79.37 92.28 5.17 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.712 0.805 . . . . 0.0 110.624 -178.54 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.416 HG21 ' HB3' ' A' ' 75' ' ' PHE . 45.1 t -98.49 144.79 10.98 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.788 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.096 -179.728 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 -102.45 92.2 4.58 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.82 1.248 . . . . 0.0 107.858 174.61 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -83.16 121.62 27.31 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.579 0.752 . . . . 0.0 110.708 -175.306 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.498 HG13 ' HA ' ' A' ' 64' ' ' SER . 43.9 pt -130.55 -177.59 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 124.675 1.19 . . . . 0.0 109.25 177.391 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 18.5 p -83.79 149.28 26.53 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 167.479 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.792 HD13 ' SG ' ' A' ' 11' ' ' CYS . 7.7 tt -63.09 -29.22 70.63 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.358 0.663 . . . . 0.0 111.816 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.555 ' HG2' ' HE3' ' A' ' 90' ' ' LYS . 29.4 tt0 -60.22 -41.78 93.79 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.445 0.698 . . . . 0.0 110.755 175.072 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.459 ' HB3' HD12 ' A' ' 83' ' ' ILE . 24.1 t70 -63.18 -32.46 73.86 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.674 0.79 . . . . 0.0 110.728 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.403 ' HB2' ' HB2' ' A' ' 64' ' ' SER . . . -63.74 -29.9 71.06 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.749 0.82 . . . . 0.0 112.697 179.132 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 65.8 mt -83.54 -54.0 10.08 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 C-N-CA 123.603 0.761 . . . . 0.0 110.062 -178.468 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.555 ' HE3' ' HG2' ' A' ' 86' ' ' GLN . 18.5 ptpt -72.8 -45.4 58.68 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.117 0.567 . . . . 0.0 112.33 -175.256 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -108.61 24.07 13.6 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.185 0.994 . . . . 0.0 110.594 -169.913 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.554 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -41.73 -62.2 0.94 Allowed 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.286 1.034 . . . . 0.0 113.672 -175.935 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.35 -36.29 83.2 Favored 'General case' 0 C--N 1.34 0.179 0 CA-C-N 114.922 -1.036 . . . . 0.0 110.806 179.862 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -61.07 -48.06 88.0 Favored Glycine 0 C--N 1.354 1.546 0 O-C-N 124.703 1.252 . . . . 0.0 112.526 -178.3 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 35.9 mt -56.99 -57.89 8.03 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 C-N-CA 124.597 1.159 . . . . 0.0 110.31 -179.693 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.9 mp -56.31 -51.65 61.15 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.912 0 O-C-N 124.257 0.973 . . . . 0.0 111.296 -177.309 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.31 -31.16 72.15 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 -176.758 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -67.19 -36.96 82.84 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 122.877 0.471 . . . . 0.0 110.217 177.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.561 HG21 HG23 ' A' ' 60' ' ' ILE . 56.4 mt -76.47 -37.49 30.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -177.847 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -57.55 -52.66 64.51 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 114.191 -1.368 . . . . 0.0 111.257 176.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -69.96 -33.51 72.19 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 123.632 0.582 . . . . 0.0 111.534 -177.794 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 67.7 mtm -65.0 -56.9 10.44 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 122.386 0.274 . . . . 0.0 110.817 178.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 48.2 mt -64.35 -39.72 86.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 O-C-N 123.677 0.61 . . . . 0.0 111.037 -179.231 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.43 ' HA ' ' HG2' ' A' ' 107' ' ' GLN . . . -67.55 -37.4 82.64 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.659 0.384 . . . . 0.0 111.433 179.729 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 33.9 t -68.48 -39.1 81.49 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 122.351 0.26 . . . . 0.0 110.848 -175.365 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -79.98 -29.67 39.57 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 116.106 -0.497 . . . . 0.0 112.173 -178.41 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.43 ' HG2' ' HA ' ' A' ' 104' ' ' ALA . 12.0 pt20 -85.08 -28.78 25.39 Favored 'General case' 0 N--CA 1.487 1.418 0 CA-C-N 117.991 0.359 . . . . 0.0 111.203 -178.78 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 . . . . . 0 C--O 1.249 1.034 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 179.037 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mpt? . . . . . 0 N--CA 1.479 1.009 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.9 t -84.28 126.35 33.1 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 171.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.8 pttm -73.36 161.98 29.85 Favored 'General case' 0 C--O 1.242 0.693 0 C-N-CA 123.187 0.595 . . . . 0.0 110.617 178.7 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.604 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.4 tmtp? -144.37 140.24 28.94 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 -169.736 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.515 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.9 tt -132.26 136.68 47.13 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 178.431 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.511 HD12 HD13 ' A' ' 50' ' ' LEU . 15.8 pt -128.15 161.14 37.1 Favored 'Isoleucine or valine' 0 C--O 1.244 0.769 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 173.715 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.592 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -147.21 168.16 22.39 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.99 177.854 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.0 tt -142.07 113.62 7.8 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 -178.592 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.52 ' HA ' ' O ' ' A' ' 64' ' ' SER . 56.0 m -103.28 111.42 23.81 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.696 0.798 . . . . 0.0 108.851 177.16 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.451 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -123.31 127.29 48.33 Favored 'General case' 0 N--CA 1.497 1.919 0 C-N-CA 122.521 0.328 . . . . 0.0 111.44 -177.663 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.798 ' SG ' HD13 ' A' ' 85' ' ' LEU . 56.0 m -130.79 145.45 57.74 Favored Pre-proline 0 N--CA 1.481 1.087 0 C-N-CA 123.866 0.866 . . . . 0.0 111.768 -178.915 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -79.37 -28.16 3.82 Favored 'Trans proline' 0 C--N 1.375 1.929 0 C-N-CA 122.866 2.377 . . . . 0.0 111.466 167.513 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 12.2 tpt -69.74 -50.77 40.27 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.012 0.925 . . . . 0.0 110.744 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 155.68 -176.79 33.11 Favored Glycine 0 C--N 1.345 1.053 0 N-CA-C 114.178 0.431 . . . . 0.0 114.178 175.605 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 71.0 mt -73.62 -20.18 60.66 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.974 0.909 . . . . 0.0 113.393 -172.632 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.82 -42.66 89.74 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-N 118.574 0.625 . . . . 0.0 110.619 176.693 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.479 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 7.2 t-160 -67.1 -43.27 82.93 Favored 'General case' 0 C--O 1.246 0.919 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.866 178.28 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 34.7 p -65.8 -31.26 72.13 Favored 'General case' 0 C--N 1.353 0.76 0 CA-C-N 115.509 -0.769 . . . . 0.0 111.558 -177.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -74.15 -33.42 63.5 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 119.028 -0.51 . . . . 0.0 111.192 -178.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 64.6 mtm -65.05 -35.82 82.37 Favored 'General case' 0 N--CA 1.492 1.66 0 CA-C-O 120.961 0.41 . . . . 0.0 110.87 173.275 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.48 -48.67 54.66 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.999 177.441 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.68 -36.13 82.82 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 124.32 1.048 . . . . 0.0 110.946 -177.301 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -71.04 -41.11 71.24 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 -176.533 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -72.97 -38.95 66.5 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.919 -178.166 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 76.5 mt -71.68 -33.41 68.81 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.079 0.552 . . . . 0.0 110.784 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.447 ' O ' HG23 ' A' ' 30' ' ' VAL . 37.4 tt0 -61.29 -55.86 27.11 Favored 'General case' 0 C--N 1.35 0.599 0 O-C-N 124.019 0.824 . . . . 0.0 109.209 177.721 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.434 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 44.8 mt-10 -56.22 -48.25 76.82 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 124.36 1.037 . . . . 0.0 110.717 -178.414 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.47 -47.46 79.15 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.119 0.968 . . . . 0.0 111.548 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.03 -22.18 62.18 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.186 0.994 . . . . 0.0 113.537 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 26' ' ' GLU . 37.6 t -79.93 -41.55 21.55 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 -179.425 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 6.9 mm-40 -72.21 -21.72 61.37 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 114.465 -1.243 . . . . 0.0 110.102 175.422 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.437 ' HB1' ' HE1' ' A' ' 34' ' ' TYR . . . -75.61 -31.25 59.83 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 114.726 -1.125 . . . . 0.0 111.436 173.679 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 98.77 22.79 12.93 Favored Glycine 0 C--N 1.344 1.019 0 CA-C-N 115.833 -0.621 . . . . 0.0 114.095 171.751 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.437 ' HE1' ' HB1' ' A' ' 32' ' ' ALA . 2.5 m-85 -99.75 163.51 12.44 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 171.946 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.604 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 35.1 tt0 -74.33 130.42 39.65 Favored 'General case' 0 C--O 1.217 -0.646 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 159.636 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.515 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 9.3 p -119.28 134.46 62.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 CA-C-N 119.133 0.879 . . . . 0.0 110.9 -173.648 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 45.2 tptt -141.0 120.45 13.16 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.509 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.592 HG12 ' HB3' ' A' ' 7' ' ' ALA . 43.1 mt -122.28 122.94 67.64 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 C-N-CA 122.712 0.405 . . . . 0.0 112.08 -175.325 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 76.9 tt0 -88.53 116.0 26.46 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.493 1.117 . . . . 0.0 109.904 175.256 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.511 HG22 ' HB2' ' A' ' 9' ' ' CYS . 24.3 p -100.85 104.96 16.2 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 122.521 0.328 . . . . 0.0 110.366 177.735 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.451 ' O ' ' HA ' ' A' ' 10' ' ' ALA . 13.9 mt-30 -96.66 144.0 27.1 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.237 0.615 . . . . 0.0 109.45 175.802 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -167.98 177.47 42.19 Favored Glycine 0 C--N 1.335 0.49 0 C-N-CA 121.716 -0.278 . . . . 0.0 112.568 179.419 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.79 -29.27 69.34 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.535 0.734 . . . . 0.0 111.958 179.534 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -67.53 -42.32 82.93 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.407 0.683 . . . . 0.0 110.205 174.037 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 153.77 -173.01 32.51 Favored Glycine 0 C--N 1.341 0.811 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.93 -176.762 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 72.6 mt -101.59 135.57 37.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 176.399 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.416 ' HB3' ' OG1' ' A' ' 40' ' ' THR . 9.1 tp-100 -132.16 144.78 50.91 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.386 0.674 . . . . 0.0 110.383 -172.786 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 42.2 t30 74.39 -64.87 0.37 Allowed 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 126.43 1.892 . . . . 0.0 108.855 -177.618 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 22.6 ttt-85 63.73 129.19 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 127.048 2.139 . . . . 0.0 113.947 172.52 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.511 HD13 HD12 ' A' ' 6' ' ' ILE . 26.9 mt -77.76 148.63 34.74 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 113.837 -1.529 . . . . 0.0 110.272 175.884 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 58.5 p -113.72 170.14 8.47 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.505 176.347 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -57.19 -33.41 67.46 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.382 0.673 . . . . 0.0 111.222 -179.211 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -61.17 -54.95 37.95 Favored 'General case' 0 C--N 1.35 0.608 0 O-C-N 124.256 0.972 . . . . 0.0 109.667 175.31 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 53.1 m-20 -54.56 -41.82 70.26 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 123.966 0.906 . . . . 0.0 112.239 -176.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.673 HD11 HH21 ' A' ' 74' ' ' ARG . 40.4 mt -71.11 -33.47 51.39 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 O-C-N 123.874 0.734 . . . . 0.0 110.604 -176.39 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.23 -39.63 65.34 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.475 0.71 . . . . 0.0 111.299 176.203 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -69.25 -32.28 71.37 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.881 0.872 . . . . 0.0 110.95 179.425 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -56.57 101.88 0.07 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.884 1.274 . . . . 0.0 113.216 -172.527 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 27.4 m -61.11 -39.59 90.55 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.759 0.824 . . . . 0.0 109.12 165.302 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.52 HG23 HG21 ' A' ' 99' ' ' ILE . 53.0 mt -127.22 144.37 37.51 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 C-N-CA 123.746 0.818 . . . . 0.0 110.581 179.149 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 28.1 mt -134.42 120.28 32.75 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 C-N-CA 124.014 0.926 . . . . 0.0 108.839 172.689 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.6 mp -109.46 119.77 59.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 175.167 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' HIS . . . . . 0.438 ' HB2' ' HG3' ' A' ' 82' ' ' GLU . 12.6 m170 -92.44 83.92 5.05 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-O 121.747 0.784 . . . . 0.0 108.944 168.61 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.52 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 24.8 p -80.45 83.58 6.24 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 114.236 -1.347 . . . . 0.0 109.072 175.551 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 33.7 m -128.29 156.58 40.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 CA-C-O 121.872 0.844 . . . . 0.0 112.29 -169.126 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -109.3 -21.44 12.54 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 113.633 -1.622 . . . . 0.0 109.002 173.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 6.2 m -137.13 148.48 26.29 Favored 'Isoleucine or valine' 0 C--N 1.35 0.613 0 C-N-CA 125.519 1.528 . . . . 0.0 108.015 175.509 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 67.6 m -59.27 116.18 15.1 Favored Pre-proline 0 CA--C 1.548 0.899 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 176.075 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.407 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 39.9 Cg_endo -64.29 151.46 85.32 Favored 'Trans proline' 0 C--N 1.381 2.241 0 C-N-CA 122.86 2.373 . . . . 0.0 111.475 -176.514 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -64.62 -36.72 85.15 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-O 121.619 0.723 . . . . 0.0 110.408 -178.34 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.509 ' HB3' ' HD3' ' A' ' 74' ' ' ARG . 2.2 m-20 -91.49 13.21 18.33 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.486 1.115 . . . . 0.0 111.919 -173.764 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.407 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 4.8 p30 -56.15 -30.3 61.98 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 124.372 1.069 . . . . 0.0 112.154 -177.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -61.08 -33.61 73.62 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.67 1.188 . . . . 0.0 112.457 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.673 HH21 HD11 ' A' ' 55' ' ' ILE . 27.3 mtp180 -65.11 -29.34 70.2 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.436 1.094 . . . . 0.0 112.007 177.918 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -100.24 -11.74 20.12 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 114.913 -1.04 . . . . 0.0 111.84 -175.213 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -56.86 -35.27 68.68 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.373 1.069 . . . . 0.0 111.92 -177.365 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 34.7 t -73.53 -19.01 61.02 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.852 0.861 . . . . 0.0 112.507 -178.608 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.59 ' HG3' HG22 ' A' ' 55' ' ' ILE . 32.3 mmt180 -111.44 173.59 6.27 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.531 0.733 . . . . 0.0 111.781 -171.209 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -84.33 97.68 9.59 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.758 0.823 . . . . 0.0 110.387 -177.289 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 39.3 t -105.87 153.14 7.39 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 CA-C-N 114.966 -1.016 . . . . 0.0 110.255 -179.421 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 -124.36 91.39 3.44 Favored 'General case' 0 C--O 1.243 0.72 0 C-N-CA 124.815 1.246 . . . . 0.0 107.895 179.197 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.438 ' HG3' ' HB2' ' A' ' 63' ' ' HIS . 2.2 mp0 -77.08 126.86 31.65 Favored 'General case' 0 C--N 1.353 0.746 0 C-N-CA 122.916 0.486 . . . . 0.0 110.714 -177.613 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.454 HG13 ' HA ' ' A' ' 64' ' ' SER . 43.4 pt -136.46 -178.58 2.43 Favored 'Isoleucine or valine' 0 C--O 1.246 0.911 0 C-N-CA 125.327 1.451 . . . . 0.0 108.317 177.861 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 23.5 p -83.39 147.44 27.89 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.102 0.477 . . . . 0.0 109.825 169.118 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.798 HD13 ' SG ' ' A' ' 11' ' ' CYS . 8.1 tt -65.85 -28.29 68.86 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.929 179.404 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.434 ' O ' ' HG2' ' A' ' 90' ' ' LYS . 28.6 tt0 -62.6 -44.96 95.01 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.555 0.742 . . . . 0.0 110.428 174.107 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -60.82 -30.95 70.4 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.758 0.823 . . . . 0.0 110.609 179.253 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.7 -21.57 63.48 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.956 0.902 . . . . 0.0 113.318 178.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 65.5 mt -89.27 -41.82 14.1 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 C-N-CA 123.622 0.769 . . . . 0.0 110.36 -179.163 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.434 ' HG2' ' O ' ' A' ' 86' ' ' GLN . 16.2 ptpt -92.68 -47.44 7.09 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.016 0.526 . . . . 0.0 112.172 -174.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -99.48 18.55 17.58 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 123.746 0.818 . . . . 0.0 111.477 -173.296 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.498 ' HA ' HD12 ' A' ' 95' ' ' ILE . . . -45.66 -57.98 3.8 Favored 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 124.158 0.983 . . . . 0.0 113.527 -171.522 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.48 -38.77 81.68 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.39 0.676 . . . . 0.0 111.014 179.041 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -61.77 -46.48 94.09 Favored Glycine 0 C--N 1.352 1.454 0 O-C-N 124.462 1.101 . . . . 0.0 112.696 -179.511 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.498 HD12 ' HA ' ' A' ' 92' ' ' ALA . 16.8 mt -57.72 -57.95 8.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 124.137 0.975 . . . . 0.0 110.22 -179.752 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.476 ' O ' ' HG3' ' A' ' 100' ' ' GLU . 2.2 mp -57.52 -51.98 62.9 Favored 'Isoleucine or valine' 0 C--N 1.357 0.926 0 O-C-N 124.131 0.894 . . . . 0.0 110.647 -176.51 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -32.14 71.98 Favored 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -175.412 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -65.01 -37.52 87.93 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 123.806 0.691 . . . . 0.0 110.137 176.71 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.52 HG21 HG23 ' A' ' 60' ' ' ILE . 25.8 mt -79.93 -31.94 13.79 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.834 -178.995 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.476 ' HG3' ' O ' ' A' ' 96' ' ' ILE . 36.2 mt-10 -59.71 -50.59 73.26 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.396 0.678 . . . . 0.0 110.621 177.319 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -68.99 -36.99 78.47 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 123.835 0.71 . . . . 0.0 111.083 -177.225 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 71.4 mtm -60.43 -54.04 50.34 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 122.421 0.289 . . . . 0.0 110.323 176.527 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.5 HD12 HG12 ' A' ' 60' ' ' ILE . 39.7 mt -67.3 -35.71 74.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 123.288 0.635 . . . . 0.0 111.523 -178.358 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.73 -36.72 83.12 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.041 0.537 . . . . 0.0 110.47 178.85 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 70.0 m -79.49 -27.08 41.5 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 122.918 0.487 . . . . 0.0 111.383 -174.05 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -85.79 -33.44 21.38 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 122.377 0.271 . . . . 0.0 111.639 177.181 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -80.47 -30.16 37.44 Favored 'General case' 0 N--CA 1.487 1.416 0 CA-C-N 118.086 0.403 . . . . 0.0 111.186 -179.273 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 12.7 mm100 . . . . . 0 C--O 1.248 1.015 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 175.959 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.0 mtt . . . . . 0 N--CA 1.484 1.239 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.6 t -76.67 94.88 3.86 Favored 'General case' 0 C--N 1.348 0.522 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 171.398 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.405 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 3.3 pttt -102.3 178.92 4.46 Favored 'General case' 0 C--O 1.251 1.139 0 C-N-CA 123.985 0.914 . . . . 0.0 110.348 179.777 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.551 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.2 tmtp? -143.69 140.38 30.01 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.615 -0.721 . . . . 0.0 109.163 -175.71 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.479 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 8.8 tt -126.25 137.19 53.5 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 176.718 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.442 HD12 HD13 ' A' ' 50' ' ' LEU . 16.4 pt -128.88 161.75 37.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 172.447 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.609 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -147.63 168.06 22.99 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.111 0.481 . . . . 0.0 109.86 176.427 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.6 tt -138.65 114.34 9.86 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.515 ' HA ' ' O ' ' A' ' 64' ' ' SER . 80.5 m -106.4 107.65 18.77 Favored 'General case' 0 C--O 1.218 -0.583 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 177.957 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.424 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -125.97 122.95 37.39 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.025 0.53 . . . . 0.0 110.939 -177.346 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.821 ' SG ' HD13 ' A' ' 85' ' ' LEU . 2.9 m -140.42 146.78 46.8 Favored Pre-proline 0 N--CA 1.477 0.901 0 C-N-CA 123.682 0.793 . . . . 0.0 111.113 178.194 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -85.49 0.78 8.5 Favored 'Trans proline' 0 C--N 1.377 2.069 0 C-N-CA 123.596 2.864 . . . . 0.0 112.19 -179.469 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 27.0 mmt -88.38 -26.01 22.41 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.24 1.016 . . . . 0.0 110.644 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 135.93 177.04 14.69 Favored Glycine 0 C--N 1.344 0.992 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.809 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 47.0 mt -75.53 -13.88 60.38 Favored 'General case' 0 C--N 1.352 0.678 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -179.563 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.23 -46.49 89.57 Favored 'General case' 0 C--O 1.249 1.053 0 CA-C-O 121.168 0.509 . . . . 0.0 110.877 177.2 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.44 ' HD1' ' HG ' ' A' ' 11' ' ' CYS . 12.3 t-160 -65.38 -43.53 90.45 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.742 179.591 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.404 ' HA ' HD11 ' A' ' 85' ' ' LEU . 31.2 p -65.71 -36.0 82.36 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.471 -176.681 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.0 m-30 -70.41 -32.56 70.23 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.381 0.672 . . . . 0.0 111.342 -179.05 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' MET . . . . . 0.406 ' HB2' ' HE3' ' A' ' 20' ' ' MET . 65.2 mtm -67.15 -37.96 84.69 Favored 'General case' 0 N--CA 1.484 1.275 0 CA-C-O 120.888 0.375 . . . . 0.0 110.762 175.333 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.38 -39.32 81.77 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.989 173.58 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.06 -40.57 91.02 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.668 0.787 . . . . 0.0 110.662 -178.925 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -61.4 -51.36 69.06 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.604 0.762 . . . . 0.0 109.616 177.707 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.405 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -64.52 -48.44 75.09 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 114.765 -1.107 . . . . 0.0 112.502 -174.314 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 91.4 mt -66.12 -33.0 74.79 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.421 0.689 . . . . 0.0 111.69 179.433 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.502 ' HA ' HG21 ' A' ' 36' ' ' VAL . 32.4 tt0 -64.03 -52.21 60.52 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 123.584 0.552 . . . . 0.0 110.02 178.816 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -54.42 -48.63 71.42 Favored 'General case' 0 N--CA 1.481 1.079 0 O-C-N 124.213 0.945 . . . . 0.0 110.572 179.322 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.9 -47.37 86.03 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.603 1.161 . . . . 0.0 111.955 -178.035 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.42 -28.29 67.78 Favored 'General case' 0 N--CA 1.476 0.866 0 CA-C-N 115.068 -0.969 . . . . 0.0 112.842 178.833 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 26' ' ' GLU . 41.1 t -72.0 -38.11 62.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 178.296 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -67.88 -25.21 65.4 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.578 1.151 . . . . 0.0 111.317 176.394 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -80.88 -9.39 59.83 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 123.847 0.859 . . . . 0.0 112.075 177.298 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.62 2.81 67.09 Favored Glycine 0 C--N 1.347 1.167 0 N-CA-C 115.442 0.937 . . . . 0.0 115.442 166.429 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.405 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.1 OUTLIER -113.92 178.66 4.2 Favored 'General case' 0 N--CA 1.49 1.527 0 CA-C-N 117.746 0.773 . . . . 0.0 111.751 179.849 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.551 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 38.9 tt0 -76.47 153.73 35.33 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 123.926 0.766 . . . . 0.0 109.366 178.154 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.502 HG21 ' HA ' ' A' ' 26' ' ' GLU . 7.2 p -136.49 138.83 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 123.073 0.549 . . . . 0.0 110.284 178.493 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 43.7 tptt -146.8 122.1 10.25 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 175.268 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.609 HG12 ' HB3' ' A' ' 7' ' ' ALA . 45.7 mt -122.69 113.0 36.46 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 123.098 0.559 . . . . 0.0 111.788 -173.433 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 68.8 tt0 -81.25 107.46 14.06 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.669 0.788 . . . . 0.0 109.667 174.845 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.48 HG22 ' HB2' ' A' ' 9' ' ' CYS . 22.3 p -88.72 109.31 20.04 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.233 0.613 . . . . 0.0 110.15 175.773 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.517 HE22 ' HB2' ' A' ' 70' ' ' GLU . 42.0 mt-30 -103.6 155.42 18.56 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.685 0.755 . . . . 0.0 111.542 178.182 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 178.52 167.95 37.08 Favored Glycine 0 C--O 1.24 0.474 0 CA-C-N 114.529 -1.214 . . . . 0.0 110.406 172.285 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.12 -19.49 65.63 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-N 116.944 0.372 . . . . 0.0 110.2 173.699 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -64.63 -40.74 96.01 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 124.548 1.139 . . . . 0.0 110.856 171.178 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 162.47 -176.68 38.8 Favored Glycine 0 C--N 1.344 1.003 0 CA-C-N 115.43 -0.805 . . . . 0.0 112.176 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.532 HD13 ' NH2' ' A' ' 49' ' ' ARG . 85.0 mt -129.25 134.24 64.22 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 C-N-CA 123.972 0.909 . . . . 0.0 108.789 176.123 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 9.7 tp-100 -140.8 149.65 42.31 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.013 0.925 . . . . 0.0 110.398 -172.141 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.455 ' HB3' ' O ' ' A' ' 38' ' ' ILE . 33.8 t30 57.22 34.42 24.77 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 125.275 1.43 . . . . 0.0 110.392 177.377 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.532 ' NH2' HD13 ' A' ' 46' ' ' ILE . 20.4 ttm180 -57.39 131.51 50.31 Favored 'General case' 0 C--N 1.351 0.664 0 C-N-CA 124.695 1.198 . . . . 0.0 112.737 -171.209 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.594 ' HB2' HH22 ' A' ' 74' ' ' ARG . 27.8 mt -72.95 149.04 43.7 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 113.871 -1.513 . . . . 0.0 110.961 177.246 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.431 ' O ' HG13 ' A' ' 55' ' ' ILE . 42.7 p -103.38 174.3 5.93 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.287 173.409 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.72 -31.42 71.58 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 122.716 0.406 . . . . 0.0 110.631 173.44 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -66.23 -42.36 88.79 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.883 0.873 . . . . 0.0 110.686 178.705 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -57.19 -48.92 77.55 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.423 0.689 . . . . 0.0 111.035 175.881 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.677 HD11 HH21 ' A' ' 74' ' ' ARG . 23.1 mt -69.21 -36.39 72.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 O-C-N 124.143 0.902 . . . . 0.0 111.24 -175.292 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.75 -46.16 69.58 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.831 0.853 . . . . 0.0 111.451 -178.156 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -84.96 -10.73 56.75 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.248 0.619 . . . . 0.0 111.557 -178.061 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.95 106.93 1.12 Allowed 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.339 0.656 . . . . 0.0 110.761 178.165 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 13.7 m -63.35 -36.0 82.26 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.27 1.028 . . . . 0.0 109.831 169.495 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.513 HG23 HG21 ' A' ' 99' ' ' ILE . 75.8 mt -132.07 140.83 46.98 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 124.193 0.997 . . . . 0.0 110.082 -177.716 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 32.4 mt -135.96 125.43 39.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 C-N-CA 123.746 0.818 . . . . 0.0 108.964 174.701 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.3 mp -112.28 127.96 69.18 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 175.394 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' HIS . . . . . 0.405 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 5.7 m170 -99.82 86.15 3.24 Favored 'General case' 0 N--CA 1.486 1.353 0 CA-C-O 121.773 0.797 . . . . 0.0 109.111 169.844 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.515 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 19.7 m -81.09 81.63 7.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 114.254 -1.339 . . . . 0.0 109.173 175.998 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 34.9 m -128.5 159.68 39.74 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.413 0 CA-C-O 121.741 0.782 . . . . 0.0 111.608 -171.208 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -110.43 -25.4 10.08 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 114.494 -1.23 . . . . 0.0 108.994 172.411 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 14.6 m -135.96 164.39 32.18 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 C-N-CA 125.523 1.529 . . . . 0.0 108.868 -178.874 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 96.2 m -68.53 114.1 19.89 Favored Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 122.999 0.52 . . . . 0.0 110.272 -179.386 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.561 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 46.1 Cg_endo -68.45 152.97 74.87 Favored 'Trans proline' 0 C--N 1.382 2.323 0 C-N-CA 122.445 2.097 . . . . 0.0 112.489 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.517 ' HB2' HE22 ' A' ' 41' ' ' GLN . 40.1 mm-40 -67.29 -29.31 68.88 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.368 0.667 . . . . 0.0 111.637 -175.581 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.487 ' HB3' ' HD3' ' A' ' 74' ' ' ARG . 2.1 m-20 -104.32 18.69 21.64 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.607 -175.251 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.561 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 41.7 t30 -57.62 -35.46 70.5 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.166 0.986 . . . . 0.0 112.341 -177.654 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.53 -31.37 72.51 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 123.385 0.674 . . . . 0.0 112.632 -179.745 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.677 HH21 HD11 ' A' ' 55' ' ' ILE . 35.5 mtp180 -59.26 -33.79 71.47 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.87 0.868 . . . . 0.0 112.416 175.821 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -98.95 -16.49 18.74 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 115.083 -0.962 . . . . 0.0 111.448 -175.032 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -54.97 -33.43 62.44 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 124.14 0.976 . . . . 0.0 112.39 -176.742 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 40.4 p -78.75 -6.39 55.76 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.793 0.837 . . . . 0.0 112.909 -177.393 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.57 ' HG3' HG22 ' A' ' 55' ' ' ILE . 25.2 mmt180 -120.24 171.13 8.72 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.909 0.884 . . . . 0.0 111.343 -172.58 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -78.37 92.69 4.59 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.361 0.665 . . . . 0.0 110.014 -177.5 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 43.6 t -109.05 139.48 31.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 123.169 0.588 . . . . 0.0 110.946 -177.719 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -108.11 91.01 3.47 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.981 1.312 . . . . 0.0 107.92 -179.299 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.405 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 44.7 mt-10 -78.41 128.89 34.27 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.526 -177.016 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.423 HG13 ' HA ' ' A' ' 64' ' ' SER . 40.9 pt -141.87 -174.85 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 C-N-CA 125.433 1.493 . . . . 0.0 108.819 -179.408 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 25.5 p -83.34 148.83 27.11 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.033 0.444 . . . . 0.0 109.956 167.523 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.821 HD13 ' SG ' ' A' ' 11' ' ' CYS . 7.8 tt -63.68 -29.91 71.08 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.285 177.098 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.523 ' HG2' ' HE3' ' A' ' 90' ' ' LYS . 27.6 tt0 -70.15 -36.27 74.63 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.954 178.323 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -60.64 -33.23 72.48 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.703 0.801 . . . . 0.0 110.367 173.491 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.1 -20.63 64.94 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.827 0.851 . . . . 0.0 113.274 178.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 68.4 mt -87.32 -55.26 6.69 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 123.189 0.595 . . . . 0.0 109.654 178.704 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.523 ' HE3' ' HG2' ' A' ' 86' ' ' GLN . 18.0 ptpt -77.78 -43.84 29.42 Favored 'General case' 0 N--CA 1.482 1.174 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.626 -173.552 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -105.51 20.46 18.86 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.032 0.933 . . . . 0.0 110.522 -173.454 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.405 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -44.03 -58.99 2.51 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 124.007 0.923 . . . . 0.0 113.052 -175.342 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.07 -41.15 91.77 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.032 -0.986 . . . . 0.0 110.785 178.317 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -58.21 -46.02 93.34 Favored Glycine 0 C--N 1.352 1.459 0 O-C-N 124.493 1.121 . . . . 0.0 112.539 -179.189 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 26.8 mt -59.74 -57.42 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 124.516 1.127 . . . . 0.0 109.625 -178.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.8 mp -55.31 -50.97 60.87 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.99 0 O-C-N 124.302 1.002 . . . . 0.0 111.027 -177.225 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.95 -29.27 68.28 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 122.897 0.479 . . . . 0.0 112.097 -175.774 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -68.74 -33.72 74.39 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 123.493 0.496 . . . . 0.0 110.16 176.589 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.513 HG21 HG23 ' A' ' 60' ' ' ILE . 66.4 mt -75.82 -41.2 39.81 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 -179.894 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -58.03 -45.09 87.53 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 114.194 -1.366 . . . . 0.0 111.965 177.403 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -74.45 -30.29 61.82 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 123.208 0.317 . . . . 0.0 111.232 -178.42 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 69.9 mtm -66.99 -49.93 63.83 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 122.368 0.267 . . . . 0.0 110.404 175.335 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 50.4 mt -62.5 -36.74 76.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 123.364 0.666 . . . . 0.0 110.233 176.182 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.402 ' HA ' ' HG2' ' A' ' 107' ' ' GLN . . . -65.52 -38.95 91.15 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.118 0.567 . . . . 0.0 110.867 176.62 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 26.5 t -68.61 -33.52 74.19 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.43 0.692 . . . . 0.0 111.312 -174.441 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -85.67 -29.3 24.1 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-N 116.096 -0.502 . . . . 0.0 112.255 179.314 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.402 ' HG2' ' HA ' ' A' ' 104' ' ' ALA . 4.3 pt20 -86.7 -30.02 22.0 Favored 'General case' 0 N--CA 1.492 1.67 0 CA-C-N 118.333 0.515 . . . . 0.0 111.593 -174.772 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 . . . . . 0 N--CA 1.48 1.056 0 C-N-CA 123.422 0.689 . . . . 0.0 110.8 179.825 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.0 mtt . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.253 0.073 . . . . 0.0 111.083 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.7 t -81.48 106.36 13.37 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.11 0.564 . . . . 0.0 110.203 -178.788 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.656 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 15.0 pttt -79.86 -169.25 1.91 Allowed 'General case' 0 N--CA 1.481 1.117 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.195 169.315 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.538 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.4 tmtp? -145.22 143.25 30.17 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-O 121.377 0.608 . . . . 0.0 110.501 -174.3 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.432 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 8.4 tt -131.47 138.56 49.07 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.542 1.137 . . . . 0.0 108.075 174.491 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.467 HG13 HG23 ' A' ' 61' ' ' ILE . 17.4 pt -129.01 163.91 32.78 Favored 'Isoleucine or valine' 0 C--O 1.24 0.588 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 170.41 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.603 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -152.39 168.47 25.35 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 120.95 0.405 . . . . 0.0 110.074 178.683 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.7 tt -141.12 120.8 13.37 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 107.513 -1.291 . . . . 0.0 107.513 -177.806 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.553 ' HA ' ' O ' ' A' ' 64' ' ' SER . 60.0 m -110.73 113.78 26.65 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.664 0.786 . . . . 0.0 108.913 175.285 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.409 ' HB3' HG12 ' A' ' 65' ' ' VAL . . . -125.64 112.61 16.35 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 122.78 0.432 . . . . 0.0 110.925 -175.891 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.546 ' SG ' ' HB2' ' A' ' 13' ' ' MET . 44.0 t -121.27 136.61 25.92 Favored Pre-proline 0 N--CA 1.47 0.537 0 C-N-CA 123.928 0.891 . . . . 0.0 110.183 -179.589 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -69.58 -23.26 31.8 Favored 'Trans proline' 0 C--N 1.37 1.682 0 C-N-CA 122.781 2.321 . . . . 0.0 112.477 175.26 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.546 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 0.3 OUTLIER -71.65 -43.15 66.58 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.596 0.758 . . . . 0.0 111.209 -178.097 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 156.8 -172.06 34.39 Favored Glycine 0 C--N 1.345 1.055 0 CA-C-N 116.381 -0.372 . . . . 0.0 113.265 179.343 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 65.4 mt -82.6 -18.94 39.44 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 -175.256 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.85 -42.33 99.71 Favored 'General case' 0 N--CA 1.485 1.295 0 CA-C-N 118.818 0.736 . . . . 0.0 111.234 -177.832 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.446 ' CE1' HD22 ' A' ' 85' ' ' LEU . 10.4 t-160 -65.76 -42.22 91.15 Favored 'General case' 0 C--O 1.247 0.966 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.124 177.417 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.453 HG22 HD11 ' A' ' 85' ' ' LEU . 35.3 p -67.38 -32.61 73.65 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.238 -178.517 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -74.47 -31.37 62.2 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.357 0.663 . . . . 0.0 111.738 -178.512 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 56.3 mtm -64.8 -41.27 95.94 Favored 'General case' 0 N--CA 1.485 1.316 0 CA-C-O 120.921 0.391 . . . . 0.0 110.234 172.681 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.35 -38.4 84.76 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.324 174.541 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.84 -32.79 72.73 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.401 0.68 . . . . 0.0 111.059 -179.334 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 7.3 tp-100 -74.22 -42.77 59.22 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 122.944 0.498 . . . . 0.0 109.832 177.728 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.37 -51.01 61.5 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.489 -176.469 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.417 HD11 ' OG ' ' A' ' 64' ' ' SER . 94.3 mt -63.55 -34.26 77.41 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.502 0.721 . . . . 0.0 111.374 177.799 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.573 ' HA ' HG21 ' A' ' 36' ' ' VAL . 31.0 tt0 -56.38 -56.83 16.21 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 123.916 0.76 . . . . 0.0 110.455 174.686 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.471 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 44.8 mt-10 -52.79 -48.81 66.62 Favored 'General case' 0 N--CA 1.478 0.966 0 O-C-N 124.535 1.147 . . . . 0.0 111.238 -179.785 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.94 -49.14 78.96 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.303 1.041 . . . . 0.0 112.199 -177.915 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.26 -26.3 67.28 Favored 'General case' 0 CA--C 1.546 0.81 0 CA-C-N 115.372 -0.831 . . . . 0.0 112.863 178.519 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 26' ' ' GLU . 55.4 t -72.31 -38.3 61.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 178.21 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.471 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 8.4 mm-40 -71.54 -22.64 61.74 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 114.836 -1.074 . . . . 0.0 111.051 178.313 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -82.43 -20.19 37.5 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.318 0.647 . . . . 0.0 111.105 174.331 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 113.48 -37.56 3.55 Favored Glycine 0 C--N 1.348 1.225 0 N-CA-C 113.951 0.34 . . . . 0.0 113.951 167.783 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.656 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -76.0 174.39 10.05 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 -175.07 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.538 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 12.4 tp10 -72.56 151.65 42.29 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 113.935 -1.484 . . . . 0.0 109.507 178.515 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.573 HG21 ' HA ' ' A' ' 26' ' ' GLU . 9.6 p -136.05 128.71 46.26 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 C-N-CA 123.045 0.538 . . . . 0.0 110.753 -179.434 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 48.5 tptt -138.03 114.97 10.78 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.654 0.782 . . . . 0.0 109.071 176.276 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.603 HG12 ' HB3' ' A' ' 7' ' ' ALA . 43.2 mt -118.69 111.01 31.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -174.098 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -72.9 148.11 44.67 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 171.547 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.8 p -133.69 122.21 23.07 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.863 0.865 . . . . 0.0 109.182 -177.577 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -114.52 134.27 55.15 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -162.25 179.74 37.38 Favored Glycine 0 C--N 1.341 0.807 0 N-CA-C 112.699 -0.16 . . . . 0.0 112.699 -176.459 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.35 -24.19 67.21 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.943 0.897 . . . . 0.0 112.123 179.562 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -75.61 -36.3 60.3 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.598 0.759 . . . . 0.0 110.548 176.511 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 147.36 -156.52 27.02 Favored Glycine 0 C--N 1.346 1.099 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.417 -177.589 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.413 HD12 HH22 ' A' ' 49' ' ' ARG . 77.5 mt -113.12 141.5 28.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 174.198 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -135.54 150.25 49.68 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.258 1.023 . . . . 0.0 109.145 179.17 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 8.8 t30 64.3 39.29 7.37 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.533 1.133 . . . . 0.0 110.085 174.366 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.413 HH22 HD12 ' A' ' 46' ' ' ILE . 22.8 tpp180 -42.03 125.69 3.04 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 125.961 1.704 . . . . 0.0 113.31 -178.176 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 42.7 mt -82.48 126.95 32.82 Favored 'General case' 0 C--O 1.242 0.663 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.221 174.074 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.418 ' O ' HG13 ' A' ' 55' ' ' ILE . 60.2 p -96.64 164.35 12.63 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.932 -178.062 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.87 -29.92 63.37 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.462 0.705 . . . . 0.0 111.247 177.299 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.413 ' O ' ' HG3' ' A' ' 57' ' ' GLU . 47.7 tt0 -57.54 -61.14 2.72 Favored 'General case' 0 C--N 1.354 0.763 0 C-N-CA 123.783 0.833 . . . . 0.0 110.104 170.807 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.454 ' HB3' HG21 ' A' ' 6' ' ' ILE . 38.9 m-20 -52.02 -44.11 64.03 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 124.134 0.973 . . . . 0.0 112.343 -176.555 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.527 HG22 ' HG3' ' A' ' 78' ' ' ARG . 29.4 mt -67.4 -38.11 80.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 O-C-N 124.285 0.991 . . . . 0.0 111.742 -175.961 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -79.88 -28.69 39.9 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.218 179.732 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' A' ' 53' ' ' GLN . 53.0 mt-10 -71.07 -35.97 72.09 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.534 0.734 . . . . 0.0 110.274 173.751 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -58.53 108.01 0.58 Allowed 'General case' 0 C--N 1.348 0.521 0 CA-C-N 114.643 -1.162 . . . . 0.0 111.997 -171.686 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 37.3 m -62.68 -40.43 97.06 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 115.046 -0.979 . . . . 0.0 109.041 165.01 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 80.4 mt -129.27 140.26 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.317 -178.194 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.467 HG23 HG13 ' A' ' 6' ' ' ILE . 20.2 mt -130.31 135.0 61.63 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 171.595 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -119.42 133.98 64.47 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 173.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' HIS . . . . . 0.441 ' HB2' ' HG3' ' A' ' 82' ' ' GLU . 13.2 m170 -107.46 84.35 1.95 Allowed 'General case' 0 N--CA 1.484 1.232 0 CA-C-O 121.481 0.658 . . . . 0.0 109.648 170.421 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.553 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 20.4 m -78.54 80.59 4.92 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 124.659 1.184 . . . . 0.0 110.344 177.014 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.409 HG12 ' HB3' ' A' ' 10' ' ' ALA . 34.7 m -125.37 160.0 31.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 CA-C-O 121.665 0.745 . . . . 0.0 112.175 -169.567 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -110.59 -23.13 11.27 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 114.589 -1.187 . . . . 0.0 109.071 173.821 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 17.0 m -130.86 165.87 30.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 C-N-CA 125.545 1.538 . . . . 0.0 108.638 178.282 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 88.8 m -62.29 117.17 27.75 Favored Pre-proline 0 CA--C 1.547 0.848 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 175.229 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.606 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 38.5 Cg_endo -63.92 142.91 83.89 Favored 'Trans proline' 0 C--N 1.376 2.002 0 C-N-CA 122.06 1.84 . . . . 0.0 111.544 177.907 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -68.61 -37.49 79.82 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.45 0.7 . . . . 0.0 110.715 -174.925 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -97.6 25.06 6.07 Favored 'General case' 0 C--O 1.219 -0.503 0 CA-C-N 115.21 -0.905 . . . . 0.0 110.683 -177.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.606 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 38.6 t30 -55.11 -37.35 66.77 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.148 0.579 . . . . 0.0 111.407 177.285 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.65 -22.1 66.89 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.613 0.765 . . . . 0.0 112.778 -179.181 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.6 mmp_? -66.71 -33.09 74.86 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.146 0.578 . . . . 0.0 111.455 174.097 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -107.62 -29.48 9.14 Favored 'General case' 0 N--CA 1.485 1.298 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -168.197 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -54.94 -27.43 43.4 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 -165.403 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 20.9 t -84.8 7.19 21.6 Favored 'General case' 0 CA--C 1.56 1.352 0 C-N-CA 123.638 0.775 . . . . 0.0 112.204 -179.412 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.527 ' HG3' HG22 ' A' ' 55' ' ' ILE . 34.9 mmt180 -121.28 -177.03 3.42 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 124.595 1.158 . . . . 0.0 110.036 179.511 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -79.5 86.79 5.14 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.062 0.545 . . . . 0.0 110.893 178.788 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 22.5 t -108.68 146.64 14.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 123.75 0.82 . . . . 0.0 109.877 179.184 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -125.73 96.04 4.64 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.819 0.848 . . . . 0.0 109.737 177.589 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.441 ' HG3' ' HB2' ' A' ' 63' ' ' HIS . 1.8 mp0 -72.3 129.1 37.62 Favored 'General case' 0 C--N 1.352 0.696 0 CA-C-O 121.233 0.54 . . . . 0.0 110.404 178.261 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.485 HG13 ' HA ' ' A' ' 64' ' ' SER . 45.8 pt -138.45 -176.48 1.35 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.83 0 C-N-CA 125.231 1.412 . . . . 0.0 108.386 177.271 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 13.1 p -83.63 147.44 27.71 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 122.63 0.372 . . . . 0.0 110.158 170.42 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.518 HD13 ' HB2' ' A' ' 11' ' ' CYS . 4.8 tt -63.26 -30.23 71.41 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.341 0.656 . . . . 0.0 111.153 178.074 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -61.38 -43.76 98.32 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.39 0.676 . . . . 0.0 110.946 173.858 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.425 ' HB3' HD12 ' A' ' 83' ' ' ILE . 9.6 t70 -59.77 -32.99 71.11 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.628 0.771 . . . . 0.0 110.901 179.427 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.483 ' HB2' ' HB3' ' A' ' 64' ' ' SER . . . -65.46 -23.59 66.96 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.837 0.855 . . . . 0.0 113.244 179.112 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 34.9 mt -93.89 -51.12 11.51 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 123.091 0.556 . . . . 0.0 109.895 -179.187 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 58.1 pttt -75.62 -29.73 59.28 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.329 0.652 . . . . 0.0 112.297 -174.759 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -126.45 18.75 7.5 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 122.989 0.516 . . . . 0.0 110.886 -168.736 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -44.98 -57.35 3.88 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -174.671 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.27 -36.07 79.01 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.024 -0.989 . . . . 0.0 111.491 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -62.48 -56.55 20.97 Favored Glycine 0 C--N 1.351 1.365 0 O-C-N 124.152 0.908 . . . . 0.0 111.554 179.818 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.405 ' O ' HG13 ' A' ' 99' ' ' ILE . 33.7 mt -47.05 -57.76 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 125.039 1.336 . . . . 0.0 111.09 -179.383 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.9 mp -57.48 -53.49 43.48 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 O-C-N 124.244 0.965 . . . . 0.0 111.212 -176.688 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -27.26 67.64 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -176.567 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 24.3 mm-40 -69.33 -36.4 76.89 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.762 0.825 . . . . 0.0 109.744 178.701 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.405 HG13 ' O ' ' A' ' 95' ' ' ILE . 30.3 mt -77.99 -38.94 25.01 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -55.71 -47.84 76.17 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 114.22 -1.355 . . . . 0.0 111.489 176.581 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -74.56 -33.76 62.77 Favored 'General case' 0 C--N 1.349 0.557 0 O-C-N 123.566 0.541 . . . . 0.0 111.278 -177.804 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 70.3 mtm -60.46 -51.41 69.6 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 176.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 60.2 mt -65.76 -45.27 92.2 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.916 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.562 178.109 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.73 -31.53 72.24 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -175.506 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 66.1 m -84.2 -24.74 29.97 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -176.004 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -84.46 -31.8 24.38 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 122.002 0.121 . . . . 0.0 110.973 174.131 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -84.08 -33.32 24.41 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 122.847 0.459 . . . . 0.0 111.248 -178.947 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 27.3 mm-40 . . . . . 0 C--O 1.251 1.183 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 177.293 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.622 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 17.1 pttt . . . . . 0 N--CA 1.48 1.038 0 CA-C-O 121.302 0.573 . . . . 0.0 110.847 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.54 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.0 tmtp? -146.34 143.61 29.22 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -170.374 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.486 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.2 tt -132.29 141.9 49.17 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 175.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.496 HD13 ' HA ' ' A' ' 55' ' ' ILE . 21.0 pt -132.57 169.79 21.26 Favored 'Isoleucine or valine' 0 C--O 1.241 0.653 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 170.501 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.615 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -153.64 169.74 22.53 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.354 175.636 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.1 tt -143.03 113.5 7.38 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 178.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 64' ' ' SER . 56.3 m -101.05 113.53 26.63 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 175.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.474 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -126.8 119.0 25.79 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 122.626 0.37 . . . . 0.0 110.405 -178.035 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.514 ' SG ' ' HB2' ' A' ' 13' ' ' MET . 51.7 t -125.26 138.53 31.86 Favored Pre-proline 0 N--CA 1.472 0.64 0 C-N-CA 123.339 0.656 . . . . 0.0 111.185 -172.635 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -68.38 -20.42 42.27 Favored 'Trans proline' 0 C--N 1.378 2.109 0 C-N-CA 123.096 2.531 . . . . 0.0 112.606 172.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.514 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 60.5 mtt -75.91 -46.36 30.38 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.635 0.774 . . . . 0.0 110.01 178.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 141.92 -161.49 27.13 Favored Glycine 0 C--N 1.346 1.138 0 CA-C-N 116.038 -0.528 . . . . 0.0 113.307 176.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 52.9 mt -74.2 -26.61 60.37 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 -170.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.73 -43.34 94.25 Favored 'General case' 0 N--CA 1.485 1.32 0 CA-C-O 121.498 0.666 . . . . 0.0 110.971 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 8.6 t-160 -71.56 -38.1 71.0 Favored 'General case' 0 C--O 1.247 0.935 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.385 -178.353 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 51.6 p -66.45 -32.02 73.14 Favored 'General case' 0 C--N 1.35 0.604 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.869 178.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 18.6 m-30 -72.14 -30.35 64.95 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.049 0.54 . . . . 0.0 111.694 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 41.0 mtm -67.28 -40.19 86.09 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 120.758 0.313 . . . . 0.0 110.456 173.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.46 -36.6 74.01 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.363 176.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.56 -50.38 58.78 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.828 0.851 . . . . 0.0 110.301 -178.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.484 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 8.7 tp-100 -58.32 -43.94 88.4 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.737 0.815 . . . . 0.0 110.44 179.098 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.48 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -62.73 -54.39 39.88 Favored 'General case' 0 CA--C 1.55 0.96 0 CA-C-N 115.66 -0.7 . . . . 0.0 112.052 -178.204 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 92.1 mt -64.69 -29.61 70.61 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.196 0.598 . . . . 0.0 111.536 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.503 ' O ' HG23 ' A' ' 30' ' ' VAL . 32.9 tt0 -65.91 -55.27 17.78 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.812 0.695 . . . . 0.0 110.012 -179.385 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.51 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 27.5 mm-40 -52.44 -47.5 66.37 Favored 'General case' 0 N--CA 1.484 1.261 0 O-C-N 124.359 1.037 . . . . 0.0 110.432 178.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.49 -51.68 67.59 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.502 1.121 . . . . 0.0 111.925 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.55 -23.39 65.42 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 115.332 -0.849 . . . . 0.0 113.184 178.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.503 HG23 ' O ' ' A' ' 26' ' ' GLU . 53.9 t -74.88 -37.6 42.13 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 178.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.51 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 17.4 mm-40 -72.75 -21.48 61.01 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.745 177.393 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -80.64 -13.76 58.76 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.532 0.733 . . . . 0.0 111.76 174.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 105.0 -37.79 3.62 Favored Glycine 0 C--N 1.347 1.191 0 N-CA-C 114.278 0.471 . . . . 0.0 114.278 167.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.622 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -76.75 -179.4 5.35 Favored 'General case' 0 N--CA 1.483 1.207 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -175.897 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.54 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 8.8 tp10 -73.05 153.06 41.01 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 114.453 -1.248 . . . . 0.0 110.31 176.496 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.486 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 6.7 p -142.46 128.06 17.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 123.273 0.629 . . . . 0.0 110.595 176.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 49.7 tptt -136.39 114.51 11.48 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 177.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.615 HG12 ' HB3' ' A' ' 7' ' ' ALA . 59.2 mt -117.39 111.31 34.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.925 0 C-N-CA 122.6 0.36 . . . . 0.0 111.877 -174.327 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -77.99 141.79 38.7 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.614 0.766 . . . . 0.0 109.099 171.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.417 HG22 ' HB2' ' A' ' 9' ' ' CYS . 17.4 p -124.64 117.51 24.44 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.53 0.732 . . . . 0.0 109.294 -177.666 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.474 ' O ' ' HA ' ' A' ' 10' ' ' ALA . 42.1 mt-30 -109.81 135.79 50.16 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.578 0.751 . . . . 0.0 110.146 178.44 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -161.68 179.59 36.97 Favored Glycine 0 C--N 1.336 0.57 0 N-CA-C 111.929 -0.468 . . . . 0.0 111.929 178.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.24 -14.51 63.0 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.127 0.571 . . . . 0.0 111.998 -179.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -84.78 -27.37 26.91 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.468 0.707 . . . . 0.0 111.347 176.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 147.19 -157.67 27.48 Favored Glycine 0 C--N 1.344 0.986 0 CA-C-N 116.413 -0.358 . . . . 0.0 112.545 -179.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.418 HG12 ' HG2' ' A' ' 41' ' ' GLN . 70.2 mt -127.48 132.35 69.39 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 C-N-CA 123.711 0.804 . . . . 0.0 109.995 178.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.408 ' HB3' ' OG1' ' A' ' 40' ' ' THR . 8.2 tp-100 -126.91 150.25 49.4 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.198 0.999 . . . . 0.0 110.586 -178.143 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 19.7 t30 61.43 41.5 12.69 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 124.966 1.306 . . . . 0.0 110.219 174.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 22.6 tpp180 -48.35 122.34 5.27 Favored 'General case' 0 C--N 1.356 0.873 0 C-N-CA 125.277 1.431 . . . . 0.0 112.544 -176.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.43 ' HB2' HH22 ' A' ' 74' ' ' ARG . 36.9 mt -66.73 148.99 51.18 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 114.605 -1.179 . . . . 0.0 110.621 170.107 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 34.4 p -104.45 167.81 9.5 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 172.24 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.61 -34.49 71.19 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-O 121.019 0.438 . . . . 0.0 110.461 175.52 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -63.76 -48.64 76.12 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.847 175.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -54.18 -42.35 69.57 Favored 'General case' 0 N--CA 1.496 1.873 0 C-N-CA 123.321 0.648 . . . . 0.0 111.791 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.617 HG22 ' HG3' ' A' ' 78' ' ' ARG . 43.2 mt -75.28 -27.96 19.97 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.939 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.041 -176.205 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -75.51 -45.9 35.49 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.485 0.714 . . . . 0.0 111.117 176.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -61.38 -35.3 77.1 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.342 1.057 . . . . 0.0 110.77 178.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -53.15 100.49 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.579 0 O-C-N 125.001 1.438 . . . . 0.0 112.582 -174.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 30.2 m -63.94 -36.45 84.0 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 114.673 -1.149 . . . . 0.0 109.067 167.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.5 HG23 HG21 ' A' ' 99' ' ' ILE . 80.0 mt -129.05 140.45 49.2 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 CA-C-N 114.769 -1.105 . . . . 0.0 109.794 178.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.529 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 35.1 mt -129.89 141.37 46.6 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 171.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.6 mp -127.02 112.55 29.22 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 CA-C-N 118.344 0.52 . . . . 0.0 109.632 172.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 8.6 m170 -89.17 83.95 6.52 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-O 121.745 0.783 . . . . 0.0 109.322 170.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.462 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 20.6 p -80.32 79.86 6.85 Favored 'General case' 0 C--O 1.24 0.567 0 CA-C-N 114.361 -1.29 . . . . 0.0 109.312 176.509 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 27.6 m -126.21 161.52 31.79 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 CA-C-O 121.685 0.755 . . . . 0.0 111.943 -170.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -123.08 -17.24 6.75 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 114.491 -1.231 . . . . 0.0 109.592 175.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 6.7 m -131.92 159.22 43.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 124.699 1.2 . . . . 0.0 108.401 173.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 79.0 m -64.45 111.83 6.46 Favored Pre-proline 0 CA--C 1.544 0.714 0 O-C-N 123.8 0.688 . . . . 0.0 109.663 177.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.512 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 55.8 Cg_endo -68.14 142.23 55.17 Favored 'Trans proline' 0 C--N 1.376 2.01 0 C-N-CA 122.175 1.916 . . . . 0.0 110.651 -179.157 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.425 ' HB2' HE22 ' A' ' 41' ' ' GLN . 18.4 mm-40 -65.36 -21.87 66.74 Favored 'General case' 0 N--CA 1.482 1.141 0 CA-C-O 121.327 0.584 . . . . 0.0 111.63 -173.496 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.838 ' HB3' HH11 ' A' ' 74' ' ' ARG . 4.0 m-20 -104.46 12.61 33.1 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.201 1.0 . . . . 0.0 112.737 -174.511 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.512 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 5.6 p30 -60.06 -24.95 64.98 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.558 0.743 . . . . 0.0 112.384 -176.044 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -60.89 -32.4 71.86 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.887 1.275 . . . . 0.0 113.08 -179.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.838 HH11 ' HB3' ' A' ' 71' ' ' ASP . 40.1 mtp180 -68.36 -25.32 65.02 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 124.338 1.055 . . . . 0.0 111.569 -179.418 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.433 ' HB3' HG21 ' A' ' 80' ' ' VAL . 33.0 m-85 -103.07 -2.21 27.87 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 114.139 -1.392 . . . . 0.0 111.277 -175.511 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -54.79 -42.76 72.16 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 124.639 1.176 . . . . 0.0 111.933 -179.136 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 58.5 p -82.86 -13.69 55.68 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.642 0.777 . . . . 0.0 112.358 -177.087 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.617 ' HG3' HG22 ' A' ' 55' ' ' ILE . 33.3 mmt180 -103.64 164.54 11.6 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.706 0.802 . . . . 0.0 111.63 -169.01 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -83.38 99.35 10.0 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 123.748 0.819 . . . . 0.0 110.146 -177.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.529 ' HA ' ' HB ' ' A' ' 61' ' ' ILE . 51.4 t -112.28 135.68 50.87 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 C-N-CA 123.643 0.777 . . . . 0.0 110.514 -174.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 73.6 m-85 -104.26 88.58 3.02 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 107.367 -1.345 . . . . 0.0 107.367 175.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -86.92 116.13 24.79 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 114.619 -1.173 . . . . 0.0 109.676 -172.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.439 HG13 ' HA ' ' A' ' 64' ' ' SER . 43.6 pt -126.24 -172.58 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 124.693 1.197 . . . . 0.0 110.106 -179.459 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 15.9 p -82.79 147.34 28.45 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.728 169.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.444 HD13 ' HB2' ' A' ' 11' ' ' CYS . 6.5 tt -62.85 -27.69 69.51 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.381 176.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.659 ' HG2' ' HE2' ' A' ' 90' ' ' LYS . 10.1 tt0 -71.11 -40.52 71.42 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 122.725 0.41 . . . . 0.0 111.113 177.016 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.43 ' HB3' HD12 ' A' ' 83' ' ' ILE . 24.5 t70 -59.86 -33.54 71.94 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.101 0.561 . . . . 0.0 110.195 176.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.54 -28.44 69.86 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.881 0.872 . . . . 0.0 112.739 177.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 63.9 mt -88.03 -49.04 14.77 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.992 0 C-N-CA 123.287 0.635 . . . . 0.0 110.273 -179.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.659 ' HE2' ' HG2' ' A' ' 86' ' ' GLN . 0.1 OUTLIER -79.46 -30.69 42.24 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 -173.599 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -123.31 16.8 9.81 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.148 0.579 . . . . 0.0 110.851 -170.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.48 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -40.22 -59.01 1.36 Allowed 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 124.304 1.042 . . . . 0.0 113.584 -173.111 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.56 -39.5 94.55 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 114.919 -1.037 . . . . 0.0 111.165 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -60.6 -46.78 93.76 Favored Glycine 0 C--N 1.354 1.553 0 O-C-N 124.304 1.003 . . . . 0.0 112.055 -178.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.428 HD12 ' HA ' ' A' ' 92' ' ' ALA . 34.1 mt -53.53 -62.21 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 124.893 1.277 . . . . 0.0 110.219 177.478 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.7 mp -55.04 -53.8 30.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 O-C-N 124.178 0.924 . . . . 0.0 111.227 -174.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.16 -28.93 69.15 Favored 'General case' 0 N--CA 1.485 1.302 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -175.072 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 50.5 mm-40 -71.93 -36.76 70.02 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 122.572 0.349 . . . . 0.0 110.418 176.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.5 HG21 HG23 ' A' ' 60' ' ' ILE . 55.3 mt -71.82 -35.59 55.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 179.403 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -59.05 -49.46 77.8 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-N 114.337 -1.301 . . . . 0.0 111.13 177.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -79.5 -25.96 41.69 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -175.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 65.2 mtm -69.04 -53.68 19.17 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 122.575 0.35 . . . . 0.0 110.393 174.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 26.6 mt -61.44 -49.22 85.36 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.281 177.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.524 ' O ' ' HG2' ' A' ' 108' ' ' GLN . . . -56.02 -39.97 72.73 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 122.961 0.505 . . . . 0.0 111.55 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 30.6 t -62.28 -45.84 91.46 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 123.981 0.8 . . . . 0.0 110.652 -177.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -78.82 -19.8 51.22 Favored 'General case' 0 N--CA 1.483 1.193 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 179.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 20.3 mm-40 -85.25 -12.62 52.06 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 122.84 0.456 . . . . 0.0 111.841 178.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.524 ' HG2' ' O ' ' A' ' 104' ' ' ALA . 76.8 mm-40 . . . . . 0 CA--C 1.556 1.21 0 CA-C-O 119.214 -0.422 . . . . 0.0 110.129 175.057 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.456 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 3.2 pttt . . . . . 0 N--CA 1.482 1.132 0 CA-C-O 120.963 0.411 . . . . 0.0 110.229 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.431 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 3.6 tmtp? -143.86 139.56 29.31 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 -172.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.472 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 8.6 tt -128.86 140.15 51.82 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 176.45 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 23.1 pt -128.87 158.4 41.44 Favored 'Isoleucine or valine' 0 C--O 1.24 0.594 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 170.381 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.636 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -147.19 169.53 19.14 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 177.386 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.443 HD21 ' OE1' ' A' ' 41' ' ' GLN . 5.4 tt -143.68 117.9 9.56 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 -179.144 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.511 ' HA ' ' O ' ' A' ' 64' ' ' SER . 61.5 m -108.39 108.41 19.36 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.88 0.872 . . . . 0.0 109.364 176.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -123.3 124.11 42.25 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 122.783 0.433 . . . . 0.0 110.697 -179.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.772 ' SG ' HD13 ' A' ' 85' ' ' LEU . 1.3 m -142.67 144.61 30.74 Favored Pre-proline 0 N--CA 1.483 1.209 0 C-N-CA 123.218 0.607 . . . . 0.0 111.766 -179.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -83.65 -14.57 7.74 Favored 'Trans proline' 0 C--N 1.373 1.868 0 C-N-CA 123.496 2.797 . . . . 0.0 112.447 174.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 23.1 ttt -60.38 -53.23 60.14 Favored 'General case' 0 C--N 1.357 0.908 0 C-N-CA 123.411 0.684 . . . . 0.0 109.671 174.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 157.48 175.26 28.21 Favored Glycine 0 C--O 1.246 0.87 0 CA-C-N 115.136 -0.938 . . . . 0.0 112.047 -179.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 29.9 mt -67.37 -20.61 65.59 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 122.925 0.49 . . . . 0.0 111.877 177.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.9 -45.53 82.54 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-O 121.008 0.433 . . . . 0.0 110.792 174.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.474 ' HD1' ' HG ' ' A' ' 11' ' ' CYS . 12.1 t-160 -68.48 -44.8 73.97 Favored 'General case' 0 C--O 1.242 0.666 0 CA-C-N 115.366 -0.833 . . . . 0.0 109.86 -179.174 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.491 ' HA ' HD11 ' A' ' 85' ' ' LEU . 47.5 p -64.7 -37.99 89.48 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.413 -176.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.479 ' HZ ' ' HG2' ' A' ' 47' ' ' GLN . 13.2 m-85 -74.25 -28.2 61.11 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.191 0.596 . . . . 0.0 112.0 -178.044 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 67.5 mtm -69.63 -36.7 76.36 Favored 'General case' 0 N--CA 1.483 1.222 0 CA-C-N 118.024 0.375 . . . . 0.0 110.483 173.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.02 -40.2 71.92 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.95 174.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.32 -42.75 83.11 Favored 'General case' 0 C--O 1.217 -0.613 0 C-N-CA 123.715 0.806 . . . . 0.0 110.334 -178.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.476 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 8.9 tp-100 -61.7 -47.23 86.23 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.463 0.705 . . . . 0.0 109.503 178.556 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.563 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -62.03 -52.8 62.51 Favored 'General case' 0 CA--C 1.552 1.038 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.698 -177.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 75.6 mt -64.54 -32.63 74.35 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.535 0.734 . . . . 0.0 111.635 -179.193 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.58 ' HA ' HG21 ' A' ' 36' ' ' VAL . 30.6 tt0 -65.89 -55.7 15.6 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 123.688 0.617 . . . . 0.0 110.141 -179.129 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.558 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 19.9 mm-40 -55.82 -44.36 77.8 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 124.456 1.097 . . . . 0.0 110.255 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -57.01 -50.44 72.72 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.162 0.985 . . . . 0.0 111.66 177.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.62 -22.88 65.32 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 123.671 0.788 . . . . 0.0 113.096 178.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 26' ' ' GLU . 55.1 t -75.97 -40.16 37.81 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.558 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 7.1 mm-40 -72.67 -18.53 61.55 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.513 177.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -80.93 -12.28 59.43 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.112 0.965 . . . . 0.0 111.302 173.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 82.77 23.43 55.88 Favored Glycine 0 C--N 1.349 1.298 0 N-CA-C 114.764 0.666 . . . . 0.0 114.764 167.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.456 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.1 OUTLIER -129.55 176.96 7.57 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.283 0.633 . . . . 0.0 111.089 173.138 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.431 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 11.7 tp10 -72.86 153.39 41.06 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.131 178.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.58 HG21 ' HA ' ' A' ' 26' ' ' GLU . 6.4 p -141.5 128.96 21.36 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 C-N-CA 123.426 0.69 . . . . 0.0 110.637 179.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 47.7 tptt -135.78 111.13 9.08 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.521 0.728 . . . . 0.0 109.568 179.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.636 HG12 ' HB3' ' A' ' 7' ' ' ALA . 48.4 mt -116.15 113.45 43.23 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.235 0 N-CA-C 112.767 0.654 . . . . 0.0 112.767 -172.604 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -79.22 117.65 20.43 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 123.933 0.893 . . . . 0.0 110.047 176.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.437 ' OG1' ' HB3' ' A' ' 47' ' ' GLN . 3.3 p -103.51 103.93 13.95 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.237 0.615 . . . . 0.0 110.623 -179.612 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.443 ' OE1' HD21 ' A' ' 8' ' ' LEU . 31.3 mt-30 -98.62 132.17 44.23 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 -179.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -148.29 179.85 24.82 Favored Glycine 0 C--O 1.241 0.588 0 N-CA-C 111.483 -0.647 . . . . 0.0 111.483 177.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.78 -23.75 67.49 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.46 0.704 . . . . 0.0 111.348 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -67.76 -44.47 77.44 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.819 1.247 . . . . 0.0 110.173 174.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 150.61 -175.79 29.47 Favored Glycine 0 C--N 1.336 0.54 0 CA-C-N 114.822 -1.081 . . . . 0.0 111.482 -175.292 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.467 HG21 ' NH1' ' A' ' 49' ' ' ARG . 67.6 mt -98.86 111.66 29.03 Favored 'Isoleucine or valine' 0 C--O 1.24 0.587 0 C-N-CA 123.685 0.794 . . . . 0.0 109.78 -179.412 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.479 ' HG2' ' HZ ' ' A' ' 19' ' ' PHE . 8.5 tp-100 -96.33 148.48 22.71 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.104 0.962 . . . . 0.0 110.084 177.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 25.8 t30 79.82 -54.21 0.39 Allowed 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 126.264 1.826 . . . . 0.0 111.571 173.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.467 ' NH1' HG21 ' A' ' 46' ' ' ILE . 17.7 tpp180 65.32 144.63 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.238 0 C-N-CA 125.347 1.459 . . . . 0.0 112.918 176.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 37.8 mt -112.29 129.9 56.12 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.391 1.077 . . . . 0.0 109.86 173.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 39.7 p -95.92 165.34 12.32 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.931 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.53 -30.46 63.08 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.479 0.712 . . . . 0.0 111.317 177.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -67.79 -47.34 69.4 Favored 'General case' 0 C--N 1.353 0.731 0 C-N-CA 123.699 0.8 . . . . 0.0 110.959 176.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -56.33 -44.42 79.98 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.386 0.674 . . . . 0.0 110.902 178.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.503 HG22 ' HG3' ' A' ' 78' ' ' ARG . 33.1 mt -72.39 -36.85 56.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 O-C-N 124.483 1.115 . . . . 0.0 111.277 -175.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.42 -44.01 68.79 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.385 0.674 . . . . 0.0 111.124 -178.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -86.31 -8.1 57.97 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.305 0.642 . . . . 0.0 111.998 -177.006 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.69 108.45 1.72 Allowed 'General case' 0 N--CA 1.473 0.71 0 O-C-N 123.709 0.63 . . . . 0.0 111.053 178.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 17.3 m -62.1 -37.22 84.28 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.429 167.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.584 HG23 HG21 ' A' ' 99' ' ' ILE . 76.5 mt -132.25 141.89 44.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 C-N-CA 124.363 1.065 . . . . 0.0 110.346 -176.543 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 27.2 mt -131.85 132.2 61.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 C-N-CA 123.916 0.887 . . . . 0.0 108.812 172.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.4 mp -119.23 133.25 66.67 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 172.126 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . 0.523 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 11.7 m170 -109.58 84.96 2.01 Favored 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 167.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.511 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 28.0 p -81.31 85.39 6.41 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 114.514 -1.221 . . . . 0.0 108.995 174.095 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 35.9 m -126.85 160.59 35.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-O 121.783 0.802 . . . . 0.0 111.982 -171.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -118.2 -19.01 9.18 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 114.007 -1.452 . . . . 0.0 109.116 176.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 5.8 m -132.19 160.49 42.45 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 C-N-CA 125.533 1.533 . . . . 0.0 108.037 176.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 63.8 m -59.47 116.78 17.77 Favored Pre-proline 0 C--O 1.244 0.766 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 174.243 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.524 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 37.9 Cg_endo -63.27 140.15 75.7 Favored 'Trans proline' 0 C--N 1.372 1.792 0 C-N-CA 121.949 1.766 . . . . 0.0 110.702 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -59.34 -38.11 79.51 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 123.92 0.762 . . . . 0.0 110.551 -174.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.435 ' HB3' ' HG3' ' A' ' 74' ' ' ARG . 4.4 m-20 -104.12 30.45 5.21 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 114.51 -1.223 . . . . 0.0 111.385 -174.13 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.524 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 7.2 p30 -59.89 -27.82 67.03 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.413 0.685 . . . . 0.0 110.858 177.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -60.04 -32.83 71.27 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.258 1.423 . . . . 0.0 112.262 176.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.435 ' HG3' ' HB3' ' A' ' 71' ' ' ASP . 12.1 mmp_? -66.26 -30.82 71.33 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 124.202 1.001 . . . . 0.0 111.715 -176.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -108.29 -2.06 19.56 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.962 -169.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -62.3 -35.27 78.52 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.265 0.626 . . . . 0.0 112.204 -172.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 69.8 p -75.74 -15.43 60.28 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.412 0.685 . . . . 0.0 112.014 -179.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.503 ' HG3' HG22 ' A' ' 55' ' ' ILE . 38.0 mmt180 -109.32 163.22 13.59 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.751 0.82 . . . . 0.0 111.153 -173.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 33.2 m-20 -76.42 109.25 9.98 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.463 0.705 . . . . 0.0 110.357 177.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 44.3 t -113.69 137.58 46.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 123.437 0.695 . . . . 0.0 109.918 179.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 79.7 m-85 -101.75 89.82 3.81 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 176.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.523 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 42.5 mt-10 -83.19 125.54 31.66 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.725 -174.631 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.509 HG13 ' HA ' ' A' ' 64' ' ' SER . 42.1 pt -136.09 -174.35 1.08 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 C-N-CA 124.928 1.291 . . . . 0.0 108.84 -179.558 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 22.0 p -87.45 152.3 22.34 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 120.911 0.386 . . . . 0.0 110.02 169.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.772 HD13 ' SG ' ' A' ' 11' ' ' CYS . 8.0 tt -66.26 -27.34 67.87 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.905 178.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.594 ' HG2' ' HE3' ' A' ' 90' ' ' LYS . 35.6 tt0 -63.76 -43.45 96.39 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.461 0.705 . . . . 0.0 110.719 173.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -61.61 -31.64 71.72 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.577 0.751 . . . . 0.0 110.818 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.02 -33.17 75.4 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.664 0.785 . . . . 0.0 112.433 177.159 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 86.0 mt -79.03 -46.79 23.44 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.846 0 C-N-CA 123.634 0.773 . . . . 0.0 110.524 -177.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.594 ' HE3' ' HG2' ' A' ' 86' ' ' GLN . 18.6 ptpt -81.9 -43.04 18.69 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.114 0.566 . . . . 0.0 111.994 -174.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 62.9 t30 -113.77 28.49 8.72 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.762 0.825 . . . . 0.0 110.907 -169.022 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.563 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -45.02 -62.1 1.37 Allowed 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -175.562 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.56 -36.51 82.9 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.056 -0.974 . . . . 0.0 110.913 -179.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -61.1 -48.54 85.45 Favored Glycine 0 C--N 1.354 1.569 0 O-C-N 124.616 1.198 . . . . 0.0 112.752 -178.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 22.5 mt -55.74 -56.77 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.169 0.988 . . . . 0.0 110.245 178.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.425 HG23 ' OH ' ' A' ' 34' ' ' TYR . 1.7 mp -55.75 -50.91 64.85 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.048 0 O-C-N 124.247 0.967 . . . . 0.0 111.71 -177.342 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -32.19 73.14 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 112.041 0.386 . . . . 0.0 112.041 -176.577 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -64.81 -39.02 92.9 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 123.7 0.625 . . . . 0.0 109.734 178.234 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.584 HG21 HG23 ' A' ' 60' ' ' ILE . 53.2 mt -73.14 -39.07 56.32 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.983 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -56.7 -48.99 76.47 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.973 0.909 . . . . 0.0 111.243 178.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -74.66 -32.35 62.21 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 123.631 0.582 . . . . 0.0 111.483 -175.282 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 69.3 mtm -66.02 -47.75 73.39 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 122.582 0.353 . . . . 0.0 110.688 175.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 30.5 mt -68.02 -39.18 81.09 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.411 179.103 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.15 -28.65 69.56 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.045 0.538 . . . . 0.0 111.083 177.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 18.2 t -74.15 -43.27 58.05 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 123.155 0.582 . . . . 0.0 110.949 -178.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -76.63 -34.88 58.32 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 122.93 0.492 . . . . 0.0 111.513 -179.144 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -75.85 -24.1 55.76 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 122.966 0.507 . . . . 0.0 111.574 -178.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 32.3 mm-40 . . . . . 0 N--CA 1.478 0.964 0 CA-C-O 118.458 -0.782 . . . . 0.0 109.789 177.608 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 43.9 pttt . . . . . 0 N--CA 1.471 0.577 0 CA-C-O 120.676 0.275 . . . . 0.0 110.607 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.596 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.1 tmtp? -141.25 137.37 32.49 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 -170.187 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.477 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 10.2 tt -130.01 130.32 44.84 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 178.381 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.5 HD12 HD13 ' A' ' 50' ' ' LEU . 14.2 pt -121.34 165.61 16.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 172.589 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.599 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -152.09 169.15 23.11 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.641 176.51 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.9 tt -141.45 115.46 9.25 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.528 ' HA ' ' O ' ' A' ' 64' ' ' SER . 62.1 m -107.24 111.61 24.09 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 177.68 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.449 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -125.69 112.66 16.37 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 122.474 0.31 . . . . 0.0 111.106 -175.181 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.521 ' HB2' HD13 ' A' ' 85' ' ' LEU . 36.0 t -127.43 136.2 28.58 Favored Pre-proline 0 N--CA 1.473 0.693 0 C-N-CA 123.791 0.836 . . . . 0.0 110.442 -179.261 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -76.07 -19.48 15.65 Favored 'Trans proline' 0 C--N 1.365 1.447 0 C-N-CA 122.972 2.448 . . . . 0.0 112.791 177.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.447 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 21.7 mmt -71.89 -31.94 66.93 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.513 0.725 . . . . 0.0 110.663 -178.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 149.24 175.67 21.82 Favored Glycine 0 C--N 1.348 1.216 0 CA-C-N 115.789 -0.642 . . . . 0.0 112.675 177.198 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.6 mt -73.67 -19.57 60.79 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.582 0.753 . . . . 0.0 112.509 -179.395 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.04 -44.09 87.2 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-O 121.189 0.518 . . . . 0.0 111.325 177.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 11.9 t-160 -66.69 -41.51 87.93 Favored 'General case' 0 C--O 1.247 0.923 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.275 179.075 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 34.2 p -66.77 -32.78 74.29 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.99 -178.595 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.6 m-30 -69.49 -31.63 70.01 Favored 'General case' 0 C--N 1.354 0.772 0 C-N-CA 123.246 0.618 . . . . 0.0 111.25 178.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 64.5 mtm -67.01 -41.15 87.14 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-O 120.639 0.257 . . . . 0.0 110.901 175.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.14 -44.55 83.88 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.065 174.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.13 -41.28 97.27 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.954 0.901 . . . . 0.0 110.895 -177.415 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -57.17 -54.75 43.21 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.981 0.912 . . . . 0.0 109.949 177.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.06 -42.87 93.79 Favored 'General case' 0 CA--C 1.553 1.06 0 CA-C-N 114.953 -1.021 . . . . 0.0 111.99 -174.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.424 HD11 ' OG ' ' A' ' 64' ' ' SER . 89.2 mt -68.11 -35.77 78.68 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 123.13 0.572 . . . . 0.0 111.265 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.558 ' HA ' HG21 ' A' ' 36' ' ' VAL . 35.6 tt0 -62.19 -53.0 61.56 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 123.837 0.71 . . . . 0.0 109.725 -178.455 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.447 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 45.3 mt-10 -54.59 -46.77 73.82 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 114.547 -1.206 . . . . 0.0 110.402 179.442 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.58 -52.12 67.03 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.323 1.049 . . . . 0.0 111.729 -178.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.94 -24.31 67.48 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 178.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 26' ' ' GLU . 50.5 t -77.09 -42.35 31.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.414 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 19.6 mm-40 -66.67 -28.39 68.42 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 114.604 -1.18 . . . . 0.0 110.344 175.24 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -80.18 -25.08 39.89 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.211 1.005 . . . . 0.0 111.923 176.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.96 32.74 7.74 Favored Glycine 0 C--N 1.344 0.999 0 N-CA-C 114.264 0.466 . . . . 0.0 114.264 170.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -102.4 163.48 12.21 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 117.36 0.58 . . . . 0.0 109.592 168.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.596 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 41.0 tt0 -73.66 124.97 26.99 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 106.502 -1.666 . . . . 0.0 106.502 158.509 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.558 HG21 ' HA ' ' A' ' 26' ' ' GLU . 13.5 p -111.27 137.32 44.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 CA-C-N 118.635 0.652 . . . . 0.0 110.72 -174.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 45.0 tptt -148.21 111.77 5.02 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 178.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.599 HG12 ' HB3' ' A' ' 7' ' ' ALA . 48.9 mt -116.94 110.63 31.98 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 122.602 0.361 . . . . 0.0 111.891 -173.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -77.92 115.25 17.52 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 123.238 0.615 . . . . 0.0 109.658 176.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 7.0 p -95.76 108.09 20.38 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.938 177.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.54 ' HG2' HG12 ' A' ' 46' ' ' ILE . 42.2 mt-30 -100.97 154.02 19.04 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.256 0.623 . . . . 0.0 110.679 176.2 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -171.08 -178.39 41.56 Favored Glycine 0 C--O 1.238 0.379 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.617 178.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.34 -26.05 66.3 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.089 0.556 . . . . 0.0 111.327 178.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -65.8 -39.41 90.91 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.495 0.718 . . . . 0.0 110.117 171.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 142.18 -151.99 23.32 Favored Glycine 0 C--N 1.341 0.852 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.969 -178.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.54 HG12 ' HG2' ' A' ' 41' ' ' GLN . 65.2 mt -113.21 145.25 19.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 123.683 0.793 . . . . 0.0 110.067 -174.112 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -140.01 149.28 43.02 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.865 0.866 . . . . 0.0 110.137 -179.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 44.1 t30 79.1 -49.94 0.43 Allowed 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 126.487 1.915 . . . . 0.0 110.043 178.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 21.7 tpp180 66.86 122.82 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.869 1.667 . . . . 0.0 113.339 169.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.5 HD13 HD12 ' A' ' 6' ' ' ILE . 39.4 mt -92.31 146.41 23.72 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 114.772 -1.104 . . . . 0.0 110.55 172.481 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.42 ' O ' HG13 ' A' ' 55' ' ' ILE . 66.4 p -105.12 166.63 10.26 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.744 0.818 . . . . 0.0 109.693 176.478 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.06 -29.49 69.77 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 122.931 0.492 . . . . 0.0 110.562 176.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -72.27 -41.14 67.06 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.43 177.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -59.5 -43.49 93.34 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 122.836 0.454 . . . . 0.0 110.927 177.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.663 HG22 ' HG3' ' A' ' 78' ' ' ARG . 23.1 mt -74.38 -32.32 30.62 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 O-C-N 123.961 0.788 . . . . 0.0 110.891 -176.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.57 -41.5 62.83 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.434 0.694 . . . . 0.0 111.619 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -91.27 -3.04 57.26 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.554 0.742 . . . . 0.0 111.398 -177.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.55 106.22 1.11 Allowed 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 122.948 0.499 . . . . 0.0 110.437 176.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 27.7 m -60.26 -36.92 78.9 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.846 0.858 . . . . 0.0 109.44 169.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 72.8 mt -137.27 143.35 34.68 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 123.904 0.882 . . . . 0.0 110.315 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.498 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 26.3 mt -127.81 135.64 62.48 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 171.46 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -124.12 111.16 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 CA-C-N 118.405 0.548 . . . . 0.0 109.526 173.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 12.1 m170 -88.24 85.28 6.89 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-O 121.586 0.708 . . . . 0.0 109.524 174.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.528 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 25.0 m -81.01 82.64 6.92 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.542 176.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 29.5 m -125.93 155.78 35.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 CA-C-O 121.965 0.888 . . . . 0.0 112.209 -170.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -107.87 -25.07 11.39 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 113.91 -1.496 . . . . 0.0 109.365 175.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 15.0 m -131.4 171.15 18.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 125.328 1.451 . . . . 0.0 108.664 176.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 22.1 m -64.72 116.87 32.85 Favored Pre-proline 0 CA--C 1.55 0.974 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 171.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.43 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 37.0 Cg_endo -66.71 145.56 75.91 Favored 'Trans proline' 0 C--N 1.372 1.773 0 C-N-CA 121.506 1.471 . . . . 0.0 110.388 174.393 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.451 ' HB2' HE22 ' A' ' 41' ' ' GLN . 42.2 mm-40 -64.52 -28.98 70.02 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.241 0.616 . . . . 0.0 111.406 -176.138 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.601 ' HB3' HH11 ' A' ' 74' ' ' ARG . 0.9 OUTLIER -103.17 18.24 22.19 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.468 1.107 . . . . 0.0 111.616 -173.901 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.43 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 6.7 p30 -56.65 -32.4 65.32 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 124.385 1.074 . . . . 0.0 113.018 -175.274 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.46 ' HA ' ' HB2' ' A' ' 76' ' ' GLU . 2.1 pp20? -76.38 -18.16 59.01 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.704 0.802 . . . . 0.0 112.515 -171.17 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.601 HH11 ' HB3' ' A' ' 71' ' ' ASP . 41.0 mtp180 -67.4 -26.68 66.55 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.018 0.927 . . . . 0.0 111.312 174.063 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -104.01 -4.36 23.43 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 114.463 -1.244 . . . . 0.0 111.017 -176.042 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.46 ' HB2' ' HA ' ' A' ' 73' ' ' GLU . 37.9 tt0 -61.96 -32.2 72.61 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 124.579 1.152 . . . . 0.0 112.474 -173.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 32.0 t -92.13 3.91 54.29 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.392 0.677 . . . . 0.0 111.836 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.663 ' HG3' HG22 ' A' ' 55' ' ' ILE . 39.8 mmt180 -117.61 166.3 12.56 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.718 0.807 . . . . 0.0 111.446 -177.036 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -79.35 94.24 5.46 Favored 'General case' 0 C--O 1.244 0.789 0 C-N-CA 123.675 0.79 . . . . 0.0 110.673 -177.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.498 ' HA ' ' HB ' ' A' ' 61' ' ' ILE . 60.8 t -104.97 141.35 20.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 124.151 0.98 . . . . 0.0 110.727 -178.369 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -114.52 88.71 2.92 Favored 'General case' 0 C--O 1.24 0.553 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 174.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -84.59 120.97 26.97 Favored 'General case' 0 C--N 1.346 0.442 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.363 -174.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.434 HD12 ' HB3' ' A' ' 87' ' ' ASP . 48.5 pt -125.24 -179.33 2.35 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 124.434 1.094 . . . . 0.0 109.466 177.491 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 24.1 p -76.83 148.22 36.68 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.533 168.464 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.521 HD13 ' HB2' ' A' ' 11' ' ' CYS . 4.7 tt -62.51 -28.64 69.98 Favored 'General case' 0 N--CA 1.481 1.098 0 O-C-N 124.046 0.841 . . . . 0.0 111.27 179.47 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -64.3 -44.92 90.14 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.285 0.634 . . . . 0.0 111.266 176.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.434 ' HB3' HD12 ' A' ' 83' ' ' ILE . 24.3 t70 -59.98 -31.47 69.94 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.542 0.737 . . . . 0.0 110.649 -177.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.19 -26.61 64.92 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.943 0.897 . . . . 0.0 112.922 179.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 57.0 mt -85.24 -40.1 14.55 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.964 0 C-N-CA 123.111 0.564 . . . . 0.0 110.459 -179.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.44 -56.1 3.45 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 122.793 0.437 . . . . 0.0 111.795 -176.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -95.46 20.53 9.35 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.843 0.857 . . . . 0.0 110.959 -170.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.508 ' HA ' HD12 ' A' ' 95' ' ' ILE . . . -43.22 -62.34 1.08 Allowed 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 124.607 1.163 . . . . 0.0 114.132 -172.575 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.21 -34.59 75.35 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.028 178.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.07 -43.04 99.38 Favored Glycine 0 C--N 1.351 1.407 0 O-C-N 124.495 1.122 . . . . 0.0 112.758 178.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.508 HD12 ' HA ' ' A' ' 92' ' ' ALA . 22.2 mt -62.37 -57.96 9.71 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 C-N-CA 124.185 0.994 . . . . 0.0 109.973 -177.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.43 HG13 HD11 ' A' ' 5' ' ' LEU . 2.0 mp -58.4 -45.71 89.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 O-C-N 124.093 0.87 . . . . 0.0 110.608 -175.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 2.5 pptp? -69.72 -27.62 65.13 Favored 'General case' 0 N--CA 1.48 1.047 0 O-C-N 123.605 0.565 . . . . 0.0 111.556 -177.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 38.9 mm-40 -62.91 -42.55 99.83 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 174.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 13.1 mt -78.43 -33.36 17.22 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.387 -175.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -54.79 -53.69 51.87 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.604 1.162 . . . . 0.0 111.281 171.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -72.16 -33.77 67.97 Favored 'General case' 0 N--CA 1.48 1.064 0 O-C-N 123.594 0.559 . . . . 0.0 111.25 -175.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 71.1 mtm -64.29 -49.3 72.34 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 122.937 0.495 . . . . 0.0 110.592 177.134 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 36.8 mt -67.05 -42.16 88.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 C-N-CA 123.232 0.613 . . . . 0.0 110.302 177.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.88 -12.56 61.61 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 122.925 0.49 . . . . 0.0 111.843 -179.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 29.9 t -92.4 -39.71 11.28 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 122.609 0.364 . . . . 0.0 110.804 176.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -78.71 -28.18 45.07 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.757 0.423 . . . . 0.0 111.458 -177.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.7 mm-40 -84.35 -41.33 16.87 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.175 0.59 . . . . 0.0 109.876 178.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 76.3 mm-40 . . . . . 0 C--O 1.255 1.35 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.632 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.63 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 13.4 pttt . . . . . 0 C--O 1.247 0.962 0 CA-C-O 121.291 0.567 . . . . 0.0 111.179 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.514 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.2 tmtp? -142.96 142.48 31.66 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 121.102 0.477 . . . . 0.0 109.81 -171.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.474 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.0 tt -131.34 136.17 47.86 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 176.084 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.411 HG22 ' HE2' ' A' ' 4' ' ' LYS . 17.1 pt -126.72 159.1 36.76 Favored 'Isoleucine or valine' 0 C--O 1.239 0.509 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 170.306 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.619 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -145.28 168.91 19.32 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 176.534 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.427 HD21 ' OE1' ' A' ' 41' ' ' GLN . 4.3 tt -144.88 112.09 6.02 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 -176.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.522 ' HA ' ' O ' ' A' ' 64' ' ' SER . 49.9 m -101.25 109.65 21.54 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.068 0.947 . . . . 0.0 109.12 176.385 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.42 ' HB3' HG12 ' A' ' 65' ' ' VAL . . . -127.47 115.81 19.46 Favored 'General case' 0 N--CA 1.489 1.513 0 CA-C-O 120.839 0.352 . . . . 0.0 110.674 -178.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.559 ' HB2' HD13 ' A' ' 85' ' ' LEU . 44.0 t -123.43 142.93 40.06 Favored Pre-proline 0 N--CA 1.476 0.855 0 C-N-CA 123.926 0.89 . . . . 0.0 110.247 -176.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -72.58 -16.64 26.97 Favored 'Trans proline' 0 C--N 1.37 1.687 0 C-N-CA 122.938 2.425 . . . . 0.0 113.093 174.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 82.8 mtp -72.67 -54.91 7.72 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.393 0.677 . . . . 0.0 111.078 -179.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.413 ' HA2' ' H ' ' A' ' 43' ' ' ALA . . . 161.3 -177.76 37.5 Favored Glycine 0 C--N 1.342 0.875 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.845 -175.713 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 39.9 mt -75.19 -14.44 60.54 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -177.399 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.41 -49.73 76.42 Favored 'General case' 0 C--O 1.249 1.066 0 CA-C-O 121.337 0.589 . . . . 0.0 111.086 177.168 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.402 ' ND1' HD22 ' A' ' 85' ' ' LEU . 5.8 t-160 -64.98 -40.24 94.67 Favored 'General case' 0 C--O 1.248 1.004 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.224 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 32.7 p -67.3 -36.43 81.49 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.307 -178.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.8 m-30 -69.26 -32.84 72.31 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.127 0.571 . . . . 0.0 111.453 -178.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 62.5 mtm -67.93 -38.2 82.58 Favored 'General case' 0 N--CA 1.483 1.175 0 O-C-N 123.175 0.297 . . . . 0.0 110.81 175.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -69.7 -40.53 76.26 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.364 174.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.7 -37.1 81.81 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.899 0.88 . . . . 0.0 110.562 -178.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.477 ' O ' ' HG3' ' A' ' 27' ' ' GLU . 32.6 tt0 -62.52 -53.01 61.14 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.846 175.661 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.45 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -64.75 -47.5 77.98 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 115.587 -0.733 . . . . 0.0 112.183 -173.074 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 85.1 mt -64.43 -34.46 78.25 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.07 0.548 . . . . 0.0 111.431 178.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.505 ' O ' HG23 ' A' ' 30' ' ' VAL . 38.3 tt0 -61.92 -54.76 37.5 Favored 'General case' 0 C--N 1.349 0.578 0 O-C-N 123.686 0.616 . . . . 0.0 109.894 177.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.567 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 44.9 mt-10 -49.42 -52.12 30.78 Favored 'General case' 0 N--CA 1.48 1.048 0 O-C-N 124.632 1.207 . . . . 0.0 110.73 179.54 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.417 ' HB1' ' HA ' ' A' ' 93' ' ' ALA . . . -56.18 -52.05 65.81 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.807 1.243 . . . . 0.0 112.098 -179.664 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.38 -22.52 66.25 Favored 'General case' 0 CA--C 1.55 0.947 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 179.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 26' ' ' GLU . 55.8 t -76.25 -37.5 32.08 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.256 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 178.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.567 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 16.2 mm-40 -76.48 -19.89 57.55 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 114.725 -1.125 . . . . 0.0 110.475 178.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -78.44 -19.0 54.11 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.672 0.789 . . . . 0.0 111.198 172.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 97.01 1.24 59.75 Favored Glycine 0 C--N 1.349 1.263 0 N-CA-C 115.2 0.84 . . . . 0.0 115.2 165.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.63 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -108.24 173.58 6.26 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-N 117.85 0.825 . . . . 0.0 112.089 176.255 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.514 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 34.2 tt0 -71.07 145.91 49.6 Favored 'General case' 0 C--N 1.35 0.612 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.656 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.493 HG21 ' HA ' ' A' ' 26' ' ' GLU . 7.4 p -135.34 128.64 48.72 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 122.741 0.416 . . . . 0.0 111.165 -179.566 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.5 tptt -135.75 115.55 13.02 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 176.44 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.619 HG12 ' HB3' ' A' ' 7' ' ' ALA . 49.3 mt -117.09 113.42 42.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 N-CA-C 111.995 0.369 . . . . 0.0 111.995 -176.16 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -75.62 147.81 39.25 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.894 0.878 . . . . 0.0 109.221 171.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.443 HG22 ' HB2' ' A' ' 9' ' ' CYS . 13.6 p -134.57 123.93 24.65 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.156 0.983 . . . . 0.0 109.208 -176.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.469 ' HG2' HG23 ' A' ' 46' ' ' ILE . 23.7 mt-30 -125.62 136.5 53.33 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 -176.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -163.59 -160.42 11.58 Favored Glycine 0 N--CA 1.465 0.605 0 C-N-CA 121.851 -0.214 . . . . 0.0 112.677 -179.1 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.413 ' H ' ' HA2' ' A' ' 14' ' ' GLY . . . -60.91 -28.77 69.16 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.957 0.903 . . . . 0.0 111.787 177.235 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -86.27 2.35 47.54 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.021 0.928 . . . . 0.0 111.51 -178.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 94.22 -157.48 22.65 Favored Glycine 0 C--N 1.34 0.773 0 N-CA-C 112.134 -0.386 . . . . 0.0 112.134 -176.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.469 HG23 ' HG2' ' A' ' 41' ' ' GLN . 40.8 mt -106.44 144.86 14.94 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 C-N-CA 123.601 0.76 . . . . 0.0 110.306 -172.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -143.02 148.12 36.23 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.005 1.322 . . . . 0.0 108.822 -174.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 10.1 t30 58.86 40.96 22.14 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 124.362 1.065 . . . . 0.0 110.517 175.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 9.5 tpp180 -47.35 133.28 12.62 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.763 1.625 . . . . 0.0 113.069 -172.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 47.5 mt -83.35 126.75 33.03 Favored 'General case' 0 C--O 1.242 0.693 0 C-N-CA 123.879 0.872 . . . . 0.0 110.383 173.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.408 ' O ' HG13 ' A' ' 55' ' ' ILE . 37.0 p -88.79 164.5 15.21 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.664 178.323 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.74 -30.37 67.45 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.148 0.579 . . . . 0.0 110.963 175.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.405 ' O ' ' HG3' ' A' ' 57' ' ' GLU . 29.2 tt0 -66.91 -48.48 68.57 Favored 'General case' 0 C--N 1.355 0.819 0 C-N-CA 122.972 0.509 . . . . 0.0 110.57 175.36 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -50.84 -44.96 59.47 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 123.504 0.721 . . . . 0.0 111.355 177.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.408 HG13 ' O ' ' A' ' 51' ' ' THR . 26.4 mt -72.5 -35.68 51.99 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.051 0 CA-C-N 114.449 -1.25 . . . . 0.0 111.107 -177.152 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.45 -37.17 77.22 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.49 0.716 . . . . 0.0 111.172 179.41 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.405 ' HG3' ' O ' ' A' ' 53' ' ' GLN . 57.6 mt-10 -75.13 -33.46 61.57 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.746 0.818 . . . . 0.0 110.773 177.723 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -54.93 99.81 0.03 OUTLIER 'General case' 0 C--N 1.355 0.81 0 O-C-N 124.699 1.249 . . . . 0.0 112.315 -172.315 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 23.8 m -63.19 -32.9 74.4 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-N 114.531 -1.213 . . . . 0.0 109.241 168.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.481 HG23 HG21 ' A' ' 99' ' ' ILE . 81.5 mt -133.71 139.04 49.6 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 C-N-CA 124.367 1.067 . . . . 0.0 109.827 -179.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.6 mt -131.39 130.55 62.94 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 173.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.3 mp -116.25 126.09 73.58 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 172.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 14.8 m170 -99.98 86.09 3.19 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 167.271 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.522 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 20.0 p -80.41 81.87 6.57 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 114.633 -1.167 . . . . 0.0 108.94 174.363 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.42 HG12 ' HB3' ' A' ' 10' ' ' ALA . 29.8 m -129.87 165.05 30.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.225 -170.377 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -121.98 -14.83 7.95 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.445 1.098 . . . . 0.0 109.318 170.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 9.4 m -127.97 177.05 6.45 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 125.013 1.325 . . . . 0.0 109.516 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 37.2 m -75.9 118.47 71.34 Favored Pre-proline 0 CA--C 1.545 0.75 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 173.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.54 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 48.4 Cg_endo -65.97 146.81 83.63 Favored 'Trans proline' 0 C--N 1.373 1.82 0 C-N-CA 122.141 1.894 . . . . 0.0 111.18 175.239 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -65.33 -41.06 94.36 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.341 0.657 . . . . 0.0 110.624 -177.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -88.39 15.2 8.14 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 115.349 -0.841 . . . . 0.0 112.146 -175.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.54 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 6.0 p30 -55.69 -28.62 56.56 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 123.859 0.864 . . . . 0.0 112.041 -177.144 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.563 ' HG3' ' HG3' ' A' ' 74' ' ' ARG . 8.9 pt-20 -56.53 -37.22 70.18 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 124.694 1.198 . . . . 0.0 112.343 175.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.563 ' HG3' ' HG3' ' A' ' 73' ' ' GLU . 81.4 mtt85 -80.11 -17.05 53.61 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.815 1.246 . . . . 0.0 112.079 -176.713 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.517 ' HB3' HG21 ' A' ' 80' ' ' VAL . 66.6 m-85 -107.4 -2.68 20.31 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.574 0.749 . . . . 0.0 110.999 178.041 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -55.06 -49.04 72.62 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.494 1.118 . . . . 0.0 112.663 -172.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 81.0 p -91.6 0.51 57.49 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.127 0.571 . . . . 0.0 112.379 -176.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -104.62 161.52 14.06 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.276 0.63 . . . . 0.0 111.202 -170.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 -72.67 93.57 1.65 Allowed 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.355 0.662 . . . . 0.0 110.929 -175.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.517 HG21 ' HB3' ' A' ' 75' ' ' PHE . 44.2 t -116.85 133.01 64.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 123.206 0.602 . . . . 0.0 110.86 -175.077 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 66.1 m-85 -105.84 91.3 3.69 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.776 1.23 . . . . 0.0 108.553 177.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -78.88 110.12 13.78 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.611 0.764 . . . . 0.0 110.87 -175.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.445 HG13 ' HA ' ' A' ' 64' ' ' SER . 42.1 pt -117.31 -173.78 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 124.471 1.109 . . . . 0.0 109.561 176.043 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 40.4 p -86.8 149.73 24.64 Favored 'General case' 0 C--O 1.239 0.539 0 CA-C-O 121.071 0.462 . . . . 0.0 110.376 170.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.559 HD13 ' HB2' ' A' ' 11' ' ' CYS . 7.2 tt -64.52 -30.61 71.64 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.779 177.149 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -64.47 -43.79 93.1 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.879 176.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -63.74 -28.84 70.16 Favored 'General case' 0 N--CA 1.479 1.015 0 O-C-N 123.516 0.51 . . . . 0.0 110.629 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.1 -32.89 74.82 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.739 0.816 . . . . 0.0 112.292 177.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 64.6 mt -79.96 -42.69 22.28 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.835 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.414 -177.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -85.85 -47.34 9.77 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -175.086 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -106.15 25.45 10.98 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 124.081 0.952 . . . . 0.0 110.736 -170.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.45 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -41.92 -60.79 1.29 Allowed 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 124.253 1.021 . . . . 0.0 113.372 -175.144 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.417 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . . . -65.0 -34.1 77.64 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.602 -178.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.69 -45.8 93.6 Favored Glycine 0 C--N 1.346 1.103 0 O-C-N 124.183 0.927 . . . . 0.0 112.253 -178.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 22.6 mt -60.1 -57.09 13.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 124.445 1.098 . . . . 0.0 110.266 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.9 mp -56.42 -50.05 74.24 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 O-C-N 123.945 0.778 . . . . 0.0 110.846 -178.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.87 -27.98 67.14 Favored 'General case' 0 N--CA 1.485 1.298 0 O-C-N 123.389 0.431 . . . . 0.0 111.304 -176.245 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.419 ' O ' ' HG3' ' A' ' 102' ' ' MET . 48.4 mm-40 -65.65 -40.78 92.82 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.316 0.646 . . . . 0.0 109.896 175.365 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.481 HG21 HG23 ' A' ' 60' ' ' ILE . 32.7 mt -75.83 -34.05 27.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 N-CA-C 109.152 -0.685 . . . . 0.0 109.152 -176.815 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -60.54 -50.34 73.92 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 114.419 -1.264 . . . . 0.0 111.147 174.249 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -72.19 -33.3 67.55 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 122.751 0.42 . . . . 0.0 110.969 -176.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.419 ' HG3' ' O ' ' A' ' 98' ' ' GLU . 69.3 mtm -63.63 -58.2 7.69 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 122.751 0.42 . . . . 0.0 110.148 177.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 63.4 mt -62.38 -41.29 91.17 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.929 0 O-C-N 123.893 0.746 . . . . 0.0 110.587 -179.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.22 -32.52 74.24 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 122.541 0.337 . . . . 0.0 111.562 179.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 38.5 t -73.52 -37.43 65.65 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-O 120.887 0.375 . . . . 0.0 110.717 -176.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -85.16 -25.77 27.23 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.808 -177.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -85.6 -40.17 16.53 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 122.811 0.444 . . . . 0.0 111.516 178.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 81.8 mm-40 . . . . . 0 CA--C 1.55 0.978 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 174.943 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.6 pttt . . . . . 0 N--CA 1.484 1.251 0 CA-C-O 121.078 0.466 . . . . 0.0 110.782 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.534 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 3.8 tmtp? -144.03 143.67 31.29 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -173.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.483 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.0 tt -134.56 142.18 46.9 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 177.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.416 HD13 ' HA ' ' A' ' 55' ' ' ILE . 21.6 pt -133.39 168.43 24.13 Favored 'Isoleucine or valine' 0 C--O 1.243 0.742 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 170.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.622 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -152.3 169.99 21.15 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.342 175.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.4 tt -140.24 112.19 7.57 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 106.811 -1.551 . . . . 0.0 106.811 178.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.529 ' HB2' HG22 ' A' ' 40' ' ' THR . 68.9 m -102.05 109.35 21.04 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 177.263 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.447 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -128.71 113.79 15.81 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 122.759 0.424 . . . . 0.0 111.273 -176.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.74 ' SG ' HD13 ' A' ' 85' ' ' LEU . 2.2 m -130.98 146.61 62.9 Favored Pre-proline 0 N--CA 1.474 0.727 0 C-N-CA 123.481 0.712 . . . . 0.0 110.111 174.038 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -88.39 15.76 2.01 Favored 'Trans proline' 0 C--N 1.37 1.694 0 C-N-CA 123.331 2.688 . . . . 0.0 111.427 175.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 16.9 tpt -138.27 76.13 1.56 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.455 1.102 . . . . 0.0 109.16 178.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.77 132.31 4.25 Favored Glycine 0 C--N 1.34 0.802 0 CA-C-N 115.123 -0.944 . . . . 0.0 114.186 167.25 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 22.4 mt -66.39 -22.45 66.24 Favored 'General case' 0 C--O 1.216 -0.707 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 163.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.21 -40.09 73.48 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.316 0.646 . . . . 0.0 110.921 171.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.496 ' ND1' HD22 ' A' ' 85' ' ' LEU . 4.5 t-80 -68.99 -45.13 71.39 Favored 'General case' 0 C--O 1.245 0.865 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 178.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 35.5 p -66.19 -30.0 70.38 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.798 -178.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -80.12 -27.21 39.18 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.181 0.593 . . . . 0.0 111.418 -178.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 66.6 mtm -66.7 -38.72 87.32 Favored 'General case' 0 N--CA 1.482 1.142 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 171.098 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -72.55 -40.15 66.92 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.518 176.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.61 -51.58 58.54 Favored 'General case' 0 C--O 1.217 -0.635 0 C-N-CA 123.851 0.86 . . . . 0.0 109.979 -177.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.483 HE21 ' HG2' ' A' ' 27' ' ' GLU . 23.8 tp60 -62.81 -38.89 92.49 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 123.766 0.666 . . . . 0.0 110.52 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.584 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -62.42 -53.43 54.94 Favored 'General case' 0 CA--C 1.551 1.013 0 O-C-N 123.642 0.589 . . . . 0.0 111.419 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 93.4 mt -66.47 -29.86 70.07 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 123.491 0.716 . . . . 0.0 111.295 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.557 ' HA ' HG21 ' A' ' 36' ' ' VAL . 38.4 tt0 -64.84 -54.73 26.51 Favored 'General case' 0 C--N 1.346 0.449 0 C-N-CA 123.581 0.753 . . . . 0.0 109.807 -179.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.492 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 12.7 mm-40 -55.21 -49.09 72.82 Favored 'General case' 0 N--CA 1.479 1.025 0 O-C-N 124.505 1.128 . . . . 0.0 110.355 178.64 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.78 -46.68 81.35 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.656 1.183 . . . . 0.0 111.795 -178.102 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.78 -28.96 68.05 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 115.147 -0.933 . . . . 0.0 112.681 177.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 26' ' ' GLU . 56.1 t -72.86 -37.35 54.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 179.148 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 9.1 mm-40 -72.21 -26.98 62.26 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.641 178.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.45 -32.85 72.05 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.294 0.638 . . . . 0.0 110.902 172.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 104.33 18.8 12.42 Favored Glycine 0 C--N 1.346 1.121 0 N-CA-C 114.606 0.602 . . . . 0.0 114.606 169.359 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -122.19 -179.85 4.3 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.174 0.59 . . . . 0.0 111.334 175.51 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.534 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 12.2 tp10 -73.31 152.53 40.91 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.093 178.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.557 HG21 ' HA ' ' A' ' 26' ' ' GLU . 7.3 p -142.45 128.41 17.81 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 C-N-CA 123.296 0.638 . . . . 0.0 110.796 178.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.8 tptt -136.87 114.82 11.4 Favored 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 176.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.622 HG12 ' HB3' ' A' ' 7' ' ' ALA . 50.6 mt -119.17 116.39 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 122.746 0.418 . . . . 0.0 111.786 -173.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -87.08 119.81 27.69 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.894 0.877 . . . . 0.0 110.024 175.467 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.529 HG22 ' HB2' ' A' ' 9' ' ' CYS . 26.7 p -99.71 109.21 21.68 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.679 0.792 . . . . 0.0 111.144 178.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.447 ' O ' ' HA ' ' A' ' 10' ' ' ALA . 46.4 mt-30 -96.93 139.4 33.02 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.425 0.69 . . . . 0.0 110.095 173.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -164.89 175.73 40.78 Favored Glycine 0 C--N 1.341 0.806 0 N-CA-C 111.882 -0.487 . . . . 0.0 111.882 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.85 -12.33 60.35 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 122.625 0.37 . . . . 0.0 111.504 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -77.71 -28.22 50.85 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.27 0.628 . . . . 0.0 110.147 171.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 143.26 -169.79 25.68 Favored Glycine 0 C--N 1.346 1.137 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.391 -177.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 64.5 mt -113.29 145.5 19.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 123.123 0.569 . . . . 0.0 109.465 176.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -142.86 151.31 40.94 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.349 0.659 . . . . 0.0 110.197 -176.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.432 ' HB3' ' O ' ' A' ' 38' ' ' ILE . 10.4 t30 58.74 45.88 15.05 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 125.017 1.327 . . . . 0.0 110.075 178.173 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.6 tpp180 -52.21 120.77 5.83 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.111 1.364 . . . . 0.0 112.16 -175.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 37.5 mt -64.11 146.12 54.75 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.276 1.03 . . . . 0.0 110.979 172.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 67.2 p -104.29 167.3 9.84 Favored 'General case' 0 C--O 1.244 0.77 0 C-N-CA 123.304 0.642 . . . . 0.0 110.145 175.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.99 -35.27 74.66 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.049 0.54 . . . . 0.0 110.321 174.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 -60.98 -51.84 67.54 Favored 'General case' 0 CA--C 1.546 0.81 0 CA-C-N 114.393 -1.276 . . . . 0.0 110.53 174.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 31.3 m-20 -53.67 -46.28 70.59 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 123.633 0.773 . . . . 0.0 112.261 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.556 HG22 ' HG3' ' A' ' 78' ' ' ARG . 23.0 mt -73.2 -31.01 32.81 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.078 0 O-C-N 123.834 0.708 . . . . 0.0 110.974 -175.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.64 -37.57 70.84 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.229 0.612 . . . . 0.0 111.103 177.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -77.33 -26.42 52.12 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.032 0.933 . . . . 0.0 111.118 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -56.93 99.65 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.063 0.945 . . . . 0.0 112.431 -175.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 27.4 m -63.56 -37.9 89.09 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 115.156 -0.929 . . . . 0.0 108.901 168.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.533 HG23 HG21 ' A' ' 99' ' ' ILE . 80.5 mt -128.45 140.71 48.48 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.767 179.369 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.447 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 33.2 mt -131.3 137.23 56.02 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 173.006 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.2 mp -123.29 112.84 35.2 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 173.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 9.9 m170 -89.91 84.03 6.19 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-O 121.815 0.817 . . . . 0.0 108.972 171.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.454 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 23.4 p -83.27 84.58 7.44 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 114.302 -1.317 . . . . 0.0 108.926 177.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.418 HG12 ' HB3' ' A' ' 10' ' ' ALA . 34.6 m -127.88 163.61 31.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 121.535 0.684 . . . . 0.0 111.988 -170.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -113.67 -28.78 7.34 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.761 1.224 . . . . 0.0 108.98 174.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 12.9 m -124.18 162.67 25.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 125.18 1.392 . . . . 0.0 108.591 176.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 55.4 m -68.67 116.52 41.56 Favored Pre-proline 0 CA--C 1.549 0.912 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 174.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.536 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 31.1 Cg_endo -64.35 150.43 88.29 Favored 'Trans proline' 0 C--N 1.375 1.97 0 C-N-CA 122.466 2.111 . . . . 0.0 112.081 178.346 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -67.45 -30.95 70.81 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.589 0.756 . . . . 0.0 110.261 178.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.508 ' HB3' ' HD3' ' A' ' 74' ' ' ARG . 3.8 m-20 -94.13 12.73 25.51 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 114.42 -1.264 . . . . 0.0 112.162 -174.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.536 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 59.5 t30 -60.22 -35.29 75.1 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.097 0.959 . . . . 0.0 112.471 -174.695 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.96 -17.86 62.04 Favored 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -175.651 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.508 ' HD3' ' HB3' ' A' ' 71' ' ' ASP . 58.3 mtp180 -64.41 -25.96 68.25 Favored 'General case' 0 N--CA 1.485 1.304 0 CA-C-O 121.427 0.632 . . . . 0.0 111.631 174.525 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -100.69 17.85 20.84 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.652 1.181 . . . . 0.0 110.556 -175.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -50.18 -52.09 38.39 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 125.356 1.462 . . . . 0.0 113.105 -174.223 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 21.6 t -99.41 5.62 46.27 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.409 0.683 . . . . 0.0 112.082 -171.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.556 ' HG3' HG22 ' A' ' 55' ' ' ILE . 34.7 mmt180 -106.18 145.78 31.09 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.473 0.709 . . . . 0.0 111.063 -173.34 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -68.65 99.58 1.02 Allowed 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.718 0.807 . . . . 0.0 110.923 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.447 ' HA ' ' HB ' ' A' ' 61' ' ' ILE . 57.5 t -109.69 128.25 65.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 123.515 0.726 . . . . 0.0 110.322 -178.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 73.3 m-85 -98.25 92.51 5.75 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 124.423 1.089 . . . . 0.0 108.16 174.363 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -85.76 129.86 34.71 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.473 -175.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.436 HG13 ' HA ' ' A' ' 64' ' ' SER . 41.7 pt -137.45 -172.78 0.78 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.844 0 C-N-CA 124.926 1.29 . . . . 0.0 108.86 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 26.2 p -84.98 149.98 25.23 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.061 0.458 . . . . 0.0 109.969 167.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.74 HD13 ' SG ' ' A' ' 11' ' ' CYS . 8.2 tt -65.42 -29.04 69.68 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.578 177.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.488 ' HG2' ' HE3' ' A' ' 90' ' ' LYS . 35.7 tt0 -59.99 -46.06 90.71 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.638 173.703 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -62.41 -32.67 73.54 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.327 0.651 . . . . 0.0 110.633 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.37 -32.64 74.12 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.584 0.754 . . . . 0.0 112.365 176.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 94.3 mt -78.21 -50.72 18.93 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 123.491 0.716 . . . . 0.0 110.713 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.488 ' HE3' ' HG2' ' A' ' 86' ' ' GLN . 18.6 ptpt -82.56 -33.36 28.14 Favored 'General case' 0 N--CA 1.484 1.26 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -172.126 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -120.5 22.99 11.06 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.896 0.879 . . . . 0.0 110.442 -168.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.584 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -42.33 -60.28 1.54 Allowed 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 124.353 1.061 . . . . 0.0 113.428 -174.575 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.42 -36.96 85.45 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.072 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -62.13 -47.55 89.06 Favored Glycine 0 C--N 1.355 1.618 0 O-C-N 124.479 1.112 . . . . 0.0 112.078 -177.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.402 ' O ' HG13 ' A' ' 99' ' ' ILE . 23.2 mt -55.79 -58.66 4.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 124.598 1.159 . . . . 0.0 110.333 177.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.8 mp -55.25 -51.3 57.14 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 O-C-N 124.246 0.966 . . . . 0.0 111.043 -177.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.74 -29.53 68.78 Favored 'General case' 0 N--CA 1.486 1.357 0 O-C-N 123.417 0.448 . . . . 0.0 112.163 -175.357 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 59.7 mm-40 -71.25 -32.41 68.72 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.153 0.581 . . . . 0.0 110.381 177.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.533 HG21 HG23 ' A' ' 60' ' ' ILE . 48.0 mt -78.22 -36.23 20.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -57.86 -48.48 79.66 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 114.446 -1.252 . . . . 0.0 111.275 177.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -74.22 -34.93 63.83 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 123.92 0.762 . . . . 0.0 111.44 -178.173 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 64.5 mtm -64.58 -50.82 65.74 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 122.679 0.392 . . . . 0.0 110.615 178.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 39.2 mt -66.41 -42.45 90.47 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.383 178.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.24 -28.23 69.21 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 117.683 0.22 . . . . 0.0 111.049 178.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 36.8 t -75.03 -41.52 59.1 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 122.044 -0.41 . . . . 0.0 110.364 -178.136 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -78.56 -34.77 46.77 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 122.84 0.456 . . . . 0.0 111.469 -177.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 14.3 mm-40 -82.67 -43.37 16.99 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.072 0.549 . . . . 0.0 111.81 -174.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 . . . . . 0 CA--C 1.554 1.112 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 177.546 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.524 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 4.7 pttt . . . . . 0 N--CA 1.49 1.543 0 CA-C-O 120.796 0.331 . . . . 0.0 110.669 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.529 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 5.0 tmtp? -143.71 144.2 31.75 Favored 'General case' 0 N--CA 1.481 1.091 0 CA-C-O 121.454 0.645 . . . . 0.0 110.66 -175.099 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.499 ' N ' ' HD3' ' A' ' 4' ' ' LYS . 8.8 tt -130.8 135.67 47.97 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 125.246 1.418 . . . . 0.0 107.902 175.04 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.439 HG13 HG23 ' A' ' 61' ' ' ILE . 20.3 pt -126.1 161.94 30.7 Favored 'Isoleucine or valine' 0 C--O 1.242 0.693 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 171.656 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.631 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -148.94 166.61 28.09 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 122.96 0.504 . . . . 0.0 110.015 175.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.467 HD21 ' HG3' ' A' ' 41' ' ' GLN . 4.1 tt -136.58 123.38 21.24 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 178.268 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.56 ' HA ' ' O ' ' A' ' 64' ' ' SER . 78.0 m -112.51 112.63 24.31 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 123.61 0.764 . . . . 0.0 109.244 177.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.428 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -126.27 120.74 30.74 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 122.855 0.462 . . . . 0.0 111.547 -176.51 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.801 ' SG ' HD13 ' A' ' 85' ' ' LEU . 1.4 m -127.31 144.64 51.45 Favored Pre-proline 0 N--CA 1.485 1.323 0 C-N-CA 123.957 0.903 . . . . 0.0 111.45 -178.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -74.53 -23.61 14.7 Favored 'Trans proline' 0 C--N 1.379 2.176 0 C-N-CA 122.869 2.379 . . . . 0.0 113.161 177.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 76.9 mtm -76.11 -41.28 50.72 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 173.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 138.08 -156.03 23.65 Favored Glycine 0 C--N 1.347 1.173 0 N-CA-C 114.675 0.63 . . . . 0.0 114.675 172.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.3 mt -75.18 -18.48 60.16 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 114.783 1.401 . . . . 0.0 114.783 -164.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.98 -48.65 80.82 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-O 121.466 0.65 . . . . 0.0 110.761 178.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -66.18 -39.25 89.57 Favored 'General case' 0 C--O 1.246 0.868 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.264 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.407 HG21 ' O ' ' A' ' 41' ' ' GLN . 40.8 p -67.89 -36.34 80.07 Favored 'General case' 0 C--N 1.349 0.581 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.444 -175.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -72.49 -25.24 61.34 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 123.389 0.43 . . . . 0.0 111.616 178.329 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 56.3 mtm -63.08 -45.44 92.11 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-O 120.87 0.367 . . . . 0.0 110.055 170.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -69.72 -38.07 76.78 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.423 177.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.94 -43.09 84.11 Favored 'General case' 0 C--O 1.216 -0.682 0 C-N-CA 123.599 0.76 . . . . 0.0 110.735 -177.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.411 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 8.4 tp-100 -66.06 -42.2 89.79 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.064 0.546 . . . . 0.0 110.23 -179.558 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.03 -49.61 67.11 Favored 'General case' 0 CA--C 1.556 1.179 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.988 -178.543 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.431 HD11 ' OG ' ' A' ' 64' ' ' SER . 86.6 mt -66.52 -32.6 74.05 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.184 0.594 . . . . 0.0 111.789 178.595 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.519 ' HA ' HG21 ' A' ' 36' ' ' VAL . 46.0 tt0 -59.89 -53.54 56.72 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 123.907 0.754 . . . . 0.0 109.686 179.069 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 23' ' ' GLN . 30.4 mm-40 -54.07 -52.4 61.06 Favored 'General case' 0 N--CA 1.477 0.888 0 O-C-N 124.719 1.262 . . . . 0.0 110.834 178.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.15 -45.84 79.5 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.515 1.126 . . . . 0.0 112.109 -177.247 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.21 -29.71 67.73 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 115.364 -0.834 . . . . 0.0 113.063 177.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.48 HG23 ' O ' ' A' ' 26' ' ' GLU . 52.2 t -72.63 -38.55 59.16 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -71.79 -23.35 61.56 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 114.548 -1.205 . . . . 0.0 111.061 178.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.49 -22.31 59.14 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.411 0.684 . . . . 0.0 111.657 176.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 105.06 0.34 41.49 Favored Glycine 0 C--N 1.352 1.423 0 CA-C-O 119.555 -0.581 . . . . 0.0 114.512 171.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.524 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.1 OUTLIER -113.38 -179.87 3.76 Favored 'General case' 0 N--CA 1.485 1.319 0 CA-C-N 117.642 0.721 . . . . 0.0 111.901 177.427 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.529 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 38.2 tt0 -79.06 152.76 30.68 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.053 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.519 HG21 ' HA ' ' A' ' 26' ' ' GLU . 11.0 p -132.18 141.68 44.74 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 123.647 0.779 . . . . 0.0 110.548 177.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 49.1 tptt -147.22 119.52 8.37 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 172.012 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.631 HG12 ' HB3' ' A' ' 7' ' ' ALA . 47.9 mt -120.74 112.45 36.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 C-N-CA 122.938 0.495 . . . . 0.0 111.954 -175.43 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 46.5 tt0 -80.98 117.13 21.33 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.467 0.707 . . . . 0.0 109.423 174.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.409 HG22 ' HB2' ' A' ' 9' ' ' CYS . 21.7 p -98.87 115.74 29.53 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.814 0.845 . . . . 0.0 110.177 178.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.467 ' HG3' HD21 ' A' ' 8' ' ' LEU . 11.0 mt-30 -108.64 151.43 26.15 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.414 0.686 . . . . 0.0 109.917 175.767 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -172.81 -177.14 41.93 Favored Glycine 0 C--N 1.337 0.596 0 CA-C-N 116.73 -0.214 . . . . 0.0 112.872 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.69 -19.23 65.14 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.637 0.775 . . . . 0.0 112.527 -179.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -79.61 -31.74 41.71 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.623 0.769 . . . . 0.0 110.775 174.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 143.18 -158.71 27.31 Favored Glycine 0 C--N 1.339 0.738 0 N-CA-C 111.184 -0.766 . . . . 0.0 111.184 -176.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.43 HG23 ' HG2' ' A' ' 41' ' ' GLN . 30.0 mt -117.62 154.99 19.47 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 123.031 0.532 . . . . 0.0 109.963 179.541 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -149.8 152.62 35.49 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.198 0.999 . . . . 0.0 109.937 -179.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 18.8 t30 60.99 42.02 13.26 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 124.72 1.208 . . . . 0.0 109.89 176.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 10.1 tpt180 -54.68 121.59 8.83 Favored 'General case' 0 C--N 1.356 0.853 0 C-N-CA 125.098 1.359 . . . . 0.0 112.157 -169.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 44.4 mt -67.31 144.27 55.96 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.805 0.842 . . . . 0.0 110.118 172.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.431 ' O ' HG13 ' A' ' 55' ' ' ILE . 31.6 p -111.53 172.46 6.88 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.822 0.849 . . . . 0.0 109.392 177.053 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.44 -30.07 68.23 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 122.862 0.465 . . . . 0.0 111.381 176.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -64.33 -47.54 79.01 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.827 0.851 . . . . 0.0 110.814 176.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -59.74 -45.04 93.44 Favored 'General case' 0 N--CA 1.48 1.041 0 O-C-N 123.858 0.724 . . . . 0.0 111.028 179.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.561 HG22 ' HG3' ' A' ' 78' ' ' ARG . 26.7 mt -73.23 -28.87 26.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 C-N-CA 123.671 0.788 . . . . 0.0 111.017 -176.125 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -74.74 -49.04 22.47 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.249 0.62 . . . . 0.0 111.13 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -81.16 -9.34 59.82 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.407 0.683 . . . . 0.0 111.753 -176.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.59 101.15 0.17 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.521 0.729 . . . . 0.0 111.299 179.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 24.0 m -61.53 -38.03 85.93 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 115.021 -0.99 . . . . 0.0 109.102 168.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.516 HG23 HG21 ' A' ' 99' ' ' ILE . 73.1 mt -130.32 140.4 48.95 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.767 0 CA-C-N 114.819 -1.082 . . . . 0.0 110.174 -179.316 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.439 HG23 HG13 ' A' ' 6' ' ' ILE . 20.5 mt -133.01 131.56 58.88 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 C-N-CA 123.685 0.794 . . . . 0.0 109.098 172.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.0 mp -119.84 134.77 62.3 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 173.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 7.5 m170 -109.35 85.43 2.1 Favored 'General case' 0 N--CA 1.487 1.419 0 CA-C-N 118.931 0.787 . . . . 0.0 109.339 168.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.56 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 19.4 m -77.78 82.11 4.18 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 114.288 -1.324 . . . . 0.0 109.595 175.011 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.404 ' O ' ' HA ' ' A' ' 84' ' ' THR . 21.6 m -127.26 152.67 35.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 121.47 0.652 . . . . 0.0 111.313 -172.426 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -103.13 -29.02 11.59 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.315 1.046 . . . . 0.0 108.936 174.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 16.4 m -133.9 163.35 37.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 125.479 1.512 . . . . 0.0 108.447 177.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 26.3 m -64.72 117.59 39.78 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 122.942 0.497 . . . . 0.0 110.618 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.437 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 37.9 Cg_endo -67.6 148.81 78.94 Favored 'Trans proline' 0 C--N 1.374 1.874 0 C-N-CA 122.149 1.9 . . . . 0.0 111.079 175.037 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -63.51 -33.12 74.88 Favored 'General case' 0 N--CA 1.483 1.223 0 CA-C-O 121.242 0.544 . . . . 0.0 110.572 -179.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.504 ' HB3' ' HD3' ' A' ' 74' ' ' ARG . 1.3 m-20 -94.9 16.23 16.58 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.322 1.049 . . . . 0.0 112.357 -174.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.437 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 5.1 p30 -60.37 -36.08 77.2 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.256 0.622 . . . . 0.0 112.403 -174.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.64 -21.15 63.57 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.761 0.824 . . . . 0.0 112.945 -174.12 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.504 ' HD3' ' HB3' ' A' ' 71' ' ' ASP . 77.1 mtp180 -62.66 -42.89 99.86 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-O 122.215 1.007 . . . . 0.0 110.286 174.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -89.91 -17.97 27.01 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 113.72 -1.582 . . . . 0.0 111.04 -172.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -63.5 -27.38 69.23 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.311 0.645 . . . . 0.0 110.488 178.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 45.1 t -62.89 -34.73 78.04 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 124.071 0.948 . . . . 0.0 111.554 172.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.561 ' HG3' HG22 ' A' ' 55' ' ' ILE . 20.7 mmt180 -95.39 -175.98 3.64 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.329 1.052 . . . . 0.0 111.62 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -94.44 120.29 34.45 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.576 0.751 . . . . 0.0 109.826 173.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 62.1 t -130.42 148.49 33.13 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.163 0 C-N-CA 124.213 1.005 . . . . 0.0 110.296 -174.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -107.68 90.89 3.44 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.02 0.928 . . . . 0.0 109.342 173.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -75.68 111.52 11.1 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.42 0.688 . . . . 0.0 110.362 178.28 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.462 HG13 ' HA ' ' A' ' 64' ' ' SER . 44.2 pt -119.36 -175.53 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 124.489 1.116 . . . . 0.0 109.16 175.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.404 ' HA ' ' O ' ' A' ' 65' ' ' VAL . 22.0 p -83.2 148.14 27.62 Favored 'General case' 0 C--O 1.238 0.455 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 168.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.801 HD13 ' SG ' ' A' ' 11' ' ' CYS . 5.8 tt -62.41 -26.9 68.73 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.665 0.786 . . . . 0.0 111.482 178.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.522 ' HG2' ' HE3' ' A' ' 90' ' ' LYS . 33.7 tt0 -67.04 -40.62 87.2 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 123.795 0.838 . . . . 0.0 111.171 175.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.432 ' HB3' HD12 ' A' ' 83' ' ' ILE . 22.8 t70 -61.52 -29.84 70.25 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.456 0.702 . . . . 0.0 111.067 178.495 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -70.31 -18.52 63.1 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.715 0.806 . . . . 0.0 112.998 178.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 66.2 mt -95.91 -40.58 10.94 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.826 0 C-N-CA 123.518 0.727 . . . . 0.0 110.392 -179.258 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.522 ' HE3' ' HG2' ' A' ' 86' ' ' GLN . 18.1 ptpt -88.67 -31.05 18.7 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.196 0.598 . . . . 0.0 112.361 -175.044 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . 0.509 HD22 HG13 ' A' ' 95' ' ' ILE . 6.0 t30 -126.58 26.78 6.23 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.374 0.669 . . . . 0.0 110.185 -170.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -49.15 -61.12 2.25 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.817 0.847 . . . . 0.0 113.026 -174.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.24 -39.74 83.73 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.872 177.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -55.97 -47.38 80.29 Favored Glycine 0 C--N 1.353 1.517 0 O-C-N 124.886 1.366 . . . . 0.0 112.991 179.296 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.509 HG13 HD22 ' A' ' 91' ' ' ASN . 26.0 mt -58.32 -56.9 13.31 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 124.052 0.941 . . . . 0.0 110.053 -179.824 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.8 mp -57.25 -50.62 76.12 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.185 0 O-C-N 124.034 0.834 . . . . 0.0 111.42 -176.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.65 -29.73 70.34 Favored 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -176.751 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -66.71 -38.44 86.74 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.487 0.715 . . . . 0.0 110.236 177.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.516 HG21 HG23 ' A' ' 60' ' ' ILE . 22.2 mt -77.92 -34.31 19.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 -177.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -61.14 -46.17 91.66 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.553 1.141 . . . . 0.0 111.821 177.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -74.53 -32.84 62.61 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 123.158 0.286 . . . . 0.0 111.465 -178.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 65.1 mtm -65.74 -45.57 82.11 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 122.638 0.375 . . . . 0.0 110.62 175.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 48.0 mt -65.93 -38.83 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 O-C-N 123.46 0.475 . . . . 0.0 109.938 176.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.36 -21.78 66.24 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.147 0.579 . . . . 0.0 111.371 177.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 44.6 t -88.58 -38.15 15.11 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 122.944 0.497 . . . . 0.0 111.199 -178.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -77.24 -25.48 51.61 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 122.396 0.278 . . . . 0.0 110.885 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 17.0 mm-40 -85.04 -50.24 7.62 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.02 0.528 . . . . 0.0 110.054 174.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 24.4 mm-40 . . . . . 0 CA--C 1.55 0.945 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 177.664 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 47.9 pttt . . . . . 0 N--CA 1.473 0.676 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.6 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.3 tmtp? -141.8 140.84 33.12 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 -172.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.467 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 10.1 tt -129.36 134.9 48.11 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 177.528 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.431 HD12 HD13 ' A' ' 50' ' ' LEU . 17.7 pt -128.01 165.17 27.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 173.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.618 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -152.48 169.08 23.48 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 122.775 0.43 . . . . 0.0 110.078 178.18 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.5 tt -139.73 114.28 9.25 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 -179.574 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.494 ' HA ' ' O ' ' A' ' 64' ' ' SER . 85.6 m -106.39 111.09 23.52 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 177.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.513 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -127.38 122.48 33.76 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 122.785 0.434 . . . . 0.0 111.235 -176.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.712 ' SG ' HD13 ' A' ' 85' ' ' LEU . 1.2 m -136.55 139.65 30.01 Favored Pre-proline 0 N--CA 1.474 0.74 0 C-N-CA 123.728 0.811 . . . . 0.0 109.878 176.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -75.91 -10.01 19.66 Favored 'Trans proline' 0 C--N 1.373 1.867 0 C-N-CA 122.856 2.371 . . . . 0.0 111.504 178.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 44.6 mtt -69.3 -56.97 5.98 Favored 'General case' 0 C--N 1.35 0.624 0 C-N-CA 124.93 1.292 . . . . 0.0 109.718 177.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 163.0 175.1 33.68 Favored Glycine 0 C--N 1.349 1.266 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.89 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 28.9 mt -69.89 -22.52 63.22 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.388 0.675 . . . . 0.0 112.759 -179.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -55.66 -44.65 77.45 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-O 120.956 0.408 . . . . 0.0 111.025 175.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -71.33 -36.5 71.57 Favored 'General case' 0 C--O 1.247 0.934 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.81 -178.537 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.414 ' HA ' HD11 ' A' ' 85' ' ' LEU . 44.8 p -70.97 -31.22 67.72 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.822 -178.396 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 -74.4 -28.13 60.95 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.298 0.639 . . . . 0.0 111.013 178.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 71.0 mtp -58.92 -51.26 70.81 Favored 'General case' 0 N--CA 1.483 1.189 0 CA-C-O 121.214 0.53 . . . . 0.0 109.838 169.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.01 -40.08 94.37 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.771 177.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.93 -37.11 78.7 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.876 0.87 . . . . 0.0 111.461 -176.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.424 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 8.4 tp-100 -64.5 -48.13 76.34 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.264 0.626 . . . . 0.0 109.715 178.273 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.465 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -63.11 -51.36 66.84 Favored 'General case' 0 CA--C 1.554 1.101 0 CA-C-N 115.221 -0.9 . . . . 0.0 111.934 -176.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 85.4 mt -63.91 -34.57 78.27 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.415 0.686 . . . . 0.0 112.048 -179.309 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.461 ' O ' HG23 ' A' ' 30' ' ' VAL . 39.0 tt0 -60.66 -56.72 17.9 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 123.979 0.799 . . . . 0.0 110.324 -179.022 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.482 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 21.3 mm-40 -56.96 -44.58 82.76 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 124.673 1.233 . . . . 0.0 111.196 -178.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.59 -49.45 77.42 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.839 0.855 . . . . 0.0 111.688 -179.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.15 -21.99 63.97 Favored 'General case' 0 CA--C 1.552 1.04 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 177.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.461 HG23 ' O ' ' A' ' 26' ' ' GLU . 42.3 t -73.61 -42.79 55.35 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.261 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 179.272 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 9.0 mm-40 -76.08 -20.3 57.82 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 114.559 -1.201 . . . . 0.0 110.814 -178.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -84.09 -14.6 50.0 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.719 0.808 . . . . 0.0 111.586 173.212 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 86.25 33.4 14.47 Favored Glycine 0 C--N 1.344 0.986 0 N-CA-C 114.792 0.677 . . . . 0.0 114.792 166.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -101.95 -179.19 3.93 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 117.781 0.791 . . . . 0.0 109.371 165.478 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.6 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 11.4 tp10 -87.71 132.31 34.17 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 156.618 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.467 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 8.7 p -117.47 135.74 56.88 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.27 0 CA-C-N 119.057 0.844 . . . . 0.0 110.667 -176.269 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.4 tptt -144.44 119.0 9.71 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.333 0.653 . . . . 0.0 109.278 177.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.618 HG12 ' HB3' ' A' ' 7' ' ' ALA . 46.6 mt -121.21 112.22 34.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 C-N-CA 123.082 0.553 . . . . 0.0 111.725 -173.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 49.0 tt0 -80.86 116.41 20.83 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.409 0.684 . . . . 0.0 110.115 175.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.404 HG22 ' HB2' ' A' ' 9' ' ' CYS . 22.6 p -97.26 114.31 26.04 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.841 0.856 . . . . 0.0 110.749 178.197 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.513 ' O ' ' HA ' ' A' ' 10' ' ' ALA . 45.7 mt-30 -105.09 137.27 43.11 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.918 0.887 . . . . 0.0 109.08 174.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -170.35 -165.84 28.33 Favored Glycine 0 C--N 1.345 1.041 0 C-N-CA 121.423 -0.417 . . . . 0.0 113.597 -177.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.99 -29.22 68.18 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.908 0.883 . . . . 0.0 112.601 -176.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -80.08 -11.25 59.78 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.283 0.633 . . . . 0.0 110.955 176.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 119.75 -157.35 15.57 Favored Glycine 0 C--N 1.345 1.075 0 N-CA-C 111.642 -0.583 . . . . 0.0 111.642 -179.537 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.405 HD12 HH22 ' A' ' 49' ' ' ARG . 55.4 mt -107.31 144.74 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 179.292 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -145.7 150.42 36.24 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.944 0.898 . . . . 0.0 109.514 -174.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.6 t30 60.64 43.87 12.08 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.554 1.142 . . . . 0.0 110.058 177.119 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.405 HH22 HD12 ' A' ' 46' ' ' ILE . 19.9 tpp180 -53.37 124.2 14.08 Favored 'General case' 0 C--N 1.357 0.921 0 C-N-CA 124.863 1.265 . . . . 0.0 112.796 -173.152 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.468 ' HB2' HH22 ' A' ' 74' ' ' ARG . 51.4 mt -69.9 140.45 53.12 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 114.49 -1.232 . . . . 0.0 110.96 170.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 70.1 p -101.86 164.74 11.57 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.627 0.771 . . . . 0.0 109.76 178.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.59 -32.13 64.94 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 122.913 0.485 . . . . 0.0 110.744 173.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 44.8 tt0 -61.9 -53.65 52.84 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.96 0.904 . . . . 0.0 110.962 173.304 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -57.68 -41.06 80.8 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 123.257 0.623 . . . . 0.0 111.886 -177.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.561 HG22 ' HG3' ' A' ' 78' ' ' ARG . 55.0 mt -72.08 -31.32 39.52 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.125 0 C-N-CA 123.77 0.828 . . . . 0.0 110.962 -177.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.72 -45.19 53.72 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.362 0.665 . . . . 0.0 111.337 176.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -65.7 -32.92 74.74 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.159 0.984 . . . . 0.0 111.121 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -51.92 102.6 0.05 OUTLIER 'General case' 0 CA--C 1.543 0.693 0 O-C-N 124.857 1.348 . . . . 0.0 112.322 -174.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 29.0 m -61.25 -37.96 84.99 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.089 165.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 91.7 mt -137.05 139.52 44.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 124.255 1.022 . . . . 0.0 110.371 -176.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.442 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 23.5 mt -126.05 141.21 46.36 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 172.6 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.0 mp -129.52 111.92 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 CA-C-N 118.248 0.476 . . . . 0.0 109.827 174.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . 0.411 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 12.7 m170 -87.74 85.67 7.08 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-O 121.618 0.723 . . . . 0.0 110.021 174.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.494 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 19.6 m -82.87 83.22 7.84 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 114.605 -1.179 . . . . 0.0 109.7 176.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.409 ' O ' ' HA ' ' A' ' 84' ' ' THR . 31.3 m -129.17 158.76 41.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 CA-C-O 121.668 0.747 . . . . 0.0 112.487 -170.482 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -113.97 -14.66 12.42 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.116 1.366 . . . . 0.0 109.445 175.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.3 m -134.1 150.24 31.03 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 125.786 1.635 . . . . 0.0 107.94 174.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 50.0 m -64.12 111.39 5.34 Favored Pre-proline 0 CA--C 1.548 0.903 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 174.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.531 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 33.4 Cg_endo -62.79 148.43 93.42 Favored 'Trans proline' 0 C--N 1.38 2.187 0 C-N-CA 122.467 2.111 . . . . 0.0 112.223 -173.721 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -65.13 -32.46 74.16 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.645 -179.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -96.55 15.66 20.96 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 115.084 -0.962 . . . . 0.0 112.424 -175.12 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.531 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 51.6 t30 -58.16 -33.51 69.3 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 124.033 0.933 . . . . 0.0 112.137 -179.189 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.42 -23.54 65.55 Favored 'General case' 0 N--CA 1.485 1.283 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -175.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.468 HH22 ' HB2' ' A' ' 50' ' ' LEU . 40.7 mtp180 -64.51 -38.12 89.92 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.385 0.674 . . . . 0.0 112.021 174.44 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -91.13 -3.04 57.43 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-N 114.615 -1.175 . . . . 0.0 111.357 -174.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -60.46 -30.65 69.81 Favored 'General case' 0 CA--C 1.554 1.099 0 C-N-CA 124.471 1.108 . . . . 0.0 112.021 -176.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 52.7 p -74.95 -18.68 60.35 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 124.048 0.939 . . . . 0.0 112.802 179.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.561 ' HG3' HG22 ' A' ' 55' ' ' ILE . 19.9 mmt180 -116.7 168.62 10.04 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.594 0.757 . . . . 0.0 111.881 -166.173 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -76.95 102.65 6.5 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.719 0.808 . . . . 0.0 110.349 -178.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.442 ' HA ' ' HB ' ' A' ' 61' ' ' ILE . 58.1 t -112.75 129.28 68.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 123.427 0.691 . . . . 0.0 110.807 -177.47 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 -99.87 90.08 4.31 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.387 1.075 . . . . 0.0 108.41 176.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.411 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 47.3 mt-10 -79.29 126.87 31.35 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.953 -176.514 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.55 HD12 ' HB3' ' A' ' 87' ' ' ASP . 38.2 pt -140.91 -172.9 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 C-N-CA 125.278 1.431 . . . . 0.0 109.137 178.729 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.409 ' HA ' ' O ' ' A' ' 65' ' ' VAL . 34.4 p -85.21 153.89 22.33 Favored 'General case' 0 C--N 1.346 0.45 0 CA-C-O 121.071 0.463 . . . . 0.0 110.324 168.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.712 HD13 ' SG ' ' A' ' 11' ' ' CYS . 7.6 tt -63.99 -27.54 69.19 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.039 176.179 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.471 ' HG2' ' HE2' ' A' ' 90' ' ' LYS . 35.7 tt0 -64.34 -42.96 96.0 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.864 0.866 . . . . 0.0 111.48 176.226 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.55 ' HB3' HD12 ' A' ' 83' ' ' ILE . 30.1 t70 -62.12 -30.86 71.32 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.462 0.705 . . . . 0.0 111.131 -179.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.46 -27.44 67.03 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.852 0.861 . . . . 0.0 112.885 178.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 37.6 mt -88.11 -45.96 15.83 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 C-N-CA 123.01 0.524 . . . . 0.0 109.996 -178.357 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.471 ' HE2' ' HG2' ' A' ' 86' ' ' GLN . 0.2 OUTLIER -78.82 -38.06 39.08 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 122.942 0.497 . . . . 0.0 112.089 -175.423 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -122.25 25.34 9.01 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.377 0.671 . . . . 0.0 110.56 -167.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.465 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -47.07 -59.37 3.18 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.401 0.68 . . . . 0.0 112.499 -176.186 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.06 -37.4 76.96 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 114.781 -1.1 . . . . 0.0 111.109 178.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.55 -50.7 60.03 Favored Glycine 0 C--N 1.354 1.548 0 O-C-N 124.578 1.174 . . . . 0.0 112.62 -178.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.407 ' O ' HG13 ' A' ' 99' ' ' ILE . 33.4 mt -54.38 -57.38 6.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 124.463 1.105 . . . . 0.0 110.126 -179.082 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.0 mp -56.8 -51.36 68.33 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.986 0 O-C-N 124.192 0.932 . . . . 0.0 111.021 -176.534 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.48 -28.12 68.32 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -176.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 35.7 mm-40 -70.91 -33.2 70.3 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.554 0.742 . . . . 0.0 110.652 178.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 95' ' ' ILE . 19.4 mt -82.14 -33.19 11.38 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 178.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -57.0 -49.76 74.8 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.479 1.112 . . . . 0.0 111.091 174.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -74.12 -33.93 63.75 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 123.576 0.548 . . . . 0.0 111.7 -177.046 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 66.8 mtm -63.13 -53.55 51.76 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 122.173 0.189 . . . . 0.0 110.6 175.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 21.7 mt -64.57 -39.32 85.2 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 O-C-N 123.821 0.701 . . . . 0.0 110.674 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.82 -42.08 99.57 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 122.263 0.225 . . . . 0.0 110.833 178.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 14.8 t -69.78 -35.4 74.85 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 122.703 0.401 . . . . 0.0 111.166 -172.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -81.18 -28.69 34.86 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 122.811 0.444 . . . . 0.0 111.618 179.169 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -87.26 -21.78 25.59 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.078 0.551 . . . . 0.0 112.033 -178.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 . . . . . 0 N--CA 1.481 1.089 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 175.032 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 37.8 pttt . . . . . 0 N--CA 1.478 0.93 0 CA-C-O 120.94 0.4 . . . . 0.0 110.516 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.575 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.2 tmtp? -142.42 134.49 27.36 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 -175.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.441 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.9 tt -127.08 136.82 52.69 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 179.091 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 19.6 pt -128.22 164.23 30.42 Favored 'Isoleucine or valine' 0 C--O 1.243 0.724 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 173.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.607 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -152.28 165.74 33.98 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.877 177.504 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.515 HD21 ' HG3' ' A' ' 41' ' ' GLN . 3.2 tt -137.34 109.95 7.51 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 -179.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.509 ' HA ' ' O ' ' A' ' 64' ' ' SER . 64.1 m -102.25 113.25 26.37 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 123.725 0.81 . . . . 0.0 108.966 177.472 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.415 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -129.01 124.08 34.01 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 122.703 0.401 . . . . 0.0 111.032 -176.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.738 ' SG ' HD13 ' A' ' 85' ' ' LEU . 1.3 m -144.17 148.88 43.13 Favored Pre-proline 0 N--CA 1.477 0.891 0 C-N-CA 123.753 0.821 . . . . 0.0 110.552 178.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -81.61 -7.16 12.62 Favored 'Trans proline' 0 C--N 1.373 1.863 0 C-N-CA 122.725 2.283 . . . . 0.0 111.411 176.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 55.0 mtt -70.52 -20.83 62.8 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.68 1.192 . . . . 0.0 110.991 177.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.17 -178.59 17.89 Favored Glycine 0 C--N 1.344 1.007 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.943 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 39.2 mt -72.33 -22.55 61.16 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 112.832 0.679 . . . . 0.0 112.832 -175.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.66 -43.53 93.91 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-N 118.484 0.584 . . . . 0.0 111.479 178.074 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.4 t-160 -70.07 -39.63 75.52 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.391 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.444 ' HA ' HD11 ' A' ' 85' ' ' LEU . 48.7 p -68.45 -28.08 66.73 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.419 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.1 m-30 -75.7 -28.23 58.55 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.599 0.76 . . . . 0.0 111.185 177.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 78.7 mtp -61.26 -46.14 91.59 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-O 121.303 0.573 . . . . 0.0 109.654 171.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.93 -38.05 69.93 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 114.888 -1.051 . . . . 0.0 111.507 178.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.23 -42.32 93.5 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.65 0.78 . . . . 0.0 110.837 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.407 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 24.2 tp60 -66.22 -43.49 86.52 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 122.812 0.445 . . . . 0.0 109.991 178.265 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.546 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -60.27 -56.53 20.42 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.912 -177.102 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.414 HD11 ' OG ' ' A' ' 64' ' ' SER . 96.6 mt -65.59 -30.49 71.23 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.789 0.835 . . . . 0.0 111.894 -179.275 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.515 ' HA ' HG21 ' A' ' 36' ' ' VAL . 35.5 tt0 -60.03 -55.37 34.77 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 123.733 0.646 . . . . 0.0 110.054 176.504 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.552 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 55.4 mm-40 -53.03 -51.12 62.72 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 124.513 1.133 . . . . 0.0 110.518 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.74 -49.8 72.1 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.454 1.102 . . . . 0.0 112.032 -177.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.94 -23.57 64.17 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 113.508 0.929 . . . . 0.0 113.508 177.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' ' 26' ' ' GLU . 49.0 t -75.87 -43.23 39.75 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 -179.707 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.552 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 24.6 mm-40 -69.81 -33.36 72.24 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 114.486 -1.234 . . . . 0.0 110.134 179.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -77.35 -19.21 56.63 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.558 0.743 . . . . 0.0 111.707 176.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 89.67 39.16 6.32 Favored Glycine 0 C--N 1.342 0.861 0 N-CA-C 114.722 0.649 . . . . 0.0 114.722 166.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -104.53 170.27 7.99 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 165.197 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.575 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 45.4 tt0 -78.99 129.45 34.46 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 156.048 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.515 HG21 ' HA ' ' A' ' 26' ' ' GLU . 12.2 p -113.97 137.5 46.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 CA-C-N 118.336 0.516 . . . . 0.0 110.01 -175.626 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 47.8 tptt -144.38 113.33 6.8 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 177.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.607 HG12 ' HB3' ' A' ' 7' ' ' ALA . 61.3 mt -118.3 110.96 32.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 122.55 0.34 . . . . 0.0 111.418 -175.321 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -74.29 142.1 45.26 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 123.805 0.691 . . . . 0.0 109.136 171.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 14.0 p -128.0 117.55 21.9 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.745 0.818 . . . . 0.0 109.219 -176.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.515 ' HG3' HD21 ' A' ' 8' ' ' LEU . 8.2 mt-30 -110.17 128.85 55.7 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 178.428 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -152.79 -176.37 25.28 Favored Glycine 0 C--N 1.336 0.564 0 N-CA-C 112.113 -0.395 . . . . 0.0 112.113 -177.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.51 -27.67 69.43 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.711 0.805 . . . . 0.0 111.695 -179.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -72.57 -36.32 68.16 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.972 0.909 . . . . 0.0 110.751 177.205 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 146.64 -159.42 27.99 Favored Glycine 0 C--N 1.347 1.155 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.054 -177.052 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 76.1 mt -111.57 131.96 61.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 123.397 0.679 . . . . 0.0 109.58 178.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -128.29 150.47 50.04 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.458 1.103 . . . . 0.0 109.691 -177.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 17.0 t30 60.63 41.42 15.32 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 124.61 1.164 . . . . 0.0 110.259 176.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 18.7 tpp180 -47.35 125.39 8.01 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 125.496 1.519 . . . . 0.0 113.142 -174.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 42.2 mt -75.09 127.93 34.35 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.778 173.526 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 50.1 p -87.34 161.2 18.06 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.423 176.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -57.48 -29.63 64.41 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 122.971 0.509 . . . . 0.0 111.47 175.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -73.06 -37.1 66.95 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.648 0.779 . . . . 0.0 111.378 178.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -62.02 -40.83 97.04 Favored 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 110.332 -0.247 . . . . 0.0 110.332 174.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.567 HG22 ' HG3' ' A' ' 78' ' ' ARG . 31.9 mt -73.6 -30.04 28.43 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.991 0 O-C-N 124.206 0.941 . . . . 0.0 110.888 -178.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.97 -48.99 31.75 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.598 0.759 . . . . 0.0 111.173 179.303 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -84.23 -4.38 58.79 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.593 0.757 . . . . 0.0 112.025 -177.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.91 104.19 0.82 Allowed 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.912 0.387 . . . . 0.0 110.58 177.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 26.1 m -60.64 -37.66 82.23 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.226 167.353 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 73.0 mt -135.65 142.45 39.32 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 C-N-CA 123.527 0.731 . . . . 0.0 110.646 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.406 HD13 ' HD2' ' A' ' 75' ' ' PHE . 23.4 mt -129.17 135.79 61.09 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 C-N-CA 124.105 0.962 . . . . 0.0 108.446 171.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -125.82 112.69 31.44 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 C-N-CA 123.106 0.562 . . . . 0.0 109.586 174.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . 0.459 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 16.4 m170 -88.25 86.22 7.04 Favored 'General case' 0 N--CA 1.485 1.319 0 CA-C-N 118.833 0.742 . . . . 0.0 109.45 172.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.509 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 23.1 m -82.92 81.62 8.54 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-N 114.808 -1.087 . . . . 0.0 109.466 176.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 28.0 m -126.88 159.05 37.25 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-O 121.677 0.751 . . . . 0.0 112.252 -170.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -117.54 -21.57 8.52 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.106 1.362 . . . . 0.0 108.822 173.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 12.3 m -126.04 156.83 36.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 125.106 1.362 . . . . 0.0 108.197 175.203 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 38.7 m -65.79 118.29 50.23 Favored Pre-proline 0 CA--C 1.546 0.812 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 177.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.545 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 56.2 Cg_endo -69.49 146.38 61.67 Favored 'Trans proline' 0 C--N 1.373 1.839 0 C-N-CA 121.683 1.589 . . . . 0.0 110.705 175.385 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.424 ' HG2' HE22 ' A' ' 41' ' ' GLN . 21.6 mm-40 -62.69 -48.28 79.99 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-O 121.538 0.685 . . . . 0.0 111.196 -175.358 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -94.76 26.58 3.47 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 114.76 -1.109 . . . . 0.0 111.789 -170.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.545 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 6.5 p30 -60.19 -27.75 67.41 Favored 'General case' 0 CA--C 1.557 1.237 0 C-N-CA 124.616 1.166 . . . . 0.0 112.043 -178.557 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.98 -13.1 60.01 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.06 0.944 . . . . 0.0 112.809 -177.334 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -69.53 -23.28 63.57 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-O 121.34 0.591 . . . . 0.0 110.66 171.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.406 ' HD2' HD13 ' A' ' 61' ' ' ILE . 27.3 m-85 -104.21 7.72 36.08 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 124.932 1.293 . . . . 0.0 110.563 -177.042 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -56.6 -52.47 64.72 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 124.883 1.273 . . . . 0.0 112.584 -171.069 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 48.4 t -86.79 -2.6 58.69 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.193 0.997 . . . . 0.0 112.046 -175.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.567 ' HG3' HG22 ' A' ' 55' ' ' ILE . 25.2 mmt180 -103.41 159.72 15.33 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.925 0.89 . . . . 0.0 110.12 -173.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -77.1 99.2 5.28 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-O 121.222 0.534 . . . . 0.0 111.211 -176.291 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 41.6 t -112.44 142.02 26.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 123.982 0.913 . . . . 0.0 110.501 -177.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -116.94 93.29 4.13 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.487 1.115 . . . . 0.0 108.656 177.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.459 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 42.1 mt-10 -81.81 114.53 20.5 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.598 -176.589 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.529 HD12 ' HB3' ' A' ' 87' ' ' ASP . 45.2 pt -125.46 -173.78 0.95 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.882 0 C-N-CA 124.704 1.201 . . . . 0.0 109.008 177.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 40.4 p -80.88 152.52 28.09 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-O 120.935 0.397 . . . . 0.0 110.0 168.184 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.738 HD13 ' SG ' ' A' ' 11' ' ' CYS . 6.7 tt -62.59 -26.09 68.42 Favored 'General case' 0 CA--C 1.551 1.012 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.724 173.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.59 ' HG2' ' HE2' ' A' ' 90' ' ' LYS . 34.6 tt0 -64.98 -45.6 84.97 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.733 0.813 . . . . 0.0 111.292 176.387 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.529 ' HB3' HD12 ' A' ' 83' ' ' ILE . 20.3 t70 -61.57 -30.71 70.84 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.375 0.67 . . . . 0.0 111.102 -178.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.97 -43.42 95.83 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.514 0.726 . . . . 0.0 111.794 175.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 75.3 mt -68.45 -41.22 83.16 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.926 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.271 -177.164 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.59 ' HE2' ' HG2' ' A' ' 86' ' ' GLN . 0.2 OUTLIER -87.35 -53.22 4.95 Favored 'General case' 0 N--CA 1.485 1.299 0 CA-C-O 120.964 0.412 . . . . 0.0 111.938 -175.607 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -102.73 28.15 6.36 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.3 1.04 . . . . 0.0 110.667 -166.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.546 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -43.56 -62.5 1.06 Allowed 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.835 0.854 . . . . 0.0 112.922 -175.272 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.24 -39.17 85.79 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.177 -0.92 . . . . 0.0 110.958 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . 0.412 ' O ' ' HG2' ' A' ' 98' ' ' GLU . . . -58.79 -53.91 42.35 Favored Glycine 0 C--N 1.353 1.508 0 O-C-N 124.72 1.262 . . . . 0.0 112.828 -178.162 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 25.8 mt -51.18 -55.74 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 124.481 1.113 . . . . 0.0 110.624 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.8 mp -57.96 -50.61 77.37 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.112 0 O-C-N 124.199 0.937 . . . . 0.0 111.298 -176.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.36 -27.42 66.23 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 122.91 0.484 . . . . 0.0 112.174 -176.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.412 ' HG2' ' O ' ' A' ' 94' ' ' GLY . 57.7 mm-40 -67.15 -38.75 86.03 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.232 0.613 . . . . 0.0 109.753 176.811 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.41 ' O ' HG13 ' A' ' 103' ' ' ILE . 21.1 mt -77.06 -37.17 25.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -52.13 -51.72 56.11 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 124.735 1.214 . . . . 0.0 111.981 174.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -71.46 -33.14 69.06 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 123.505 0.503 . . . . 0.0 111.218 -177.01 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 71.0 mtm -67.49 -39.24 85.21 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 122.617 0.367 . . . . 0.0 111.042 175.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.478 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 9.3 mt -70.08 -42.8 79.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 176.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.37 -21.2 66.23 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.242 0.617 . . . . 0.0 111.23 179.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 26.3 t -85.19 -42.18 14.95 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 122.931 0.492 . . . . 0.0 110.09 179.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.478 ' HG2' ' HA ' ' A' ' 103' ' ' ILE . 13.1 pt-20 -76.35 -23.3 54.19 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 122.897 0.479 . . . . 0.0 111.599 -178.05 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.9 mm-40 -90.02 -39.86 12.68 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.122 0.569 . . . . 0.0 110.535 177.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 80.3 mm-40 . . . . . 0 CA--C 1.554 1.104 0 CA-C-O 118.587 -0.72 . . . . 0.0 109.495 179.891 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.673 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 27.9 pttt . . . . . 0 C--O 1.245 0.838 0 CA-C-O 121.487 0.66 . . . . 0.0 111.04 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.592 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.9 tmtp? -143.75 143.68 31.49 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.477 -172.606 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.477 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.0 tt -128.01 131.13 49.22 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 174.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 18.7 pt -122.98 161.72 24.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 108.482 -0.932 . . . . 0.0 108.482 170.097 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.586 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -146.48 171.34 15.21 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.001 176.444 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.5 tt -146.48 117.31 7.66 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 -178.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.516 ' HA ' ' O ' ' A' ' 64' ' ' SER . 56.2 m -104.73 112.86 26.11 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.932 0.893 . . . . 0.0 109.239 176.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.531 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -128.36 117.24 21.08 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 122.496 0.318 . . . . 0.0 111.183 -178.206 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.767 ' SG ' HD13 ' A' ' 85' ' ' LEU . 1.3 m -138.78 141.78 31.77 Favored Pre-proline 0 N--CA 1.484 1.226 0 C-N-CA 123.89 0.876 . . . . 0.0 110.868 178.186 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -82.94 -7.66 11.21 Favored 'Trans proline' 0 C--N 1.375 1.928 0 C-N-CA 123.434 2.756 . . . . 0.0 111.533 176.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 47.9 ttm -65.12 -30.15 71.07 Favored 'General case' 0 C--N 1.354 0.764 0 C-N-CA 124.738 1.215 . . . . 0.0 110.318 170.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 125.79 -176.08 17.43 Favored Glycine 0 C--N 1.346 1.126 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.407 179.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 48.9 mt -78.17 -21.75 49.72 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 -173.038 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.82 -41.96 88.06 Favored 'General case' 0 N--CA 1.488 1.463 0 CA-C-N 118.922 0.783 . . . . 0.0 110.898 178.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.429 ' ND1' HD22 ' A' ' 85' ' ' LEU . 4.9 t-80 -67.55 -44.63 77.83 Favored 'General case' 0 C--O 1.247 0.94 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.165 -179.603 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 50.1 p -65.76 -36.43 83.53 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 114.816 -1.084 . . . . 0.0 110.916 -178.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -68.62 -30.82 69.64 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.34 0.656 . . . . 0.0 111.352 -179.182 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 64.7 mtm -68.28 -40.55 81.77 Favored 'General case' 0 N--CA 1.485 1.293 0 CA-C-O 120.473 0.178 . . . . 0.0 111.1 175.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.63 -38.48 83.94 Favored 'General case' 0 N--CA 1.485 1.29 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.133 175.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.8 -39.35 80.17 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.084 0.953 . . . . 0.0 110.975 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.4 tp60 -62.71 -50.91 69.24 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.672 0.789 . . . . 0.0 109.513 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.15 -50.63 69.66 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 124.265 0.978 . . . . 0.0 111.956 -175.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 68.2 mt -63.93 -34.22 77.48 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 122.95 0.5 . . . . 0.0 111.743 179.048 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.44 ' O ' HG23 ' A' ' 30' ' ' VAL . 42.4 tt0 -63.39 -54.12 41.75 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 122.463 0.305 . . . . 0.0 110.313 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -51.28 -50.74 58.7 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 124.616 1.198 . . . . 0.0 111.445 179.357 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.421 ' HB3' HD12 ' A' ' 96' ' ' ILE . . . -67.48 -35.85 79.96 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 115.177 -0.92 . . . . 0.0 112.195 -176.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.04 -25.84 59.01 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.073 0.549 . . . . 0.0 111.716 178.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.44 HG23 ' O ' ' A' ' 26' ' ' GLU . 53.7 t -71.73 -39.37 68.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 175.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -65.87 -29.52 69.98 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 114.688 -1.142 . . . . 0.0 111.088 174.521 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -82.49 1.5 37.38 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 123.45 0.7 . . . . 0.0 112.41 177.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.96 -45.93 1.77 Allowed Glycine 0 C--N 1.353 1.503 0 N-CA-C 114.423 0.529 . . . . 0.0 114.423 165.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.673 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.1 OUTLIER -71.56 175.72 5.34 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -174.418 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.592 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 37.8 tt0 -77.07 144.03 38.83 Favored 'General case' 0 C--N 1.351 0.638 0 CA-C-N 114.446 -1.252 . . . . 0.0 109.111 178.515 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.477 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 9.3 p -128.66 135.92 61.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 122.66 0.384 . . . . 0.0 110.944 -178.612 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.9 tptt -142.46 113.35 7.5 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.248 0.619 . . . . 0.0 109.482 174.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.586 HG12 ' HB3' ' A' ' 7' ' ' ALA . 40.7 mt -117.54 112.78 40.24 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 122.854 0.462 . . . . 0.0 111.536 -176.376 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.532 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 32.0 tt0 -84.59 124.14 31.1 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.176 0.591 . . . . 0.0 110.288 177.262 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 24.9 p -100.95 105.27 16.49 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.871 0.868 . . . . 0.0 110.413 177.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.531 ' O ' ' HA ' ' A' ' 10' ' ' ALA . 40.0 mt-30 -95.35 141.83 28.45 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 172.219 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -162.19 -176.95 34.81 Favored Glycine 0 N--CA 1.464 0.564 0 CA-C-O 120.019 -0.323 . . . . 0.0 112.718 -177.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.6 -28.91 67.6 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.73 0.812 . . . . 0.0 111.807 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -72.69 -43.93 62.45 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.147 0.979 . . . . 0.0 110.363 175.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 148.69 -158.58 27.72 Favored Glycine 0 C--N 1.345 1.044 0 CA-C-N 115.257 -0.883 . . . . 0.0 112.007 -175.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 64.8 mt -106.82 138.6 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 123.699 0.8 . . . . 0.0 110.146 -175.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -140.02 151.23 45.29 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.903 0.881 . . . . 0.0 109.191 -177.384 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 21.7 t30 57.57 48.27 14.61 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 124.507 1.123 . . . . 0.0 109.702 -177.016 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 32.0 tpt180 -48.4 123.36 6.46 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 126.228 1.811 . . . . 0.0 113.704 -173.09 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.532 ' HG ' ' HB2' ' A' ' 39' ' ' GLU . 52.2 mt -75.17 135.54 41.08 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 124.086 0.954 . . . . 0.0 110.318 170.595 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 44.4 p -103.77 173.03 6.48 Favored 'General case' 0 C--O 1.244 0.808 0 C-N-CA 124.164 0.985 . . . . 0.0 109.38 177.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.09 -33.81 73.93 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 122.813 0.445 . . . . 0.0 110.759 175.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -63.96 -44.75 91.83 Favored 'General case' 0 C--N 1.359 0.982 0 O-C-N 124.066 0.854 . . . . 0.0 110.944 178.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -57.99 -47.84 81.81 Favored 'General case' 0 N--CA 1.48 1.045 0 O-C-N 123.8 0.688 . . . . 0.0 110.983 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.546 HG22 ' HG3' ' A' ' 78' ' ' ARG . 14.2 mt -74.94 -28.83 21.57 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 O-C-N 123.741 0.65 . . . . 0.0 111.256 -177.191 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.94 -44.17 70.11 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.561 0.744 . . . . 0.0 111.401 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -89.36 -9.02 51.97 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.322 0.649 . . . . 0.0 111.602 -176.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.35 96.74 0.11 Allowed 'General case' 0 C--N 1.351 0.67 0 C-N-CA 123.548 0.739 . . . . 0.0 111.647 -177.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 26.3 m -62.58 -35.99 81.25 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 114.836 -1.075 . . . . 0.0 109.745 172.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.456 HG23 HG21 ' A' ' 99' ' ' ILE . 79.8 mt -131.55 137.18 55.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 CA-C-N 114.883 -1.053 . . . . 0.0 109.209 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 30.1 mt -131.23 133.66 62.14 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 175.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -124.95 111.11 26.72 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 174.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 11.8 m170 -89.19 85.49 6.65 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-O 121.576 0.703 . . . . 0.0 109.626 173.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.516 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 18.5 p -79.29 81.27 5.58 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-N 114.531 -1.213 . . . . 0.0 108.973 175.138 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.406 ' O ' ' HA ' ' A' ' 84' ' ' THR . 35.9 m -126.51 159.72 35.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 121.631 0.729 . . . . 0.0 111.553 -171.027 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -128.89 -3.22 5.21 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.068 1.347 . . . . 0.0 109.275 176.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.8 m -138.71 158.25 30.31 Favored 'Isoleucine or valine' 0 C--N 1.349 0.564 0 C-N-CA 125.912 1.685 . . . . 0.0 107.356 168.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 39.2 m -63.41 118.43 43.78 Favored Pre-proline 0 CA--C 1.547 0.828 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 175.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.479 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 58.9 Cg_endo -67.37 146.44 75.05 Favored 'Trans proline' 0 C--N 1.377 2.054 0 C-N-CA 122.095 1.863 . . . . 0.0 110.686 179.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.458 ' HB2' HE22 ' A' ' 41' ' ' GLN . 9.1 mm-40 -61.82 -38.79 89.47 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-O 121.752 0.787 . . . . 0.0 110.752 -176.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -94.57 16.54 15.19 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 114.514 -1.221 . . . . 0.0 112.417 -172.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.479 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 4.1 p30 -54.11 -26.59 28.2 Favored 'General case' 0 CA--C 1.565 1.541 0 C-N-CA 123.965 0.906 . . . . 0.0 110.766 174.404 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -56.13 -45.52 79.52 Favored 'General case' 0 CA--C 1.565 1.52 0 C-N-CA 125.836 1.654 . . . . 0.0 112.702 171.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 58.7 mtt85 -71.02 -17.77 62.61 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 124.6 1.16 . . . . 0.0 112.656 -176.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.539 ' HB3' HG21 ' A' ' 80' ' ' VAL . 77.1 m-85 -103.23 19.12 20.22 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.048 0.939 . . . . 0.0 110.991 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 13.7 tp10 -57.33 -56.51 20.91 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.409 1.083 . . . . 0.0 112.305 -174.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 64.8 p -86.2 -9.78 55.93 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.674 0.789 . . . . 0.0 112.453 -174.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.546 ' HG3' HG22 ' A' ' 55' ' ' ILE . 38.5 mmt180 -91.37 157.11 17.28 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 123.357 0.663 . . . . 0.0 111.927 -170.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -82.14 97.96 8.46 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.668 0.787 . . . . 0.0 109.751 -178.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.539 HG21 ' HB3' ' A' ' 75' ' ' PHE . 41.6 t -110.73 118.43 57.22 Favored 'Isoleucine or valine' 0 C--O 1.24 0.602 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.96 -174.854 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -86.39 89.41 7.87 Favored 'General case' 0 C--O 1.24 0.574 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 172.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -84.52 125.37 32.34 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.157 -177.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.627 HD12 ' HB3' ' A' ' 87' ' ' ASP . 39.0 pt -135.2 -175.37 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 125.024 1.33 . . . . 0.0 109.224 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.406 ' HA ' ' O ' ' A' ' 65' ' ' VAL . 24.8 p -79.57 151.35 30.71 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.847 0.356 . . . . 0.0 110.475 168.241 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.767 HD13 ' SG ' ' A' ' 11' ' ' CYS . 6.5 tt -61.88 -32.15 72.49 Favored 'General case' 0 N--CA 1.48 1.059 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.492 176.066 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 31.2 tt0 -59.83 -43.55 94.51 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.794 0.838 . . . . 0.0 111.181 175.21 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.627 ' HB3' HD12 ' A' ' 83' ' ' ILE . 5.1 t70 -60.31 -31.67 70.5 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.95 0.9 . . . . 0.0 110.773 -176.621 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.93 -28.74 63.67 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.468 0.707 . . . . 0.0 112.831 178.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 86.0 mt -77.92 -48.14 24.01 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.874 0 C-N-CA 123.041 0.536 . . . . 0.0 110.32 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -80.31 -43.17 21.71 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.075 0.55 . . . . 0.0 112.323 -176.25 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -114.46 27.86 9.16 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.507 0.723 . . . . 0.0 110.557 -168.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -45.38 -60.08 2.34 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 124.063 0.945 . . . . 0.0 112.781 -177.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.66 -41.38 94.9 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 114.074 -1.421 . . . . 0.0 110.702 177.318 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -62.81 -42.1 99.74 Favored Glycine 0 C--N 1.354 1.566 0 O-C-N 124.391 1.057 . . . . 0.0 113.301 -173.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.403 ' O ' HG13 ' A' ' 99' ' ' ILE . 19.7 mt -63.25 -57.51 11.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 123.909 0.884 . . . . 0.0 108.682 179.45 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.421 HD12 ' HB3' ' A' ' 28' ' ' ALA . 82.6 mt -58.61 -45.77 90.44 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 CA-C-N 114.04 -1.437 . . . . 0.0 111.722 -174.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -33.07 73.5 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 122.755 0.422 . . . . 0.0 111.365 -177.531 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -67.5 -37.56 83.01 Favored 'General case' 0 C--N 1.355 0.809 0 O-C-N 123.614 0.571 . . . . 0.0 110.404 177.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.456 HG21 HG23 ' A' ' 60' ' ' ILE . 57.1 mt -75.14 -34.94 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 -177.128 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -63.37 -49.5 73.59 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 114.892 -1.049 . . . . 0.0 111.374 176.081 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -73.57 -30.7 63.19 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-O 119.613 -0.232 . . . . 0.0 111.307 -177.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.453 ' O ' ' HG2' ' A' ' 106' ' ' GLU . 68.3 mtm -65.47 -61.97 1.8 Allowed 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 175.165 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 41.3 mt -58.58 -48.49 85.44 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 O-C-N 123.932 0.77 . . . . 0.0 111.419 -176.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.83 -37.55 88.01 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -175.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 15.3 t -80.88 -23.47 39.0 Favored 'General case' 0 N--CA 1.484 1.275 0 CA-C-N 117.763 0.256 . . . . 0.0 111.643 -172.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' A' ' 102' ' ' MET . 11.6 pt-20 -86.79 -41.69 13.89 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 122.549 0.34 . . . . 0.0 111.058 176.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -73.26 -35.62 66.23 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.025 0.53 . . . . 0.0 110.905 -177.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 76.3 mm-40 . . . . . 0 CA--C 1.55 0.965 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 175.217 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.639 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 18.1 pttt . . . . . 0 N--CA 1.481 1.121 0 CA-C-O 121.203 0.525 . . . . 0.0 111.684 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.462 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.4 tmtp? -142.2 141.0 32.52 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-O 121.029 0.442 . . . . 0.0 109.834 -173.555 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.474 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 8.9 tt -128.4 139.58 52.3 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 176.199 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.427 HD12 HD13 ' A' ' 50' ' ' LEU . 18.3 pt -131.08 169.48 21.58 Favored 'Isoleucine or valine' 0 C--O 1.244 0.77 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 172.187 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.619 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -155.22 167.74 29.35 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.22 176.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.402 ' HA ' ' O ' ' A' ' 39' ' ' GLU . 3.8 tt -138.53 115.23 10.65 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 178.127 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.53 ' HA ' ' O ' ' A' ' 64' ' ' SER . 65.1 m -105.33 112.53 25.67 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.567 0.747 . . . . 0.0 109.045 176.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.444 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -126.51 128.26 46.62 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 122.718 0.407 . . . . 0.0 111.641 -176.387 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.75 ' SG ' HD13 ' A' ' 85' ' ' LEU . 20.9 m -125.82 151.15 70.65 Favored Pre-proline 0 N--CA 1.476 0.83 0 C-N-CA 124.24 1.016 . . . . 0.0 109.989 175.516 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -82.15 -0.54 10.32 Favored 'Trans proline' 0 C--N 1.374 1.897 0 C-N-CA 122.757 2.304 . . . . 0.0 112.099 173.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 46.6 ttm -99.4 -62.36 1.25 Allowed 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.307 1.043 . . . . 0.0 110.458 -173.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 179.52 -178.22 48.57 Favored Glycine 0 C--N 1.347 1.168 0 CA-C-N 115.96 -0.564 . . . . 0.0 113.336 -176.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 74.6 mt -82.32 -17.13 46.84 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 -174.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.6 -45.99 91.92 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-N 118.69 0.677 . . . . 0.0 110.998 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 8.0 t-160 -68.88 -36.6 78.28 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.406 -179.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.459 ' HA ' HD11 ' A' ' 85' ' ' LEU . 36.2 p -68.81 -30.31 68.85 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.566 179.643 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.496 ' HA ' ' HB3' ' A' ' 22' ' ' ALA . 19.8 m-85 -77.48 -22.35 51.43 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.467 0.707 . . . . 0.0 111.681 177.048 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 77.6 mtp -66.49 -44.33 82.93 Favored 'General case' 0 N--CA 1.486 1.336 0 CA-C-O 121.322 0.582 . . . . 0.0 109.471 171.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.73 -37.49 70.58 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 114.687 -1.142 . . . . 0.0 111.101 176.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.496 ' HB3' ' HA ' ' A' ' 19' ' ' PHE . . . -70.32 -34.01 72.19 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.437 0.695 . . . . 0.0 110.85 -179.318 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.1 tt0 -61.85 -55.37 30.5 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.342 0.657 . . . . 0.0 109.328 173.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.68 -44.37 86.42 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 114.372 -1.286 . . . . 0.0 112.447 -170.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.437 HD11 ' OG ' ' A' ' 64' ' ' SER . 96.2 mt -70.04 -34.77 73.66 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 122.745 0.418 . . . . 0.0 111.323 178.299 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.482 ' O ' HG23 ' A' ' 30' ' ' VAL . 36.8 tt0 -60.49 -55.45 33.3 Favored 'General case' 0 C--N 1.354 0.796 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 178.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -54.14 -50.2 67.47 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 124.579 1.174 . . . . 0.0 110.886 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.4 -45.1 92.43 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.162 0.985 . . . . 0.0 112.201 -176.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.58 -24.81 61.15 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 178.423 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 26' ' ' GLU . 40.6 t -70.43 -43.04 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 175.582 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -62.63 -34.04 76.24 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 114.588 -1.187 . . . . 0.0 111.064 178.193 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.68 -42.28 95.47 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.478 0.711 . . . . 0.0 111.65 177.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 135.09 -43.96 1.21 Allowed Glycine 0 C--N 1.348 1.207 0 CA-C-N 116.861 -0.154 . . . . 0.0 113.206 174.307 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.639 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -71.6 177.88 3.85 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 -177.266 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.462 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 30.2 tt0 -78.66 154.66 30.0 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 115.083 -0.962 . . . . 0.0 109.505 178.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.474 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 7.1 p -134.94 136.61 51.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 123.226 0.61 . . . . 0.0 110.138 176.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 45.9 tptt -143.69 113.83 7.32 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 175.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.619 HG12 ' HB3' ' A' ' 7' ' ' ALA . 41.5 mt -116.01 109.85 29.6 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 C-N-CA 122.654 0.382 . . . . 0.0 111.844 -174.232 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.402 ' O ' ' HA ' ' A' ' 8' ' ' LEU . 32.7 tt0 -76.08 135.63 39.88 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 172.067 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.401 HG22 ' HB2' ' A' ' 9' ' ' CYS . 12.2 p -118.93 119.04 33.16 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 123.657 0.783 . . . . 0.0 109.65 -177.24 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.471 HE22 ' HB2' ' A' ' 70' ' ' GLU . 40.4 mt-30 -109.65 137.68 47.11 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 123.796 0.838 . . . . 0.0 109.969 179.153 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -164.45 176.31 40.36 Favored Glycine 0 C--O 1.243 0.664 0 N-CA-C 112.136 -0.386 . . . . 0.0 112.136 179.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.72 -19.79 66.03 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.292 0.637 . . . . 0.0 112.034 -179.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -74.56 -40.32 61.73 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.159 0.584 . . . . 0.0 110.876 173.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 156.06 -158.02 28.28 Favored Glycine 0 C--N 1.343 0.97 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.004 -176.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.42 HD12 HH22 ' A' ' 49' ' ' ARG . 74.6 mt -124.12 137.98 55.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 C-N-CA 123.316 0.647 . . . . 0.0 109.769 177.364 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -132.98 152.42 51.95 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.178 0.991 . . . . 0.0 109.636 -178.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.1 t30 63.58 36.82 10.74 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 124.24 1.016 . . . . 0.0 110.238 175.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.42 HH22 HD12 ' A' ' 46' ' ' ILE . 20.2 tpp180 -45.26 122.51 3.47 Favored 'General case' 0 C--N 1.362 1.117 0 C-N-CA 126.088 1.755 . . . . 0.0 112.762 -175.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.427 HD13 HD12 ' A' ' 6' ' ' ILE . 41.1 mt -76.2 147.17 38.59 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.264 172.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 17.1 p -104.86 171.88 7.08 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 175.204 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.7 -29.33 70.58 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 122.664 0.386 . . . . 0.0 111.231 175.065 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -64.94 -46.93 79.55 Favored 'General case' 0 C--N 1.354 0.781 0 O-C-N 123.759 0.662 . . . . 0.0 110.243 176.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -56.25 -46.09 79.78 Favored 'General case' 0 N--CA 1.484 1.267 0 O-C-N 123.928 0.768 . . . . 0.0 111.403 179.02 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.607 HG22 ' HG3' ' A' ' 78' ' ' ARG . 28.6 mt -74.19 -31.49 29.46 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 O-C-N 123.925 0.765 . . . . 0.0 111.121 -174.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.25 -50.02 30.5 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.164 0.585 . . . . 0.0 111.093 178.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -79.95 -9.56 59.69 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.4 0.68 . . . . 0.0 111.652 -176.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.82 103.25 0.42 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.297 0.639 . . . . 0.0 110.538 176.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 30.2 m -61.85 -36.08 80.16 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.656 170.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.497 HG23 HG21 ' A' ' 99' ' ' ILE . 79.8 mt -132.36 141.44 45.26 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.292 179.308 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.422 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 21.9 mt -132.12 140.78 47.07 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 123.856 0.862 . . . . 0.0 108.887 171.634 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.2 mp -126.03 116.65 46.51 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.329 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 173.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . 0.426 ' HE1' ' HA ' ' A' ' 72' ' ' ASN . 5.2 m170 -92.32 86.21 5.64 Favored 'General case' 0 N--CA 1.486 1.334 0 CA-C-O 121.739 0.78 . . . . 0.0 109.834 173.339 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.53 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 22.7 m -82.43 78.91 9.01 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 114.381 -1.282 . . . . 0.0 109.956 178.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.447 HG11 ' HG3' ' A' ' 69' ' ' PRO . 34.2 m -125.35 157.14 34.61 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 CA-C-O 121.858 0.837 . . . . 0.0 111.721 -170.074 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -107.77 -23.3 12.14 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 114.17 -1.377 . . . . 0.0 109.483 178.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 15.8 m -136.86 179.64 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 125.051 1.341 . . . . 0.0 108.757 178.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 86.8 m -69.98 116.02 39.82 Favored Pre-proline 0 CA--C 1.549 0.938 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 172.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.592 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 58.1 Cg_endo -73.31 146.8 40.82 Favored 'Trans proline' 0 C--N 1.373 1.857 0 C-N-CA 122.406 2.07 . . . . 0.0 110.859 175.833 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.471 ' HB2' HE22 ' A' ' 41' ' ' GLN . 14.2 mm-40 -67.36 -23.76 65.63 Favored 'General case' 0 N--CA 1.482 1.175 0 CA-C-O 121.219 0.533 . . . . 0.0 111.338 -175.478 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -101.6 10.06 40.57 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.152 -176.36 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.592 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 8.4 t30 -56.45 -34.83 67.23 Favored 'General case' 0 N--CA 1.495 1.814 0 C-N-CA 123.499 0.72 . . . . 0.0 112.021 179.592 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -57.96 -22.24 48.18 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 125.264 1.425 . . . . 0.0 113.314 179.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 43.1 mtp180 -86.03 -28.51 24.09 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.409 1.083 . . . . 0.0 112.537 -176.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.411 ' HE2' HD13 ' A' ' 50' ' ' LEU . 58.0 m-85 -99.98 -17.77 17.37 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.702 0.801 . . . . 0.0 111.969 -173.249 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -59.08 -29.49 67.38 Favored 'General case' 0 CA--C 1.559 1.292 0 C-N-CA 124.098 0.959 . . . . 0.0 113.282 -168.017 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 14.2 t -85.16 0.41 51.81 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.522 0.729 . . . . 0.0 112.142 -178.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.607 ' HG3' HG22 ' A' ' 55' ' ' ILE . 36.8 mmt180 -114.67 168.53 9.8 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.0 0.92 . . . . 0.0 110.081 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -75.65 86.45 2.7 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-O 121.785 0.802 . . . . 0.0 110.28 -178.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.422 ' HA ' ' HB ' ' A' ' 61' ' ' ILE . 60.2 t -101.56 125.94 55.53 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 CA-C-N 114.619 -1.173 . . . . 0.0 110.109 179.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -98.74 89.53 4.38 Favored 'General case' 0 C--O 1.24 0.592 0 N-CA-C 107.4 -1.333 . . . . 0.0 107.4 174.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -78.86 125.33 29.23 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.051 -177.206 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.454 HD12 ' HB3' ' A' ' 87' ' ' ASP . 46.4 pt -128.62 -174.06 1.1 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.856 0 C-N-CA 124.491 1.116 . . . . 0.0 109.379 177.388 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 23.3 p -84.36 149.3 26.13 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 109.908 -0.405 . . . . 0.0 109.908 166.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.75 HD13 ' SG ' ' A' ' 11' ' ' CYS . 7.6 tt -61.65 -31.03 71.12 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.865 179.209 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -61.51 -42.98 99.61 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 123.403 0.681 . . . . 0.0 110.938 176.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.454 ' HB3' HD12 ' A' ' 83' ' ' ILE . 9.2 t70 -62.8 -31.88 72.96 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.569 0.748 . . . . 0.0 110.913 -179.157 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.54 -14.5 63.05 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.836 0.854 . . . . 0.0 112.906 179.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 47.5 mt -96.76 -56.6 5.07 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 123.662 0.785 . . . . 0.0 109.536 178.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -77.82 -30.37 51.08 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 -173.301 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -118.35 15.25 13.9 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.443 0.697 . . . . 0.0 110.55 -175.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.489 ' HA ' HD12 ' A' ' 95' ' ' ILE . . . -41.97 -57.91 2.26 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 124.49 1.116 . . . . 0.0 113.467 -173.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.82 -41.19 97.48 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.944 179.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -58.93 -44.08 96.34 Favored Glycine 0 C--N 1.35 1.345 0 O-C-N 124.343 1.027 . . . . 0.0 112.339 -179.439 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.489 HD12 ' HA ' ' A' ' 92' ' ' ALA . 22.3 mt -59.42 -58.53 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 124.144 0.978 . . . . 0.0 110.272 -179.517 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.7 mp -54.37 -51.14 51.72 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 O-C-N 124.175 0.922 . . . . 0.0 110.832 -176.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.48 -29.82 69.36 Favored 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -175.431 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -68.34 -36.55 79.42 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 177.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.497 HG21 HG23 ' A' ' 60' ' ' ILE . 38.3 mt -76.91 -36.45 25.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 -177.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -57.38 -52.58 64.8 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 114.502 -1.226 . . . . 0.0 111.063 177.291 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -71.05 -32.15 68.78 Favored 'General case' 0 CA--C 1.546 0.805 0 O-C-N 123.671 0.607 . . . . 0.0 111.838 -176.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 70.7 mtm -66.06 -53.83 33.46 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 122.837 0.455 . . . . 0.0 110.954 177.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 40.7 mt -67.7 -33.38 61.5 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.837 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.714 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -72.21 -25.36 61.63 Favored 'General case' 0 C--O 1.212 -0.917 0 CA-C-O 119.666 -0.207 . . . . 0.0 111.066 177.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 21.0 t -78.04 -38.76 43.85 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 118.01 0.368 . . . . 0.0 110.88 -178.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -72.32 -37.56 68.89 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 122.354 0.262 . . . . 0.0 111.159 178.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -84.08 -31.15 25.48 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 122.932 0.493 . . . . 0.0 111.355 -177.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 65.9 mm-40 . . . . . 0 C--O 1.25 1.111 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.124 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.561 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 14.6 pttt . . . . . 0 C--O 1.256 1.395 0 CA-C-O 121.71 0.767 . . . . 0.0 111.192 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.567 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 3.7 tmtp? -149.64 141.49 23.73 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.126 -172.428 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.476 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.6 tt -128.48 139.05 52.53 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 176.154 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.417 HD12 HD13 ' A' ' 50' ' ' LEU . 16.0 pt -130.14 165.46 30.24 Favored 'Isoleucine or valine' 0 C--O 1.241 0.625 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 168.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.571 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -152.16 169.11 23.24 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 176.304 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.1 tt -140.97 109.69 6.02 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -178.413 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.565 ' HA ' ' O ' ' A' ' 64' ' ' SER . 66.8 m -101.05 107.61 19.1 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.938 0.895 . . . . 0.0 109.463 176.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -125.9 115.31 19.74 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 122.852 0.461 . . . . 0.0 110.096 -177.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.573 ' SG ' ' HB3' ' A' ' 13' ' ' MET . 25.7 t -123.04 139.06 30.77 Favored Pre-proline 0 N--CA 1.476 0.846 0 C-N-CA 123.034 0.533 . . . . 0.0 110.664 -175.567 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -74.39 -15.9 22.12 Favored 'Trans proline' 0 C--N 1.374 1.911 0 C-N-CA 123.151 2.568 . . . . 0.0 112.848 170.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.573 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 44.2 ttm -69.05 -57.13 5.85 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.557 0.743 . . . . 0.0 110.282 177.779 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 164.85 171.47 31.13 Favored Glycine 0 C--O 1.245 0.812 0 CA-C-N 114.886 -1.052 . . . . 0.0 111.813 -177.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 81.0 mt -67.5 -20.01 65.4 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.246 0.619 . . . . 0.0 111.941 178.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -57.06 -45.35 83.32 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-O 121.047 0.451 . . . . 0.0 110.996 175.361 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 7.7 t-160 -73.01 -36.06 66.93 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.432 -178.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.433 ' HA ' HD11 ' A' ' 85' ' ' LEU . 37.4 p -64.41 -37.79 88.77 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.563 179.505 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.404 ' HA ' ' HB3' ' A' ' 22' ' ' ALA . 21.4 m-85 -75.18 -23.42 57.72 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.416 0.687 . . . . 0.0 111.926 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 83.8 mtp -61.32 -48.45 81.3 Favored 'General case' 0 N--CA 1.484 1.262 0 CA-C-O 121.173 0.511 . . . . 0.0 110.064 169.088 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.89 -38.91 73.05 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.951 178.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.404 ' HB3' ' HA ' ' A' ' 19' ' ' PHE . . . -68.48 -39.83 81.18 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.934 0.893 . . . . 0.0 111.225 -176.606 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.452 ' O ' ' HG3' ' A' ' 27' ' ' GLU . 16.2 tt0 -65.37 -50.35 65.89 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 123.482 0.489 . . . . 0.0 110.241 176.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.87 -48.98 79.35 Favored 'General case' 0 CA--C 1.551 1.013 0 O-C-N 123.829 0.705 . . . . 0.0 112.213 -174.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 73.4 mt -64.84 -37.07 86.4 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 122.97 0.508 . . . . 0.0 111.587 177.221 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.482 ' O ' HG23 ' A' ' 30' ' ' VAL . 41.3 tt0 -59.88 -55.23 36.79 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 123.35 0.406 . . . . 0.0 110.25 -179.039 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.534 ' O ' ' HG3' ' A' ' 31' ' ' GLU . 44.6 mt-10 -52.84 -53.11 53.49 Favored 'General case' 0 N--CA 1.475 0.825 0 O-C-N 124.616 1.198 . . . . 0.0 111.159 -179.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -62.01 -37.48 85.02 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.721 -176.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.56 -24.11 49.91 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.164 0.585 . . . . 0.0 112.503 179.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 26' ' ' GLU . 40.6 t -64.14 -43.87 97.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 172.748 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.534 ' HG3' ' O ' ' A' ' 27' ' ' GLU . 25.9 mt-10 -80.13 -20.78 44.16 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 113.506 -1.679 . . . . 0.0 111.643 -176.086 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.65 -16.54 62.27 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.373 0.669 . . . . 0.0 111.221 174.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 116.11 -19.01 13.79 Favored Glycine 0 C--N 1.354 1.579 0 N-CA-C 114.53 0.572 . . . . 0.0 114.53 167.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.561 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -106.02 -179.58 3.98 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 113.323 0.861 . . . . 0.0 113.323 -173.481 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.567 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 10.8 tp10 -75.77 150.27 37.81 Favored 'General case' 0 C--N 1.355 0.812 0 CA-C-N 114.479 -1.237 . . . . 0.0 109.021 175.419 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.476 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 7.1 p -137.4 132.94 46.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 122.921 0.489 . . . . 0.0 110.238 177.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 48.2 tptt -142.11 112.82 7.3 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 179.132 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.571 HG12 ' HB3' ' A' ' 7' ' ' ALA . 45.5 mt -118.6 111.08 32.3 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 -173.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -75.55 139.68 42.27 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.829 0.851 . . . . 0.0 109.74 174.007 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.408 HG22 ' HB2' ' A' ' 9' ' ' CYS . 17.0 p -123.1 111.68 16.83 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.881 0.872 . . . . 0.0 109.463 -178.293 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.471 HE22 ' HB2' ' A' ' 70' ' ' GLU . 41.9 mt-30 -105.74 146.38 29.87 Favored 'General case' 0 C--O 1.243 0.744 0 CA-C-O 121.174 0.511 . . . . 0.0 111.376 -177.428 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -169.78 169.24 41.97 Favored Glycine 0 C--N 1.342 0.866 0 CA-C-N 114.917 -1.038 . . . . 0.0 111.752 175.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.94 -24.76 67.85 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.556 0.743 . . . . 0.0 111.741 -179.573 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -72.42 -39.93 67.5 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.201 0.6 . . . . 0.0 110.603 174.659 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 163.93 -173.73 40.0 Favored Glycine 0 C--N 1.344 1.027 0 CA-C-N 116.214 -0.448 . . . . 0.0 113.333 -179.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 78.2 mt -122.63 134.82 64.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.215 1.006 . . . . 0.0 108.836 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -128.89 152.76 48.18 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.931 0.892 . . . . 0.0 109.628 -179.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 10.3 t30 60.21 40.45 18.03 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 124.364 1.066 . . . . 0.0 109.977 176.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 17.4 tpp180 -47.58 124.54 7.18 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 125.854 1.662 . . . . 0.0 113.118 -175.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.417 HD13 HD12 ' A' ' 6' ' ' ILE . 55.0 mt -77.81 132.91 38.26 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.318 1.047 . . . . 0.0 110.6 173.3 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 43.0 p -96.68 169.77 9.65 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.721 177.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.09 -34.89 70.66 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 122.904 0.482 . . . . 0.0 111.204 175.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 19.9 tt0 -65.23 -46.74 79.38 Favored 'General case' 0 C--N 1.352 0.716 0 O-C-N 123.717 0.636 . . . . 0.0 110.463 178.117 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -53.66 -44.79 69.94 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 123.362 0.665 . . . . 0.0 111.71 179.267 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 45.8 mt -71.74 -32.73 46.11 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.94 0 O-C-N 124.302 1.002 . . . . 0.0 110.935 -177.47 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.35 -41.55 69.62 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.467 0.707 . . . . 0.0 111.42 178.02 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -72.3 -32.38 66.52 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.99 0.916 . . . . 0.0 111.003 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.73 102.56 0.07 Allowed 'General case' 0 N--CA 1.471 0.622 0 O-C-N 124.568 1.168 . . . . 0.0 112.587 -173.056 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 26.9 m -61.88 -38.59 88.87 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 124.049 0.94 . . . . 0.0 109.429 168.043 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.452 HG23 HG21 ' A' ' 99' ' ' ILE . 70.6 mt -128.44 139.78 50.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.092 -178.44 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.407 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 25.9 mt -131.21 133.49 62.38 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.286 0 C-N-CA 123.821 0.848 . . . . 0.0 108.919 171.401 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.1 mp -121.9 112.5 35.18 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.339 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 174.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . 0.511 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 9.4 m170 -86.48 86.04 7.33 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-O 121.678 0.751 . . . . 0.0 109.15 173.42 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.565 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 15.0 m -81.25 78.98 7.99 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 114.074 -1.421 . . . . 0.0 109.222 177.452 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 35.3 m -127.5 157.98 39.04 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-O 121.688 0.756 . . . . 0.0 111.537 -169.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -117.11 -10.38 10.87 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.524 1.13 . . . . 0.0 109.418 175.164 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 4.0 m -141.84 162.3 20.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 125.699 1.6 . . . . 0.0 108.498 173.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 47.0 m -61.83 114.93 12.76 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 123.286 0.634 . . . . 0.0 110.162 175.62 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.547 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 69.1 Cg_endo -70.53 151.54 64.75 Favored 'Trans proline' 0 C--N 1.377 2.055 0 C-N-CA 122.241 1.961 . . . . 0.0 110.87 178.083 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.471 ' HB2' HE22 ' A' ' 41' ' ' GLN . 11.6 mm-40 -67.57 -45.49 75.45 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-O 121.216 0.531 . . . . 0.0 111.107 -172.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -89.64 14.4 11.74 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.746 0.818 . . . . 0.0 112.305 -169.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.547 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 5.2 p30 -55.47 -27.35 47.77 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 124.83 1.252 . . . . 0.0 112.817 -176.313 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -56.89 -33.6 67.06 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.958 1.303 . . . . 0.0 113.03 -177.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -72.58 -38.15 67.97 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.929 0.892 . . . . 0.0 110.812 -175.515 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -77.09 -12.78 59.99 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 114.447 -1.251 . . . . 0.0 111.456 -174.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -54.48 -33.28 59.44 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 124.663 1.185 . . . . 0.0 112.352 178.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 73.5 p -73.83 -19.42 60.74 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 -177.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 40.6 mmt180 -115.46 170.25 8.55 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.756 0.822 . . . . 0.0 111.803 -170.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -76.9 93.94 3.84 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.412 0.685 . . . . 0.0 110.177 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.407 ' HA ' ' HB ' ' A' ' 61' ' ' ILE . 48.3 t -99.0 139.76 20.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.25 177.818 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -116.5 91.14 3.5 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 179.382 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.511 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 49.1 mt-10 -81.14 123.93 28.82 Favored 'General case' 0 C--N 1.35 0.623 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.756 -175.569 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.633 HD12 ' HB3' ' A' ' 87' ' ' ASP . 45.5 pt -131.33 179.57 4.22 Favored 'Isoleucine or valine' 0 C--O 1.248 1.02 0 C-N-CA 125.112 1.365 . . . . 0.0 108.764 178.227 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 3.2 m -80.34 151.59 29.4 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 109.138 -0.689 . . . . 0.0 109.138 167.06 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.545 HD13 ' HB2' ' A' ' 11' ' ' CYS . 7.8 tt -62.86 -29.95 71.13 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.18 0.592 . . . . 0.0 111.591 -178.019 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.536 ' HG2' ' HE2' ' A' ' 90' ' ' LYS . 34.5 tt0 -64.83 -37.01 86.18 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.095 0.558 . . . . 0.0 111.397 179.133 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.633 ' HB3' HD12 ' A' ' 83' ' ' ILE . 5.3 t70 -61.88 -34.06 75.32 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.881 0.872 . . . . 0.0 110.366 -179.411 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -72.23 -11.63 60.81 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.883 0.873 . . . . 0.0 113.017 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 84.2 mt -96.43 -53.0 8.59 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 123.641 0.776 . . . . 0.0 109.723 178.27 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.536 ' HE2' ' HG2' ' A' ' 86' ' ' GLN . 0.2 OUTLIER -72.97 -42.46 63.31 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.456 0.702 . . . . 0.0 111.834 -176.453 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -117.81 26.67 9.52 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.343 1.057 . . . . 0.0 110.098 -167.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.49 -58.89 3.68 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.667 0.787 . . . . 0.0 112.956 -174.393 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -64.66 -33.92 77.08 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.103 177.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . 0.44 ' O ' ' HG2' ' A' ' 98' ' ' GLU . . . -60.5 -52.24 53.8 Favored Glycine 0 C--N 1.354 1.579 0 O-C-N 124.474 1.109 . . . . 0.0 112.269 -178.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 22.1 mt -55.73 -53.8 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 124.653 1.181 . . . . 0.0 109.933 -179.143 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 88.8 mt -57.05 -51.34 70.24 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.954 0 CA-C-N 114.47 -1.241 . . . . 0.0 111.638 -177.074 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.03 -30.44 69.66 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -178.355 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' A' ' 94' ' ' GLY . 31.2 mm-40 -63.15 -41.35 99.26 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.4 0.68 . . . . 0.0 109.751 177.107 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.452 HG21 HG23 ' A' ' 60' ' ' ILE . 58.5 mt -76.23 -35.25 27.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 -177.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -60.77 -48.14 83.14 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.024 0.93 . . . . 0.0 111.516 178.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -70.25 -36.85 74.75 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.952 -179.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 62.3 mtm -69.4 -52.01 31.02 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.905 0.482 . . . . 0.0 111.645 -178.033 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 20.0 mt -59.89 -49.08 85.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 O-C-N 123.677 0.611 . . . . 0.0 110.43 178.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.34 -28.21 69.85 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -178.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 32.8 t -81.4 -35.57 30.58 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 122.789 0.435 . . . . 0.0 111.551 -178.056 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -81.7 -30.27 32.64 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 122.368 0.267 . . . . 0.0 111.48 -178.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -76.45 -46.53 26.56 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 122.474 0.309 . . . . 0.0 110.457 178.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 86.9 mm-40 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.877 -0.583 . . . . 0.0 110.316 179.605 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 48.7 pttt . . . . . 0 N--CA 1.474 0.765 0 CA-C-O 120.936 0.398 . . . . 0.0 110.249 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.574 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.7 tmtp? -145.34 132.85 20.81 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 -169.261 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.521 HD11 HG13 ' A' ' 96' ' ' ILE . 10.4 tt -121.23 135.16 55.18 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 107.705 -1.22 . . . . 0.0 107.705 176.145 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.57 HD12 HD13 ' A' ' 50' ' ' LEU . 15.9 pt -127.92 161.27 36.33 Favored 'Isoleucine or valine' 0 C--O 1.242 0.705 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 174.75 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.598 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -152.62 167.54 28.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.12 178.654 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.544 HD21 ' HG3' ' A' ' 41' ' ' GLN . 2.5 tt -140.73 114.97 9.26 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 -178.344 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.546 ' HA ' ' O ' ' A' ' 64' ' ' SER . 56.2 m -107.08 113.14 26.42 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.817 0.847 . . . . 0.0 108.973 176.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -128.87 123.89 33.84 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 122.596 0.358 . . . . 0.0 111.225 -177.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.76 ' SG ' HD13 ' A' ' 85' ' ' LEU . 1.2 m -133.55 149.77 73.09 Favored Pre-proline 0 N--CA 1.479 0.996 0 C-N-CA 124.022 0.929 . . . . 0.0 110.362 177.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -79.52 -11.86 14.12 Favored 'Trans proline' 0 C--N 1.375 1.928 0 C-N-CA 122.596 2.197 . . . . 0.0 112.013 176.657 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 21.8 mmt -73.33 -50.61 21.16 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.309 1.043 . . . . 0.0 110.348 -176.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 158.66 -175.18 35.75 Favored Glycine 0 C--N 1.346 1.105 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.107 -179.287 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 74.3 mt -78.6 -16.47 57.34 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.111 0.564 . . . . 0.0 112.357 -176.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -57.69 -51.52 69.21 Favored 'General case' 0 C--O 1.25 1.088 0 CA-C-O 121.29 0.567 . . . . 0.0 111.309 177.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.438 ' ND1' HD22 ' A' ' 85' ' ' LEU . 4.3 t-80 -67.06 -38.54 85.97 Favored 'General case' 0 C--O 1.248 1.017 0 CA-C-N 114.866 -1.061 . . . . 0.0 110.213 -176.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 44.8 p -67.98 -35.68 78.76 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.968 -178.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -70.59 -26.77 63.67 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 122.839 0.455 . . . . 0.0 111.789 178.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 38.1 mtm -68.56 -43.06 77.41 Favored 'General case' 0 N--CA 1.484 1.233 0 CA-C-N 117.717 0.235 . . . . 0.0 110.603 174.009 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.91 -41.94 95.16 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.768 174.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.73 -43.8 98.14 Favored 'General case' 0 C--O 1.216 -0.705 0 CA-C-N 115.201 -0.909 . . . . 0.0 110.743 179.005 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.438 ' O ' ' HG3' ' A' ' 27' ' ' GLU . 9.0 tp-100 -62.71 -44.47 96.14 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.245 0.618 . . . . 0.0 110.816 -178.316 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.535 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -68.02 -49.18 63.1 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.65 -175.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 98.6 mt -64.24 -31.21 72.32 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.241 0.616 . . . . 0.0 111.694 177.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.507 ' O ' HG23 ' A' ' 30' ' ' VAL . 30.7 tt0 -63.09 -56.41 17.14 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.632 0.773 . . . . 0.0 110.17 179.113 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.438 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 49.7 mt-10 -55.05 -46.73 75.37 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 124.187 0.929 . . . . 0.0 110.657 -179.525 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.24 -51.01 71.54 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.322 1.049 . . . . 0.0 111.625 -178.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.14 -22.73 65.77 Favored 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 113.788 1.032 . . . . 0.0 113.788 178.053 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.507 HG23 ' O ' ' A' ' 26' ' ' GLU . 52.1 t -76.56 -43.66 34.87 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 178.748 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -68.45 -26.73 65.65 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 114.831 -1.077 . . . . 0.0 110.354 176.465 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.401 ' HB1' ' HE1' ' A' ' 34' ' ' TYR . . . -76.52 -26.48 55.26 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.211 1.004 . . . . 0.0 111.636 176.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 102.75 15.03 25.63 Favored Glycine 0 C--N 1.349 1.277 0 N-CA-C 114.654 0.622 . . . . 0.0 114.654 168.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.401 ' HE1' ' HB1' ' A' ' 32' ' ' ALA . 1.7 m-85 -95.54 162.54 13.59 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-N 117.844 0.822 . . . . 0.0 109.549 176.028 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.574 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 43.4 tt0 -74.0 126.19 29.94 Favored 'General case' 0 C--O 1.222 -0.373 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 160.732 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.48 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 12.5 p -115.11 132.66 63.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-N 118.772 0.715 . . . . 0.0 111.093 -172.68 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 49.3 tptt -142.33 117.55 10.12 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 179.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.598 HG12 ' HB3' ' A' ' 7' ' ' ALA . 55.9 mt -121.1 112.02 33.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -174.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.467 ' HG3' ' HA ' ' A' ' 49' ' ' ARG . 41.9 tt0 -71.09 138.91 50.13 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.249 1.02 . . . . 0.0 109.176 172.882 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 7.0 p -128.52 122.1 30.34 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 123.895 0.878 . . . . 0.0 108.911 -177.764 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.544 ' HG3' HD21 ' A' ' 8' ' ' LEU . 2.5 mt-30 -122.04 151.75 40.51 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.622 0.725 . . . . 0.0 111.675 -176.218 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -161.31 173.1 37.68 Favored Glycine 0 C--O 1.241 0.554 0 CA-C-N 114.086 -1.415 . . . . 0.0 110.239 172.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.02 -16.45 63.72 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 122.919 0.487 . . . . 0.0 110.993 176.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -75.7 -34.82 60.43 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 123.821 0.848 . . . . 0.0 110.674 172.067 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 154.26 -176.99 31.91 Favored Glycine 0 C--N 1.348 1.198 0 CA-C-N 116.348 -0.387 . . . . 0.0 113.163 178.292 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.492 HG23 ' HG2' ' A' ' 41' ' ' GLN . 44.1 mt -108.73 156.15 9.44 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 124.434 1.094 . . . . 0.0 109.677 -178.187 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -151.2 149.61 29.63 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.821 0.848 . . . . 0.0 109.514 178.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.6 t30 60.4 34.68 20.6 Favored 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 124.135 0.974 . . . . 0.0 110.623 173.079 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.467 ' HA ' ' HG3' ' A' ' 39' ' ' GLU . 23.8 ttp180 -63.2 138.64 58.61 Favored 'General case' 0 C--N 1.351 0.652 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 -168.256 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.57 HD13 HD12 ' A' ' 6' ' ' ILE . 57.8 mt -80.4 121.55 25.86 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 113.747 -1.57 . . . . 0.0 111.504 -177.833 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 43.8 p -87.62 166.92 14.35 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 114.675 -1.148 . . . . 0.0 110.229 -177.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -53.13 -34.03 54.95 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.636 0.774 . . . . 0.0 111.898 179.056 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -68.28 -48.19 65.67 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 123.906 0.754 . . . . 0.0 111.271 178.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -58.85 -41.88 88.04 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.398 0.679 . . . . 0.0 111.236 -178.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.5 HG22 ' HG3' ' A' ' 78' ' ' ARG . 41.1 mt -76.09 -35.39 28.63 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.299 -173.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.82 -43.81 62.23 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.23 0.612 . . . . 0.0 111.181 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -85.44 -1.31 56.9 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.436 0.694 . . . . 0.0 111.985 -177.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.98 110.2 4.33 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.034 0.534 . . . . 0.0 111.202 178.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 16.4 m -61.55 -36.0 79.35 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 124.299 1.04 . . . . 0.0 110.082 167.012 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.535 HG23 HG21 ' A' ' 99' ' ' ILE . 55.6 mt -135.26 143.13 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 C-N-CA 123.885 0.874 . . . . 0.0 110.416 -179.381 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 23.0 mt -135.17 123.49 39.67 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 123.776 0.83 . . . . 0.0 109.165 173.608 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.2 mp -111.65 140.61 30.31 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.332 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 173.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . 0.541 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 6.9 m170 -114.36 84.89 2.13 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 168.473 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.546 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 15.9 m -81.39 81.98 7.36 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 114.821 -1.081 . . . . 0.0 109.483 176.002 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 30.2 m -125.33 162.72 27.49 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-O 121.782 0.801 . . . . 0.0 112.114 -171.724 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -114.98 -28.35 7.05 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 114.029 -1.441 . . . . 0.0 108.776 173.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 22.8 m -137.11 168.6 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 125.371 1.469 . . . . 0.0 108.955 178.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 62.1 m -66.42 119.28 61.24 Favored Pre-proline 0 CA--C 1.551 1.013 0 C-N-CA 123.191 0.597 . . . . 0.0 111.02 179.615 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.5 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 57.9 Cg_endo -72.68 146.3 43.1 Favored 'Trans proline' 0 C--N 1.371 1.718 0 C-N-CA 122.406 2.07 . . . . 0.0 111.12 170.285 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.451 ' H ' ' NE2' ' A' ' 41' ' ' GLN . 28.1 mm-40 -64.77 -31.98 73.46 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 123.12 0.568 . . . . 0.0 111.826 -175.102 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -102.81 25.6 9.06 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.461 0.704 . . . . 0.0 111.731 -177.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.5 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 5.8 p30 -60.89 -27.65 68.31 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.088 0.555 . . . . 0.0 110.726 174.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -59.94 -27.28 66.66 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 125.19 1.396 . . . . 0.0 112.985 177.344 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 81.6 mtt180 -68.59 -21.01 64.54 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.285 0.634 . . . . 0.0 111.85 178.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.468 ' HB3' HG21 ' A' ' 80' ' ' VAL . 32.3 m-85 -111.31 7.26 20.96 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.371 1.069 . . . . 0.0 111.236 -174.593 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -53.56 -47.61 69.89 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.761 1.224 . . . . 0.0 113.279 -172.392 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 94.4 p -101.55 4.2 40.81 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.277 0.631 . . . . 0.0 112.348 -174.005 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.5 ' HG3' HG22 ' A' ' 55' ' ' ILE . 29.8 mmt180 -101.65 162.67 12.73 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 122.685 0.394 . . . . 0.0 111.062 -174.216 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -76.7 91.37 3.45 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.357 0.663 . . . . 0.0 110.644 -177.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.468 HG21 ' HB3' ' A' ' 75' ' ' PHE . 31.3 t -109.78 148.96 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 123.815 0.846 . . . . 0.0 110.724 -175.873 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -121.24 89.85 3.21 Favored 'General case' 0 C--N 1.348 0.509 0 C-N-CA 124.448 1.099 . . . . 0.0 108.706 -178.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.541 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 41.9 mt-10 -79.07 122.49 26.28 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.372 -175.082 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.44 HG13 ' HA ' ' A' ' 64' ' ' SER . 46.1 pt -135.69 -176.55 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.85 0 C-N-CA 124.962 1.305 . . . . 0.0 108.954 178.254 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 23.8 p -81.4 152.48 27.42 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-O 120.878 0.37 . . . . 0.0 110.211 170.244 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.76 HD13 ' SG ' ' A' ' 11' ' ' CYS . 6.3 tt -63.86 -29.82 70.97 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.064 175.716 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -63.9 -44.75 92.05 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.85 176.039 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -60.63 -32.12 71.29 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 122.921 0.488 . . . . 0.0 110.973 -177.615 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.11 -35.87 81.66 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.05 0.94 . . . . 0.0 112.748 178.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 59.5 mt -76.41 -38.11 31.96 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 O-C-N 123.648 0.593 . . . . 0.0 110.621 -176.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.21 -56.94 3.11 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 122.894 0.478 . . . . 0.0 112.069 -177.675 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -98.21 29.78 3.4 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.11 0.964 . . . . 0.0 110.651 -169.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.535 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -43.74 -63.08 0.91 Allowed 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.35 1.06 . . . . 0.0 113.316 -176.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.96 -34.04 75.39 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.357 -179.53 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . 0.444 ' O ' ' HG2' ' A' ' 98' ' ' GLU . . . -63.83 -47.48 85.77 Favored Glycine 0 C--N 1.353 1.52 0 O-C-N 124.127 0.892 . . . . 0.0 112.613 -179.321 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 19.1 mt -61.7 -53.54 46.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 123.947 0.899 . . . . 0.0 110.461 -177.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.521 HG13 HD11 ' A' ' 5' ' ' LEU . 1.9 mp -55.78 -51.04 64.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 O-C-N 124.015 0.822 . . . . 0.0 110.439 -178.615 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.72 -28.29 67.53 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 123.565 0.54 . . . . 0.0 111.781 -176.074 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 94' ' ' GLY . 63.6 mm-40 -62.0 -37.17 83.83 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.304 0.642 . . . . 0.0 109.857 174.34 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.535 HG21 HG23 ' A' ' 60' ' ' ILE . 33.7 mt -79.75 -37.84 18.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.622 -178.413 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.475 ' HG3' ' O ' ' A' ' 96' ' ' ILE . 32.2 mt-10 -60.17 -41.44 92.84 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.276 0.631 . . . . 0.0 110.974 178.191 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -74.55 -31.95 62.27 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 123.406 0.441 . . . . 0.0 110.988 -178.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 67.7 mtm -66.1 -37.95 87.02 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 122.562 0.345 . . . . 0.0 111.07 172.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.432 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 45.1 mt -69.89 -40.63 79.05 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.855 0 C-N-CA 123.161 0.584 . . . . 0.0 109.555 175.439 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.12 -18.61 64.68 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.503 0.721 . . . . 0.0 111.212 177.159 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 33.3 t -86.61 -41.48 14.23 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.421 0.688 . . . . 0.0 110.849 179.052 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.432 ' HG2' ' HA ' ' A' ' 103' ' ' ILE . 18.6 pt-20 -77.26 -28.4 53.54 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 122.828 0.451 . . . . 0.0 111.504 -176.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 79.1 mm-40 -87.99 -36.83 16.82 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 122.923 0.489 . . . . 0.0 111.044 -179.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 85.0 mm-40 . . . . . 0 N--CA 1.478 0.951 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 176.436 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.583 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 17.1 pttt . . . . . 0 C--O 1.251 1.178 0 CA-C-O 121.618 0.723 . . . . 0.0 111.271 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.574 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.0 tmtp? -147.53 146.01 29.3 Favored 'General case' 0 CA--C 1.55 0.944 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.257 -172.104 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.426 ' N ' ' HD3' ' A' ' 4' ' ' LYS . 8.5 tt -132.8 135.74 45.86 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.608 1.163 . . . . 0.0 108.116 176.116 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 20.4 pt -125.51 162.8 27.77 Favored 'Isoleucine or valine' 0 C--O 1.242 0.682 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 170.134 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.579 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -150.81 170.54 19.01 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 122.986 0.514 . . . . 0.0 110.028 177.184 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.7 tt -143.91 121.92 12.1 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 107.489 -1.301 . . . . 0.0 107.489 -178.114 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.554 ' HA ' ' O ' ' A' ' 64' ' ' SER . 64.0 m -114.8 113.62 24.48 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.874 0.87 . . . . 0.0 108.984 178.274 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.417 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -126.88 117.83 23.38 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 -174.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.772 ' SG ' HD13 ' A' ' 85' ' ' LEU . 71.5 m -118.33 144.59 35.39 Favored Pre-proline 0 N--CA 1.481 1.095 0 C-N-CA 124.687 1.195 . . . . 0.0 110.039 176.5 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -80.81 -8.99 13.32 Favored 'Trans proline' 0 C--N 1.368 1.597 0 C-N-CA 122.658 2.239 . . . . 0.0 112.671 172.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 53.5 tpp -78.71 -66.7 0.83 Allowed 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.559 0.743 . . . . 0.0 109.873 176.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 179.92 -172.84 44.47 Favored Glycine 0 C--N 1.342 0.885 0 CA-C-N 115.569 -0.741 . . . . 0.0 112.24 -176.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 89.5 mt -82.39 -13.64 56.51 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.231 0.826 . . . . 0.0 113.231 -174.399 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.08 -49.92 75.24 Favored 'General case' 0 CA--C 1.556 1.207 0 CA-C-O 121.098 0.475 . . . . 0.0 112.163 -179.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.464 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 10.0 t-160 -67.88 -39.44 83.69 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.103 -178.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 30.9 p -65.56 -32.41 73.99 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.053 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 14.7 m-30 -73.76 -30.43 62.78 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.484 0.714 . . . . 0.0 112.109 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 67.8 mtm -70.18 -36.48 74.68 Favored 'General case' 0 N--CA 1.487 1.423 0 CA-C-O 120.674 0.274 . . . . 0.0 110.452 173.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.26 -38.13 75.07 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.754 173.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.84 -42.5 81.34 Favored 'General case' 0 C--O 1.214 -0.768 0 C-N-CA 123.735 0.814 . . . . 0.0 110.575 -179.157 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.468 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 20.2 tp60 -64.79 -44.49 89.8 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 122.949 0.499 . . . . 0.0 109.875 177.672 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.625 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -62.45 -51.79 66.1 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.836 -176.295 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 98.5 mt -67.48 -29.98 69.57 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.581 0.752 . . . . 0.0 111.511 178.402 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.504 ' HA ' HG21 ' A' ' 36' ' ' VAL . 32.1 tt0 -60.36 -58.54 8.07 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 123.713 0.633 . . . . 0.0 109.432 176.377 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 23' ' ' GLN . 12.1 mm-40 -51.31 -50.35 59.53 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 124.746 1.279 . . . . 0.0 110.736 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.82 -49.73 72.47 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.596 1.159 . . . . 0.0 112.153 -179.359 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.53 -29.83 70.52 Favored 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 176.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.5 HG23 ' O ' ' A' ' 26' ' ' GLU . 53.2 t -72.45 -36.65 55.17 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -179.54 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 14.1 mm-40 -71.37 -31.43 67.3 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.466 1.106 . . . . 0.0 110.801 177.549 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.77 -23.23 60.79 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.749 0.819 . . . . 0.0 111.616 175.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.13 23.21 27.86 Favored Glycine 0 C--N 1.348 1.2 0 N-CA-C 114.953 0.741 . . . . 0.0 114.953 166.003 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.583 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -118.29 178.03 4.59 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.294 0.638 . . . . 0.0 110.889 169.821 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.574 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 43.0 tt0 -74.51 147.47 41.83 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.432 178.124 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.504 HG21 ' HA ' ' A' ' 26' ' ' GLU . 15.0 p -127.12 139.33 52.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 122.756 0.422 . . . . 0.0 110.176 178.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.2 tptt -145.96 110.04 4.94 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 173.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.579 HG12 ' HB3' ' A' ' 7' ' ' ALA . 47.3 mt -115.07 111.33 35.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 C-N-CA 122.734 0.413 . . . . 0.0 111.338 -176.68 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.46 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 32.7 tt0 -73.51 145.66 45.44 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.448 0.699 . . . . 0.0 109.195 169.415 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.431 HG22 ' HB2' ' A' ' 9' ' ' CYS . 13.3 p -129.69 113.96 15.41 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 123.699 0.799 . . . . 0.0 108.877 -179.839 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.49 HE22 ' HB2' ' A' ' 70' ' ' GLU . 45.2 mt-30 -105.21 143.64 33.11 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.264 0.626 . . . . 0.0 110.223 179.441 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.409 ' HA2' ' O ' ' A' ' 11' ' ' CYS . . . -162.17 163.05 34.7 Favored Glycine 0 C--N 1.336 0.544 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.928 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.51 -23.61 67.47 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.186 0.595 . . . . 0.0 110.924 173.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -73.52 -35.06 65.53 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 124.431 1.092 . . . . 0.0 111.278 175.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 160.4 -174.46 37.12 Favored Glycine 0 C--N 1.347 1.174 0 CA-C-N 116.135 -0.484 . . . . 0.0 112.332 -178.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 76.7 mt -123.36 134.9 64.95 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 123.439 0.696 . . . . 0.0 109.153 174.471 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -127.77 149.99 50.01 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.313 1.045 . . . . 0.0 109.675 -178.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 6.8 t30 61.7 40.13 13.5 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 124.504 1.122 . . . . 0.0 110.58 173.332 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 16.1 tpp180 -47.81 122.59 5.11 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 125.576 1.55 . . . . 0.0 112.603 -176.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.46 ' HG ' ' HB2' ' A' ' 39' ' ' GLU . 42.4 mt -69.39 133.6 47.99 Favored 'General case' 0 C--O 1.241 0.657 0 C-N-CA 124.419 1.088 . . . . 0.0 111.032 174.712 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 44.8 p -91.7 163.37 14.11 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 115.113 -0.948 . . . . 0.0 109.085 175.006 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.33 -26.46 66.59 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 122.527 0.331 . . . . 0.0 110.895 173.501 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.462 HE21 ' HG3' ' A' ' 57' ' ' GLU . 23.2 tp60 -70.0 -43.34 71.59 Favored 'General case' 0 C--N 1.355 0.834 0 C-N-CA 123.788 0.835 . . . . 0.0 110.634 177.039 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 45.0 m-20 -58.18 -43.21 87.39 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 122.807 0.443 . . . . 0.0 110.677 176.24 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.401 HG22 ' HG3' ' A' ' 78' ' ' ARG . 22.9 mt -70.24 -27.76 33.2 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 O-C-N 123.986 0.804 . . . . 0.0 110.614 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.47 -40.51 42.85 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.916 0.886 . . . . 0.0 111.817 179.541 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.462 ' HG3' HE21 ' A' ' 53' ' ' GLN . 46.6 mt-10 -74.4 -32.0 62.54 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.903 0.881 . . . . 0.0 111.117 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -52.75 99.37 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.658 0 O-C-N 124.747 1.279 . . . . 0.0 113.099 -171.177 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 26.1 m -62.42 -34.5 76.87 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 123.551 0.741 . . . . 0.0 109.163 167.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.488 HG23 HG21 ' A' ' 99' ' ' ILE . 76.7 mt -132.33 140.54 47.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.397 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.408 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 21.8 mt -130.38 139.06 52.3 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 172.072 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -126.81 128.95 71.38 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 173.631 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 13.5 m170 -103.54 86.97 2.73 Favored 'General case' 0 N--CA 1.489 1.49 0 CA-C-N 118.853 0.751 . . . . 0.0 109.486 169.457 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.554 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 19.6 m -82.86 82.4 8.17 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 124.653 1.181 . . . . 0.0 109.631 175.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 26.9 m -127.8 163.88 30.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-O 121.643 0.735 . . . . 0.0 111.719 -169.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -117.73 -14.9 10.15 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 114.322 -1.308 . . . . 0.0 109.594 174.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 15.2 m -132.07 177.99 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 125.283 1.433 . . . . 0.0 109.359 178.356 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 81.1 m -72.76 114.89 34.5 Favored Pre-proline 0 CA--C 1.545 0.767 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 167.235 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.607 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 33.3 Cg_endo -68.94 146.65 65.99 Favored 'Trans proline' 0 C--N 1.374 1.908 0 C-N-CA 121.788 1.659 . . . . 0.0 110.574 174.747 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.49 ' HB2' HE22 ' A' ' 41' ' ' GLN . 20.1 mm-40 -65.13 -33.7 76.65 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-O 121.387 0.613 . . . . 0.0 111.142 -172.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -96.85 9.8 40.81 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.778 -174.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.607 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 8.5 t30 -55.28 -34.98 64.57 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 124.112 0.965 . . . . 0.0 112.016 179.016 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -59.55 -22.91 62.37 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 124.993 1.317 . . . . 0.0 113.444 177.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 29.3 mtp180 -87.13 -18.71 29.82 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.877 0.871 . . . . 0.0 111.103 -178.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.442 ' HB3' HG21 ' A' ' 80' ' ' VAL . 70.6 m-85 -102.56 7.71 39.99 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 124.191 0.996 . . . . 0.0 110.745 178.31 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.8 tp10 -57.48 -51.01 71.17 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 124.696 1.198 . . . . 0.0 112.453 -172.371 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 56.6 p -86.94 -10.55 52.99 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.226 0.61 . . . . 0.0 112.145 -177.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.401 ' HG3' HG22 ' A' ' 55' ' ' ILE . 26.6 mmt180 -89.72 157.3 18.03 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.59 0.756 . . . . 0.0 110.998 -177.109 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -78.28 95.73 5.09 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.491 0.716 . . . . 0.0 110.946 -174.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.442 HG21 ' HB3' ' A' ' 75' ' ' PHE . 44.6 t -110.85 140.91 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 123.398 0.679 . . . . 0.0 110.784 -177.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -109.53 91.3 3.59 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 124.511 1.124 . . . . 0.0 108.95 176.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -76.78 133.0 39.55 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.128 -177.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.407 HG13 ' HA ' ' A' ' 64' ' ' SER . 31.5 pt -145.06 -173.25 0.46 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.838 0 C-N-CA 125.371 1.468 . . . . 0.0 108.438 176.168 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 35.5 p -86.78 153.54 21.6 Favored 'General case' 0 C--O 1.24 0.591 0 CA-C-O 121.211 0.529 . . . . 0.0 110.274 169.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.772 HD13 ' SG ' ' A' ' 11' ' ' CYS . 6.0 tt -66.27 -29.75 70.04 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.702 176.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -59.31 -45.93 89.97 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 123.884 0.874 . . . . 0.0 110.957 172.23 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -62.35 -33.35 74.55 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 123.894 0.746 . . . . 0.0 110.981 -179.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.463 ' HB2' ' HB3' ' A' ' 64' ' ' SER . . . -63.54 -31.51 72.7 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.79 0.836 . . . . 0.0 112.557 179.594 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 74.1 mt -79.21 -57.05 5.72 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.218 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.72 -47.43 53.95 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 115.865 -0.607 . . . . 0.0 112.167 -173.68 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -105.16 22.91 14.51 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.156 0.983 . . . . 0.0 110.962 -170.483 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.625 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -39.42 -61.98 0.73 Allowed 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 124.796 1.238 . . . . 0.0 113.985 -174.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.65 -30.82 69.61 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 114.564 -1.198 . . . . 0.0 111.345 -178.242 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.54 -45.24 95.2 Favored Glycine 0 C--N 1.35 1.342 0 O-C-N 123.942 0.776 . . . . 0.0 111.939 179.251 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 13.5 mt -60.79 -56.05 20.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.338 1.055 . . . . 0.0 110.471 -179.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.7 mp -56.23 -49.76 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 O-C-N 123.781 0.675 . . . . 0.0 111.011 -178.374 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.62 -27.69 66.25 Favored 'General case' 0 N--CA 1.485 1.318 0 O-C-N 123.294 0.371 . . . . 0.0 111.342 -176.77 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -62.33 -42.03 99.05 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.418 0.687 . . . . 0.0 109.856 175.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.488 HG21 HG23 ' A' ' 60' ' ' ILE . 25.9 mt -76.83 -36.46 26.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 -176.01 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -61.77 -44.14 97.47 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-N 114.539 -1.209 . . . . 0.0 111.794 176.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -76.4 -29.52 57.13 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 123.123 0.264 . . . . 0.0 110.904 -176.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 69.0 mtm -69.0 -54.12 16.92 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 122.749 0.42 . . . . 0.0 110.313 176.051 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 62.5 mt -60.36 -45.92 95.8 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 123.165 0.586 . . . . 0.0 110.263 178.529 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.495 ' O ' ' HG2' ' A' ' 108' ' ' GLN . . . -56.08 -48.5 75.97 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 122.869 0.467 . . . . 0.0 110.811 179.375 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 22.9 t -63.73 -43.01 97.8 Favored 'General case' 0 N--CA 1.48 1.038 0 O-C-N 123.785 0.678 . . . . 0.0 111.614 -171.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -74.54 -23.84 58.86 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.887 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -87.51 -19.05 28.48 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.655 0.382 . . . . 0.0 111.093 175.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.495 ' HG2' ' O ' ' A' ' 104' ' ' ALA . 86.0 mm-40 . . . . . 0 C--O 1.253 1.264 0 C-N-CA 123.369 0.668 . . . . 0.0 109.236 173.678 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.556 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 5.8 pttt . . . . . 0 N--CA 1.48 1.063 0 CA-C-O 120.859 0.361 . . . . 0.0 110.178 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.575 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.6 tmtp? -145.14 144.08 30.7 Favored 'General case' 0 CA--C 1.556 1.208 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 -178.319 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.46 ' N ' ' HD3' ' A' ' 4' ' ' LYS . 9.1 tt -130.04 136.56 49.51 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.03 1.332 . . . . 0.0 107.583 174.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.469 HG13 HG23 ' A' ' 61' ' ' ILE . 21.4 pt -126.76 159.67 36.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 170.658 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.604 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -149.23 166.33 29.21 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 123.001 0.52 . . . . 0.0 110.107 177.052 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.584 HD21 ' HG3' ' A' ' 41' ' ' GLN . 3.1 tt -139.3 112.16 7.91 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 -178.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.565 ' HA ' ' O ' ' A' ' 64' ' ' SER . 62.9 m -99.94 114.31 27.48 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.9 0.88 . . . . 0.0 109.39 175.151 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.439 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -131.04 122.82 27.44 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 122.768 0.427 . . . . 0.0 111.208 -179.165 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.759 ' SG ' HD13 ' A' ' 85' ' ' LEU . 1.2 m -134.88 148.15 65.84 Favored Pre-proline 0 N--CA 1.478 0.945 0 C-N-CA 123.844 0.858 . . . . 0.0 110.619 178.495 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -79.57 -12.49 13.8 Favored 'Trans proline' 0 C--N 1.373 1.856 0 C-N-CA 122.74 2.294 . . . . 0.0 111.243 173.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 45.7 mtt -65.51 -42.59 91.88 Favored 'General case' 0 C--N 1.352 0.68 0 C-N-CA 125.086 1.354 . . . . 0.0 109.746 177.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 141.94 -177.94 21.04 Favored Glycine 0 C--N 1.348 1.233 0 CA-C-N 115.483 -0.781 . . . . 0.0 111.962 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 29.9 mt -73.36 -25.04 60.43 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -177.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.66 -41.99 91.84 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-O 121.091 0.472 . . . . 0.0 111.049 179.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.532 ' ND1' HD22 ' A' ' 85' ' ' LEU . 12.9 t-80 -67.77 -42.64 81.41 Favored 'General case' 0 C--O 1.251 1.133 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.282 179.305 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.424 ' HA ' HD11 ' A' ' 85' ' ' LEU . 43.5 p -66.5 -30.4 70.72 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 115.085 -0.961 . . . . 0.0 111.214 -179.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 18.8 m-30 -71.12 -32.66 69.28 Favored 'General case' 0 C--N 1.351 0.639 0 C-N-CA 123.317 0.647 . . . . 0.0 110.967 179.027 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 47.6 mtm -65.65 -39.3 91.25 Favored 'General case' 0 N--CA 1.486 1.335 0 CA-C-O 120.74 0.305 . . . . 0.0 110.713 176.126 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.22 -37.65 72.02 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.417 174.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.54 -38.55 91.4 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.717 0.807 . . . . 0.0 110.816 179.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 7.6 tp-100 -68.98 -45.65 70.08 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.027 0.531 . . . . 0.0 110.173 179.042 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.488 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -59.93 -57.21 13.86 Favored 'General case' 0 C--O 1.242 0.675 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.298 -177.785 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.429 HD11 ' OG ' ' A' ' 64' ' ' SER . 94.7 mt -64.2 -32.0 73.41 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.005 0.522 . . . . 0.0 111.852 -178.58 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.536 ' HA ' HG21 ' A' ' 36' ' ' VAL . 32.4 tt0 -61.64 -56.39 20.35 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 110.121 -0.326 . . . . 0.0 110.121 -179.283 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.476 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 44.5 mm-40 -54.02 -49.07 69.73 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 124.584 1.177 . . . . 0.0 111.502 179.229 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.42 ' HB3' HD12 ' A' ' 96' ' ' ILE . . . -65.48 -36.19 83.14 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.438 0.695 . . . . 0.0 112.099 -176.603 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.93 -24.13 58.45 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.06 0.544 . . . . 0.0 111.896 177.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 26' ' ' GLU . 54.5 t -68.68 -41.34 82.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 174.34 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.476 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 10.0 mm-40 -70.33 -25.9 63.51 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 114.027 -1.442 . . . . 0.0 111.185 179.363 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -82.77 -2.17 53.68 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 123.474 0.71 . . . . 0.0 112.407 178.229 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 87.84 17.72 57.57 Favored Glycine 0 C--N 1.35 1.346 0 N-CA-C 115.675 1.03 . . . . 0.0 115.675 164.034 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.556 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -130.16 175.37 8.97 Favored 'General case' 0 N--CA 1.484 1.263 0 CA-C-N 117.908 0.854 . . . . 0.0 112.639 175.579 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.575 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 37.0 tt0 -72.21 149.29 44.75 Favored 'General case' 0 C--N 1.353 0.737 0 CA-C-N 114.675 -1.148 . . . . 0.0 108.95 175.435 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.536 HG21 ' HA ' ' A' ' 26' ' ' GLU . 8.1 p -133.16 135.52 56.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 122.65 0.38 . . . . 0.0 110.2 -179.553 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 49.6 tptt -142.4 113.9 7.86 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 175.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.604 HG12 ' HB3' ' A' ' 7' ' ' ALA . 43.1 mt -116.78 110.35 31.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 122.838 0.455 . . . . 0.0 111.699 -176.325 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -74.0 144.97 44.94 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.421 0.688 . . . . 0.0 109.192 172.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 10.6 p -128.9 113.89 15.8 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.772 0.829 . . . . 0.0 109.46 -177.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.584 ' HG3' HD21 ' A' ' 8' ' ' LEU . 8.1 mt-30 -109.82 141.42 42.52 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 177.611 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -165.35 -177.22 37.58 Favored Glycine 0 C--O 1.241 0.593 0 N-CA-C 111.836 -0.506 . . . . 0.0 111.836 179.607 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.02 -31.9 70.38 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.366 0.666 . . . . 0.0 111.271 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -66.33 -40.38 89.85 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.447 0.699 . . . . 0.0 110.951 177.291 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 150.27 -158.6 27.75 Favored Glycine 0 C--N 1.344 1.023 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.989 -176.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 66.1 mt -116.14 137.48 49.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 C-N-CA 123.578 0.751 . . . . 0.0 109.556 179.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -136.83 151.11 48.77 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.111 0.964 . . . . 0.0 109.308 -176.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 17.2 t30 60.61 36.27 19.77 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 124.105 0.962 . . . . 0.0 110.242 177.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 14.5 tpp180 -43.59 125.63 4.1 Favored 'General case' 0 C--N 1.362 1.109 0 C-N-CA 126.292 1.837 . . . . 0.0 113.269 -174.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 50.1 mt -77.61 128.46 34.16 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.724 171.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 45.2 p -96.15 165.51 12.19 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.313 -0.858 . . . . 0.0 108.843 176.057 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.95 -29.94 67.51 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 122.697 0.399 . . . . 0.0 111.463 178.081 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.465 HE21 ' HG3' ' A' ' 57' ' ' GLU . 26.5 tp60 -62.65 -41.47 99.06 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.839 0.856 . . . . 0.0 111.508 176.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.4 ' HB3' HG21 ' A' ' 6' ' ' ILE . 56.5 m-20 -63.81 -45.09 91.23 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 122.98 0.512 . . . . 0.0 110.545 176.835 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 10.5 mt -69.11 -28.54 39.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 O-C-N 123.836 0.71 . . . . 0.0 110.847 -178.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.68 -44.97 61.12 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.721 0.808 . . . . 0.0 111.216 -179.114 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.465 ' HG3' HE21 ' A' ' 53' ' ' GLN . 40.9 mt-10 -84.24 -11.19 56.89 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.303 0.641 . . . . 0.0 111.643 -179.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.44 100.67 0.19 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.107 0.563 . . . . 0.0 111.83 -177.554 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 32.5 m -61.9 -40.94 97.17 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.218 168.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.529 HG23 HG21 ' A' ' 99' ' ' ILE . 68.4 mt -128.47 140.19 49.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.239 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.469 HG23 HG13 ' A' ' 6' ' ' ILE . 20.4 mt -131.21 133.8 62.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 171.75 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.4 mp -120.7 136.05 58.96 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 173.374 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . 0.484 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 8.5 m170 -107.76 86.37 2.29 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 167.544 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.565 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 33.9 m -79.22 79.91 5.62 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 114.529 -1.214 . . . . 0.0 109.208 175.598 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 36.0 m -127.54 161.09 35.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 121.553 0.692 . . . . 0.0 112.034 -169.642 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -118.34 -17.19 9.53 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.33 1.452 . . . . 0.0 108.751 174.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 11.8 m -133.93 160.1 42.07 Favored 'Isoleucine or valine' 0 C--N 1.35 0.621 0 C-N-CA 125.399 1.48 . . . . 0.0 109.096 175.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 41.6 m -69.78 109.98 5.69 Favored Pre-proline 0 CA--C 1.554 1.115 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 174.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -67.13 149.36 82.02 Favored 'Trans proline' 0 C--N 1.379 2.14 0 C-N-CA 122.381 2.054 . . . . 0.0 111.455 -177.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.402 ' H ' ' NE2' ' A' ' 41' ' ' GLN . 6.7 mm-40 -61.64 -31.64 71.75 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.223 0.609 . . . . 0.0 111.938 -171.561 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -104.14 21.24 16.85 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.482 0.713 . . . . 0.0 111.707 -175.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -60.66 -28.92 68.95 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.15 0.58 . . . . 0.0 111.841 -176.497 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -58.14 -32.59 68.32 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.164 0.985 . . . . 0.0 113.264 -179.103 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 74.4 mtt-85 -61.24 -38.53 87.01 Favored 'General case' 0 N--CA 1.483 1.224 0 CA-C-O 121.944 0.878 . . . . 0.0 110.52 177.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.445 ' HB3' HG21 ' A' ' 80' ' ' VAL . 41.0 m-85 -94.97 -19.83 19.89 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 113.794 -1.548 . . . . 0.0 111.001 -172.419 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -62.18 -30.08 70.81 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.171 0.988 . . . . 0.0 111.322 -176.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 22.6 t -81.53 -7.22 59.56 Favored 'General case' 0 CA--C 1.554 1.109 0 C-N-CA 123.824 0.849 . . . . 0.0 111.675 178.311 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 14.5 mmt85 -116.95 169.74 9.16 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.292 1.037 . . . . 0.0 110.24 -171.196 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -78.53 96.44 5.44 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.257 0.623 . . . . 0.0 110.801 -178.19 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.445 HG21 ' HB3' ' A' ' 75' ' ' PHE . 43.0 t -119.22 142.13 35.89 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 123.837 0.855 . . . . 0.0 110.674 -177.07 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 -108.8 94.01 4.82 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 177.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.484 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 38.8 mt-10 -83.06 114.17 21.11 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 115.267 -0.878 . . . . 0.0 110.956 -173.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.452 HG13 ' HA ' ' A' ' 64' ' ' SER . 45.6 pt -125.14 -173.84 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 124.74 1.216 . . . . 0.0 109.792 -179.017 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 20.3 p -83.55 149.14 26.78 Favored 'General case' 0 C--N 1.345 0.38 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.17 168.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.759 HD13 ' SG ' ' A' ' 11' ' ' CYS . 7.2 tt -63.68 -32.49 73.99 Favored 'General case' 0 N--CA 1.486 1.352 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.247 178.391 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.439 ' HG2' ' HE3' ' A' ' 90' ' ' LYS . 29.8 tt0 -61.22 -43.35 99.01 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.932 175.576 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -60.55 -31.31 70.42 Favored 'General case' 0 C--N 1.359 1.017 0 O-C-N 123.857 0.723 . . . . 0.0 110.825 179.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.49 -40.79 89.47 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.494 0.718 . . . . 0.0 111.908 177.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 63.0 mt -69.65 -42.01 80.33 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.899 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.57 -176.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.439 ' HE3' ' HG2' ' A' ' 86' ' ' GLN . 18.2 ptpt -87.56 -46.69 9.34 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 122.823 0.449 . . . . 0.0 112.191 -176.085 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -108.48 27.17 9.64 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 124.012 0.925 . . . . 0.0 110.946 -167.194 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.488 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -43.23 -57.96 2.73 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 124.383 1.073 . . . . 0.0 113.066 -177.448 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.37 -42.93 99.8 Favored 'General case' 0 C--N 1.344 0.357 0 CA-C-N 114.696 -1.138 . . . . 0.0 110.878 178.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -59.11 -47.6 89.99 Favored Glycine 0 C--N 1.352 1.462 0 O-C-N 124.269 0.98 . . . . 0.0 113.153 -176.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 14.4 mt -62.84 -55.75 21.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 123.946 0.898 . . . . 0.0 109.647 -177.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.42 HD12 ' HB3' ' A' ' 28' ' ' ALA . 69.2 mt -58.92 -46.62 91.25 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 CA-C-N 114.139 -1.391 . . . . 0.0 111.357 -175.165 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.54 -31.49 69.74 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 122.63 0.372 . . . . 0.0 110.645 -178.481 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -58.48 -44.02 89.18 Favored 'General case' 0 C--N 1.366 1.303 0 C-N-CA 123.369 0.668 . . . . 0.0 109.542 173.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.529 HG21 HG23 ' A' ' 60' ' ' ILE . 34.2 mt -76.41 -30.64 19.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.558 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 -174.598 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -62.5 -47.27 84.7 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.252 1.021 . . . . 0.0 111.772 175.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -74.35 -36.49 63.62 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 123.454 0.471 . . . . 0.0 110.624 -177.168 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 6.4 mtp -66.58 -52.83 41.12 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.179 0.991 . . . . 0.0 111.136 178.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.452 HD12 HG12 ' A' ' 60' ' ' ILE . 31.0 mt -66.33 -35.35 74.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.898 177.432 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.533 ' O ' ' HG2' ' A' ' 108' ' ' GLN . . . -58.61 -45.03 90.03 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 118.072 0.396 . . . . 0.0 110.377 174.662 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 22.7 t -67.56 -35.12 78.42 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.54 0.736 . . . . 0.0 111.312 -172.275 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.432 ' HG2' ' HA ' ' A' ' 103' ' ' ILE . 9.5 pt-20 -79.1 -28.45 43.01 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 116.763 -0.199 . . . . 0.0 111.307 177.171 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.433 ' HG2' ' O ' ' A' ' 103' ' ' ILE . 13.7 mm-40 -79.34 -11.35 59.93 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 122.541 0.336 . . . . 0.0 110.957 176.477 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.533 ' HG2' ' O ' ' A' ' 104' ' ' ALA . 80.4 mm-40 . . . . . 0 C--O 1.258 1.518 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 170.227 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 40.6 pttt . . . . . 0 CA--C 1.551 1.006 0 CA-C-O 120.614 0.245 . . . . 0.0 111.53 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.553 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.6 tmtp? -144.06 131.82 21.34 Favored 'General case' 0 N--CA 1.486 1.338 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 -172.095 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.464 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 10.4 tt -126.09 138.47 53.7 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 178.498 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 20.4 pt -128.68 164.16 31.49 Favored 'Isoleucine or valine' 0 C--O 1.241 0.644 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 171.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.576 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -152.02 168.35 25.49 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.037 178.129 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.8 tt -141.15 114.93 9.03 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 107.058 -1.46 . . . . 0.0 107.058 -177.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.545 ' HA ' ' O ' ' A' ' 64' ' ' SER . 61.4 m -106.72 113.06 26.34 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 176.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.411 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -127.41 127.49 44.23 Favored 'General case' 0 N--CA 1.497 1.922 0 C-N-CA 122.482 0.313 . . . . 0.0 111.836 -175.696 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.817 ' SG ' HD13 ' A' ' 85' ' ' LEU . 50.1 m -125.21 144.78 48.47 Favored Pre-proline 0 N--CA 1.478 0.935 0 C-N-CA 124.48 1.112 . . . . 0.0 110.609 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -75.82 -14.65 19.35 Favored 'Trans proline' 0 C--N 1.37 1.695 0 C-N-CA 122.379 2.053 . . . . 0.0 112.244 173.055 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 54.8 tpp -83.46 -71.76 0.49 Allowed 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.277 0.631 . . . . 0.0 110.531 178.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -171.43 -175.37 39.77 Favored Glycine 0 C--N 1.347 1.178 0 C-N-CA 121.807 -0.235 . . . . 0.0 113.351 -176.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 60.7 mt -82.37 -17.68 44.74 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -173.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.0 -43.6 91.51 Favored 'General case' 0 N--CA 1.487 1.418 0 CA-C-N 119.074 0.852 . . . . 0.0 111.253 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.439 ' ND1' ' SG ' ' A' ' 11' ' ' CYS . 18.2 t-160 -66.43 -43.04 86.75 Favored 'General case' 0 C--O 1.246 0.882 0 CA-C-N 115.015 -0.993 . . . . 0.0 110.199 178.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 31.8 p -66.42 -30.34 70.68 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 115.072 -0.967 . . . . 0.0 111.13 -178.22 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.1 m-30 -73.55 -32.11 64.01 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.328 0.651 . . . . 0.0 111.631 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 64.4 mtm -66.41 -38.98 88.68 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-O 120.788 0.328 . . . . 0.0 110.508 173.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.0 -40.58 82.99 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.89 174.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.36 -31.07 68.18 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.831 0.853 . . . . 0.0 110.963 -178.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 24.1 tp60 -67.8 -49.16 63.83 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.298 0.639 . . . . 0.0 109.404 177.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.548 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -66.3 -50.23 64.37 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-N 114.992 -1.004 . . . . 0.0 111.675 -174.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.418 HD11 ' OG ' ' A' ' 64' ' ' SER . 93.1 mt -64.46 -33.0 74.87 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.129 0.572 . . . . 0.0 111.643 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.45 ' O ' HG23 ' A' ' 30' ' ' VAL . 39.1 tt0 -58.3 -58.9 6.43 Favored 'General case' 0 C--N 1.353 0.747 0 O-C-N 123.838 0.711 . . . . 0.0 109.946 175.734 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -54.16 -47.37 72.03 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 124.602 1.189 . . . . 0.0 110.847 -177.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.13 -49.15 78.98 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.372 1.069 . . . . 0.0 111.991 -177.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.42 -21.4 61.99 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 113.329 0.862 . . . . 0.0 113.329 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.45 HG23 ' O ' ' A' ' 26' ' ' GLU . 54.1 t -77.6 -43.65 29.73 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.332 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 177.698 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -64.69 -32.44 74.12 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 114.902 -1.044 . . . . 0.0 110.36 174.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.24 -38.85 82.27 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.352 1.061 . . . . 0.0 111.344 175.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 109.32 22.17 6.93 Favored Glycine 0 C--N 1.342 0.908 0 CA-C-N 115.289 -0.869 . . . . 0.0 114.092 173.163 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.435 ' OH ' ' HG2' ' A' ' 100' ' ' GLU . 1.8 m-85 -95.63 162.95 13.4 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 117.974 0.887 . . . . 0.0 109.84 171.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.553 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 40.5 tt0 -75.98 122.82 24.76 Favored 'General case' 0 C--O 1.222 -0.361 0 N-CA-C 106.581 -1.637 . . . . 0.0 106.581 158.499 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.464 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 13.6 p -110.68 136.27 47.21 Favored 'Isoleucine or valine' 0 C--O 1.241 0.617 0 CA-C-N 118.173 0.442 . . . . 0.0 110.195 -173.16 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.1 tptt -143.77 113.84 7.3 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 178.003 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.576 HG12 ' HB3' ' A' ' 7' ' ' ALA . 38.1 mt -117.78 111.7 35.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 122.727 0.411 . . . . 0.0 111.488 -175.433 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -75.53 140.48 42.78 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.648 0.779 . . . . 0.0 109.193 169.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.401 HG22 ' HB2' ' A' ' 9' ' ' CYS . 19.8 p -123.38 121.94 37.05 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 123.642 0.777 . . . . 0.0 108.945 -179.494 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.515 HE22 ' HB2' ' A' ' 70' ' ' GLU . 41.1 mt-30 -116.18 151.96 34.66 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.396 0.679 . . . . 0.0 110.365 -178.565 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 179.74 178.33 48.39 Favored Glycine 0 C--N 1.336 0.547 0 CA-C-N 116.106 -0.497 . . . . 0.0 112.897 177.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.47 -25.87 68.46 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.53 0.732 . . . . 0.0 111.067 176.373 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -70.89 -36.08 72.59 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.821 0.848 . . . . 0.0 110.838 175.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 150.21 -162.47 29.24 Favored Glycine 0 C--N 1.349 1.26 0 CA-C-N 116.109 -0.496 . . . . 0.0 112.604 179.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 68.4 mt -120.87 136.86 56.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 124.009 0.924 . . . . 0.0 109.299 174.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -134.94 148.33 50.01 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.075 0.95 . . . . 0.0 109.244 -177.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 9.5 t30 61.92 42.75 9.9 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.501 1.12 . . . . 0.0 110.526 175.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -45.69 128.73 8.75 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 125.794 1.638 . . . . 0.0 113.686 -175.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 44.1 mt -80.47 136.86 36.4 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.583 1.153 . . . . 0.0 110.778 172.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 64.7 p -100.75 172.38 7.11 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.805 0.842 . . . . 0.0 110.375 179.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.75 -35.11 72.21 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.017 0.527 . . . . 0.0 111.201 174.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -58.94 -51.73 68.81 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.841 0.857 . . . . 0.0 111.112 175.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.437 ' O ' ' HB2' ' A' ' 58' ' ' ALA . 75.8 m-20 -59.9 -41.54 91.88 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.237 -175.499 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.441 HG22 ' HG3' ' A' ' 78' ' ' ARG . 50.6 mt -73.58 -42.96 55.52 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.243 0 C-N-CA 123.409 0.683 . . . . 0.0 111.676 -177.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.4 -39.4 71.18 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.215 0.606 . . . . 0.0 111.88 -173.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -93.02 -1.56 56.5 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.18 0.592 . . . . 0.0 111.549 -177.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.437 ' HB2' ' O ' ' A' ' 54' ' ' ASP . . . -64.45 110.11 2.17 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.056 0.542 . . . . 0.0 111.486 177.587 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 26.4 m -60.75 -37.77 82.91 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.083 0.953 . . . . 0.0 109.76 168.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.414 HD12 HD12 ' A' ' 5' ' ' LEU . 59.3 mt -134.47 144.65 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 C-N-CA 123.323 0.649 . . . . 0.0 110.857 177.208 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 21.6 mt -131.37 131.42 63.14 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 C-N-CA 124.07 0.948 . . . . 0.0 109.043 169.168 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -120.1 123.44 70.72 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 174.531 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . 0.534 ' HB2' ' HG3' ' A' ' 82' ' ' GLU . 18.1 m170 -97.62 84.06 3.33 Favored 'General case' 0 N--CA 1.488 1.457 0 CA-C-N 119.153 0.888 . . . . 0.0 109.736 170.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.545 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 28.4 m -79.25 82.83 5.36 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 114.649 -1.159 . . . . 0.0 109.535 175.15 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 32.1 m -127.43 158.1 38.87 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-O 121.379 0.609 . . . . 0.0 111.892 -170.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -103.86 -29.33 11.05 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.351 1.061 . . . . 0.0 109.037 174.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 13.6 m -131.62 169.11 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 125.066 1.346 . . . . 0.0 108.697 176.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 31.9 m -61.34 119.7 48.62 Favored Pre-proline 0 CA--C 1.551 1.014 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 174.469 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -68.23 151.53 76.65 Favored 'Trans proline' 0 C--N 1.373 1.829 0 C-N-CA 122.342 2.028 . . . . 0.0 110.643 173.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.515 ' HB2' HE22 ' A' ' 41' ' ' GLN . 10.2 mm-40 -63.46 -42.87 98.63 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-O 121.734 0.778 . . . . 0.0 109.84 -176.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -91.01 21.97 3.94 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 114.809 -1.087 . . . . 0.0 112.402 -173.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.413 ' HA ' ' HE1' ' A' ' 63' ' ' HIS . 7.1 p30 -56.01 -33.22 64.67 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.037 0.935 . . . . 0.0 112.613 -177.166 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.96 -18.32 50.7 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.944 0.898 . . . . 0.0 112.64 -174.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 3.7 mtp85 -67.01 -28.99 68.7 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-O 121.419 0.628 . . . . 0.0 110.705 176.422 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 47.1 m-85 -97.99 -5.51 33.95 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.235 1.014 . . . . 0.0 111.488 -174.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -60.12 -33.68 72.47 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.937 0.895 . . . . 0.0 111.898 -175.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 34.5 p -70.96 -13.37 61.99 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.82 0.848 . . . . 0.0 112.621 179.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.441 ' HG3' HG22 ' A' ' 55' ' ' ILE . 31.5 mmt180 -117.61 177.99 4.55 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 124.074 0.95 . . . . 0.0 111.185 -174.392 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -89.16 100.95 13.63 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.918 0.887 . . . . 0.0 110.402 -177.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 38.4 t -106.97 149.78 10.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.054 -179.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -125.09 90.75 3.29 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 124.133 0.973 . . . . 0.0 108.46 178.082 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.534 ' HG3' ' HB2' ' A' ' 63' ' ' HIS . 1.8 mp0 -78.0 131.88 37.57 Favored 'General case' 0 C--N 1.355 0.847 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.651 -178.131 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.522 HD12 ' HB3' ' A' ' 87' ' ' ASP . 37.3 pt -141.45 -172.5 0.59 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.765 0 C-N-CA 125.58 1.552 . . . . 0.0 107.786 179.315 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 32.0 p -83.03 152.54 25.35 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 121.129 0.49 . . . . 0.0 110.077 168.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.817 HD13 ' SG ' ' A' ' 11' ' ' CYS . 6.7 tt -65.91 -29.37 69.78 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.192 177.281 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.435 ' O ' ' HG2' ' A' ' 90' ' ' LYS . 29.7 tt0 -64.79 -39.45 93.62 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.049 0.54 . . . . 0.0 110.581 174.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.522 ' HB3' HD12 ' A' ' 83' ' ' ILE . 7.5 t70 -59.47 -32.85 70.63 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 124.106 0.962 . . . . 0.0 110.797 178.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.413 ' HB2' ' HB3' ' A' ' 64' ' ' SER . . . -66.03 -39.36 90.14 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.417 0.687 . . . . 0.0 112.106 177.194 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 75.3 mt -70.7 -43.07 77.73 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.84 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.724 -177.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.435 ' HG2' ' O ' ' A' ' 86' ' ' GLN . 0.2 OUTLIER -91.68 -44.21 9.15 Favored 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -173.169 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -106.52 22.8 15.24 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.845 0.858 . . . . 0.0 110.829 -169.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.548 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -42.3 -60.93 1.31 Allowed 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 124.071 0.948 . . . . 0.0 112.991 -175.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.63 -38.32 84.38 Favored 'General case' 0 C--N 1.348 0.506 0 CA-C-N 115.201 -0.909 . . . . 0.0 111.005 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -61.84 -50.2 68.29 Favored Glycine 0 C--N 1.353 1.482 0 O-C-N 124.415 1.072 . . . . 0.0 112.803 -177.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 17.2 mt -54.4 -58.01 4.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 124.228 1.011 . . . . 0.0 110.415 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.468 ' O ' ' HG3' ' A' ' 100' ' ' GLU . 2.1 mp -57.36 -54.68 27.61 Favored 'Isoleucine or valine' 0 C--N 1.36 1.028 0 O-C-N 124.391 1.057 . . . . 0.0 110.81 -175.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.28 -29.86 70.72 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -175.203 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -67.41 -39.0 85.49 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.402 0.681 . . . . 0.0 110.355 177.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 28.1 mt -75.71 -35.96 32.38 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.468 ' HG3' ' O ' ' A' ' 96' ' ' ILE . 28.4 mt-10 -60.31 -46.3 90.38 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.867 178.327 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -72.31 -31.02 65.33 Favored 'General case' 0 N--CA 1.48 1.03 0 O-C-N 123.594 0.559 . . . . 0.0 111.299 -177.039 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 71.0 mtm -64.4 -48.17 76.42 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-O 120.786 0.327 . . . . 0.0 110.584 173.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 63.9 mt -63.5 -46.17 95.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.038 176.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.24 -20.28 64.8 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.22 0.608 . . . . 0.0 111.627 -177.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 38.2 t -76.73 -41.33 45.49 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 122.65 0.38 . . . . 0.0 110.2 177.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -81.83 -21.59 37.53 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 122.925 0.49 . . . . 0.0 112.267 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 22.9 mm-40 -81.67 -47.66 12.7 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.311 0.644 . . . . 0.0 110.013 176.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 71.6 mm-40 . . . . . 0 C--O 1.251 1.16 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.988 -174.92 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 41.9 pttt . . . . . 0 N--CA 1.481 1.081 0 CA-C-O 120.987 0.422 . . . . 0.0 111.298 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.598 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.1 tmtp? -147.52 135.13 20.93 Favored 'General case' 0 CA--C 1.557 1.212 0 CA-C-O 121.291 0.567 . . . . 0.0 109.625 -173.647 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.453 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 10.1 tt -128.56 138.72 52.37 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.551 1.14 . . . . 0.0 108.339 178.007 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.511 HD12 HD13 ' A' ' 50' ' ' LEU . 20.2 pt -128.78 167.8 23.33 Favored 'Isoleucine or valine' 0 C--O 1.241 0.641 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 172.163 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.633 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -154.55 169.14 24.53 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.156 177.317 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.404 ' HA ' ' O ' ' A' ' 39' ' ' GLU . 4.6 tt -140.23 116.45 10.55 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 177.649 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.533 ' HA ' ' O ' ' A' ' 64' ' ' SER . 77.9 m -106.18 115.08 29.6 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 177.347 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.421 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -129.65 116.77 19.33 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 122.819 0.448 . . . . 0.0 111.542 -175.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.702 ' SG ' HD13 ' A' ' 85' ' ' LEU . 1.7 m -124.84 143.14 42.89 Favored Pre-proline 0 N--CA 1.479 1.017 0 C-N-CA 124.495 1.118 . . . . 0.0 109.471 175.479 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -77.2 -7.08 16.99 Favored 'Trans proline' 0 C--N 1.375 1.947 0 C-N-CA 122.561 2.174 . . . . 0.0 112.486 -178.479 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 58.3 mtt -79.78 -49.19 12.37 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.353 1.061 . . . . 0.0 110.038 -178.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 162.03 -168.63 37.15 Favored Glycine 0 C--N 1.343 0.93 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.679 -178.038 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 60.4 mt -82.96 -17.72 42.53 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 113.364 0.876 . . . . 0.0 113.364 -176.395 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.28 -45.09 95.93 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-O 121.482 0.658 . . . . 0.0 111.205 -178.654 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -65.55 -40.87 93.33 Favored 'General case' 0 C--O 1.247 0.939 0 CA-C-N 114.646 -1.161 . . . . 0.0 110.214 -179.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 52.6 p -72.18 -31.79 66.25 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 114.402 -1.272 . . . . 0.0 111.027 -176.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 15.6 m-30 -68.92 -31.95 71.22 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.127 0.571 . . . . 0.0 111.043 178.197 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 54.5 mtm -67.76 -40.92 84.03 Favored 'General case' 0 N--CA 1.486 1.341 0 O-C-N 123.378 0.424 . . . . 0.0 110.883 174.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.97 -37.84 84.98 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.933 174.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.51 -38.98 81.41 Favored 'General case' 0 C--O 1.217 -0.653 0 C-N-CA 123.923 0.889 . . . . 0.0 110.797 179.257 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -63.69 -43.35 96.9 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.685 0.794 . . . . 0.0 110.158 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.662 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -61.05 -58.32 8.89 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 114.727 -1.124 . . . . 0.0 111.601 179.531 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 95.8 mt -66.92 -30.9 71.17 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.143 0.577 . . . . 0.0 112.164 -176.293 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.507 ' O ' HG23 ' A' ' 30' ' ' VAL . 36.7 tt0 -62.01 -61.29 2.59 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.062 0.545 . . . . 0.0 109.751 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.548 ' O ' ' HG3' ' A' ' 31' ' ' GLU . 16.5 mm-40 -51.01 -51.94 47.91 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 124.71 1.256 . . . . 0.0 111.661 179.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -62.85 -40.18 96.65 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.775 0.83 . . . . 0.0 112.572 -174.841 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.17 -27.91 61.05 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 122.895 0.478 . . . . 0.0 112.202 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.507 HG23 ' O ' ' A' ' 26' ' ' GLU . 77.7 t -64.1 -44.69 97.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 175.563 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.548 ' HG3' ' O ' ' A' ' 27' ' ' GLU . 18.9 mt-10 -70.23 -32.37 70.21 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 114.755 -1.111 . . . . 0.0 110.4 -179.555 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.78 -17.89 61.54 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.688 0.795 . . . . 0.0 111.636 176.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.81 22.17 11.34 Favored Glycine 0 C--N 1.346 1.114 0 N-CA-C 115.157 0.823 . . . . 0.0 115.157 165.018 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.438 ' CE2' HD12 ' A' ' 60' ' ' ILE . 0.0 OUTLIER -104.04 173.09 6.45 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-N 118.189 0.995 . . . . 0.0 110.522 172.159 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.598 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 43.2 tt0 -83.2 123.65 29.77 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 106.83 -1.544 . . . . 0.0 106.83 157.745 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.453 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 9.5 p -109.12 135.78 46.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 122.931 0.492 . . . . 0.0 110.247 -174.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 47.9 tptt -145.46 116.21 7.72 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 179.124 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.633 HG12 ' HB3' ' A' ' 7' ' ' ALA . 42.5 mt -120.19 110.92 30.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 122.896 0.478 . . . . 0.0 111.846 -172.587 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.404 ' O ' ' HA ' ' A' ' 8' ' ' LEU . 39.6 tt0 -79.38 118.89 21.69 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.401 0.68 . . . . 0.0 109.819 175.619 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 34.8 p -96.78 133.11 41.77 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.035 177.315 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.454 ' HG2' HG12 ' A' ' 46' ' ' ILE . 42.6 mt-30 -126.88 141.3 51.85 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.098 0.959 . . . . 0.0 109.537 178.307 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -173.33 177.97 45.49 Favored Glycine 0 C--N 1.335 0.524 0 CA-C-N 116.769 -0.196 . . . . 0.0 113.031 179.525 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.18 -25.94 67.37 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.899 0.88 . . . . 0.0 111.885 178.04 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -75.18 -33.54 61.47 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.74 0.816 . . . . 0.0 111.298 178.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 156.39 -160.52 30.25 Favored Glycine 0 C--N 1.348 1.207 0 O-C-N 123.371 0.42 . . . . 0.0 112.481 179.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.458 HG21 ' NH1' ' A' ' 49' ' ' ARG . 73.1 mt -127.12 135.27 64.04 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.244 0 C-N-CA 123.82 0.848 . . . . 0.0 108.885 172.178 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -136.95 155.0 50.29 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.205 0.602 . . . . 0.0 110.474 -175.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 20.4 t30 60.93 36.76 18.7 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.704 1.202 . . . . 0.0 110.15 177.144 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.458 ' NH1' HG21 ' A' ' 46' ' ' ILE . 19.1 tpp180 -48.66 123.23 6.5 Favored 'General case' 0 C--N 1.361 1.106 0 C-N-CA 125.157 1.383 . . . . 0.0 112.103 -174.747 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.511 HD13 HD12 ' A' ' 6' ' ' ILE . 39.8 mt -70.32 140.37 52.23 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 114.786 -1.097 . . . . 0.0 110.544 173.316 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.455 ' O ' HG13 ' A' ' 55' ' ' ILE . 52.9 p -94.84 161.04 14.33 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 172.557 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.11 -25.21 66.82 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 122.449 0.3 . . . . 0.0 110.813 174.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.406 HE21 ' HG3' ' A' ' 57' ' ' GLU . 25.3 tp60 -65.88 -45.61 81.42 Favored 'General case' 0 C--N 1.354 0.791 0 O-C-N 124.035 0.834 . . . . 0.0 110.485 173.481 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 -57.86 -44.55 86.65 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.181 0.592 . . . . 0.0 110.943 176.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.575 HD11 HH21 ' A' ' 74' ' ' ARG . 12.5 mt -71.91 -29.78 34.65 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 O-C-N 124.106 0.879 . . . . 0.0 110.738 -176.049 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.78 -46.24 46.78 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.345 0.658 . . . . 0.0 110.828 177.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.406 ' HG3' HE21 ' A' ' 53' ' ' GLN . 50.8 mt-10 -67.26 -27.67 67.4 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.855 0.862 . . . . 0.0 111.553 178.186 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -56.19 99.04 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.514 0 O-C-N 124.476 1.11 . . . . 0.0 112.255 -175.074 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 29.1 m -60.99 -37.94 84.26 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 114.553 -1.203 . . . . 0.0 109.237 168.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.438 HD12 ' CE2' ' A' ' 34' ' ' TYR . 83.9 mt -134.22 140.18 46.61 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 C-N-CA 123.854 0.862 . . . . 0.0 110.262 179.805 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.43 HG23 HG13 ' A' ' 6' ' ' ILE . 24.9 mt -129.02 137.18 57.86 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 175.512 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.8 mp -128.4 113.09 28.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 CA-C-N 118.567 0.621 . . . . 0.0 110.104 175.362 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 6.1 m170 -88.24 86.08 7.02 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 121.388 0.614 . . . . 0.0 109.781 173.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.533 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 19.0 m -78.71 79.48 5.13 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 114.67 -1.15 . . . . 0.0 109.52 175.824 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.416 ' O ' ' HA ' ' A' ' 84' ' ' THR . 35.9 m -124.98 157.07 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 CA-C-O 121.869 0.842 . . . . 0.0 111.858 -170.265 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -112.59 -16.42 12.84 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 114.318 -1.31 . . . . 0.0 109.053 173.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 19.2 m -130.4 168.55 23.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 125.604 1.561 . . . . 0.0 109.234 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 64.9 m -78.61 112.95 30.53 Favored Pre-proline 0 CA--C 1.546 0.824 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 170.327 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.433 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 37.6 Cg_endo -63.76 150.26 88.86 Favored 'Trans proline' 0 C--N 1.376 2.009 0 C-N-CA 122.757 2.305 . . . . 0.0 112.367 -177.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -67.11 -23.98 65.88 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.176 0.59 . . . . 0.0 110.858 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -102.58 15.6 28.79 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.268 -0.878 . . . . 0.0 112.202 -177.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.433 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 25.6 t30 -53.35 -38.7 63.51 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.742 0.817 . . . . 0.0 111.777 179.482 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.55 -30.29 71.2 Favored 'General case' 0 N--CA 1.482 1.156 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 -176.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.575 HH21 HD11 ' A' ' 55' ' ' ILE . 43.5 mtp180 -62.55 -39.36 93.38 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-O 121.385 0.612 . . . . 0.0 111.842 174.555 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -97.37 -8.46 29.49 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.392 -175.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -64.63 -33.32 75.67 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.257 1.023 . . . . 0.0 111.115 -177.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 64.2 p -75.15 -17.13 60.46 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.656 0.782 . . . . 0.0 111.847 177.079 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.448 ' HG3' HG22 ' A' ' 55' ' ' ILE . 25.2 mmt180 -104.03 160.17 15.06 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.092 0.957 . . . . 0.0 111.091 -170.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -77.01 101.41 6.01 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.137 0.575 . . . . 0.0 110.145 174.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 80.9 t -111.9 138.7 39.65 Favored 'Isoleucine or valine' 0 C--O 1.238 0.493 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.395 -179.405 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -98.98 89.46 4.29 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 172.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -82.3 128.09 33.87 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.221 -176.363 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.529 HD12 ' HB3' ' A' ' 87' ' ' ASP . 47.2 pt -133.13 -171.78 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 C-N-CA 124.674 1.19 . . . . 0.0 108.953 178.773 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . 0.416 ' HA ' ' O ' ' A' ' 65' ' ' VAL . 18.0 p -86.55 151.43 23.48 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 122.638 0.375 . . . . 0.0 110.262 168.554 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.702 HD13 ' SG ' ' A' ' 11' ' ' CYS . 6.4 tt -63.59 -30.76 71.83 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.59 178.617 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.466 ' HG2' ' HE2' ' A' ' 90' ' ' LYS . 9.4 tt0 -63.44 -41.61 98.67 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.49 175.531 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.529 ' HB3' HD12 ' A' ' 83' ' ' ILE . 8.8 t70 -61.53 -31.43 71.45 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.713 0.805 . . . . 0.0 111.097 -178.874 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.2 -45.43 88.34 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.262 0.625 . . . . 0.0 111.259 175.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 74.1 mt -67.05 -43.09 89.12 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.959 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.936 -176.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.466 ' HE2' ' HG2' ' A' ' 86' ' ' GLN . 0.2 OUTLIER -86.55 -38.25 17.36 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -174.981 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -119.62 30.89 6.83 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 122.943 0.497 . . . . 0.0 110.856 -166.277 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.662 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -45.68 -61.22 1.8 Allowed 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 123.817 0.847 . . . . 0.0 113.015 -176.352 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -58.03 -46.36 85.45 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.464 175.199 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . 0.44 ' O ' ' HG2' ' A' ' 98' ' ' GLU . . . -54.97 -45.27 81.83 Favored Glycine 0 C--N 1.356 1.639 0 O-C-N 124.662 1.226 . . . . 0.0 113.931 -174.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 14.1 mt -62.61 -57.42 12.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 123.813 0.845 . . . . 0.0 109.378 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 96.5 mt -59.95 -44.85 95.43 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 CA-C-N 114.031 -1.44 . . . . 0.0 111.415 -172.759 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.69 -31.56 71.61 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.058 0.543 . . . . 0.0 111.936 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' A' ' 94' ' ' GLY . 51.4 mm-40 -63.85 -36.78 85.03 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 123.471 0.482 . . . . 0.0 110.2 176.138 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 16.0 mt -81.07 -32.39 12.42 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 -178.552 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -57.63 -50.89 71.65 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.448 1.099 . . . . 0.0 111.151 173.466 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -72.71 -35.09 67.52 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 123.647 0.592 . . . . 0.0 111.028 -176.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 64.4 mtm -63.47 -46.0 88.2 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 122.544 0.338 . . . . 0.0 110.43 177.549 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.426 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 19.7 mt -67.17 -40.85 86.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 O-C-N 123.631 0.582 . . . . 0.0 110.199 177.048 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.91 -24.72 67.61 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 122.933 0.493 . . . . 0.0 111.785 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 22.3 t -91.11 -33.43 15.46 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.087 0.555 . . . . 0.0 110.784 -176.111 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . 0.426 ' HG2' ' HA ' ' A' ' 103' ' ' ILE . 13.2 pt-20 -81.42 -28.78 34.11 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 122.775 0.43 . . . . 0.0 110.876 -179.489 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 87.0 mm-40 -79.76 -36.46 37.17 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.031 0.533 . . . . 0.0 110.157 175.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 65.7 mm-40 . . . . . 0 CA--C 1.552 1.045 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 178.42 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.252 1.209 0 CA-C-O 121.424 0.63 . . . . 0.0 110.423 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.55 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.1 tmtp? -145.51 137.29 25.34 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 -178.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.413 ' N ' ' HD3' ' A' ' 4' ' ' LYS . 9.4 tt -122.88 135.2 54.43 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.651 1.18 . . . . 0.0 108.064 175.139 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.473 HG21 ' HB3' ' A' ' 54' ' ' ASP . 18.9 pt -125.92 160.96 32.08 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 170.283 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.615 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -149.68 164.47 35.13 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.934 176.681 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.5 tt -138.0 110.35 7.42 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 107.439 -1.319 . . . . 0.0 107.439 -177.335 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.525 ' HA ' ' O ' ' A' ' 64' ' ' SER . 60.2 m -99.18 107.5 19.86 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.065 0.946 . . . . 0.0 109.568 176.227 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -121.78 124.43 44.18 Favored 'General case' 0 N--CA 1.492 1.657 0 C-N-CA 122.566 0.346 . . . . 0.0 111.455 -177.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.792 ' SG ' HD13 ' A' ' 85' ' ' LEU . 36.9 m -127.76 146.27 58.17 Favored Pre-proline 0 N--CA 1.48 1.033 0 C-N-CA 123.847 0.859 . . . . 0.0 111.172 177.222 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -86.92 -13.78 4.49 Favored 'Trans proline' 0 C--N 1.369 1.629 0 C-N-CA 122.971 2.447 . . . . 0.0 111.984 168.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 23.0 mmt -79.54 -58.41 3.21 Favored 'General case' 0 C--N 1.355 0.813 0 C-N-CA 124.11 0.964 . . . . 0.0 110.298 -175.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -179.12 162.35 29.17 Favored Glycine 0 C--N 1.347 1.194 0 CA-C-N 115.564 -0.744 . . . . 0.0 112.77 -178.228 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 37.2 mt -70.81 -18.35 62.74 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.81 0.844 . . . . 0.0 111.714 178.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.42 -43.89 79.83 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-O 121.036 0.446 . . . . 0.0 110.903 174.375 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.461 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 3.9 t-160 -67.87 -41.7 82.45 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.234 -178.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.407 ' HA ' HD11 ' A' ' 85' ' ' LEU . 42.7 p -67.1 -36.33 81.72 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.429 -177.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.3 m-30 -72.45 -35.02 68.17 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.091 0.556 . . . . 0.0 111.394 -177.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 60.3 mtm -67.96 -35.82 79.03 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-O 120.592 0.234 . . . . 0.0 110.601 176.265 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -69.82 -41.56 74.82 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.386 0.674 . . . . 0.0 111.198 173.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.35 -39.76 89.38 Favored 'General case' 0 C--O 1.218 -0.571 0 C-N-CA 123.81 0.844 . . . . 0.0 110.899 -177.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.3 tp60 -70.55 -41.49 72.41 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 123.624 0.578 . . . . 0.0 109.903 -179.369 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.554 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -62.89 -52.24 63.84 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.434 -178.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 82.9 mt -65.1 -33.42 75.98 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.319 0.647 . . . . 0.0 111.501 178.283 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.474 ' O ' HG23 ' A' ' 30' ' ' VAL . 40.1 tt0 -60.42 -58.39 8.72 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 123.973 0.796 . . . . 0.0 110.587 179.55 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.536 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 29.8 mm-40 -53.65 -48.38 69.45 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 124.387 1.055 . . . . 0.0 111.119 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -57.68 -46.6 84.06 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 124.043 0.839 . . . . 0.0 111.789 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.56 -28.56 67.06 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 123.721 0.808 . . . . 0.0 113.08 178.051 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 26' ' ' GLU . 42.9 t -70.2 -40.15 77.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.83 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.536 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 8.0 mm-40 -70.85 -24.59 62.55 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 114.635 -1.166 . . . . 0.0 111.297 178.816 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -77.77 -7.33 56.41 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.36 0.664 . . . . 0.0 111.964 177.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 83.69 24.69 49.0 Favored Glycine 0 C--N 1.351 1.389 0 N-CA-C 114.668 0.627 . . . . 0.0 114.668 165.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -128.96 178.76 6.16 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-N 117.328 0.564 . . . . 0.0 111.311 173.107 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.55 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 41.2 tt0 -78.5 140.36 38.59 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.325 178.746 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.43 HG21 ' HA ' ' A' ' 26' ' ' GLU . 13.9 p -120.33 143.63 31.61 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 122.88 0.472 . . . . 0.0 110.204 178.648 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 49.3 tptt -149.3 115.86 5.87 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 173.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.615 HG12 ' HB3' ' A' ' 7' ' ' ALA . 51.0 mt -121.03 114.57 43.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -176.832 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.431 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 34.7 tt0 -75.71 143.22 42.21 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.089 0.956 . . . . 0.0 109.167 171.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.492 HG22 ' HB2' ' A' ' 9' ' ' CYS . 1.9 p -127.93 103.54 7.31 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.087 0.555 . . . . 0.0 110.2 -179.132 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -94.56 137.56 33.53 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 122.852 0.461 . . . . 0.0 110.373 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -156.2 169.13 33.69 Favored Glycine 0 C--N 1.337 0.592 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.467 176.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.03 -29.36 69.67 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.545 0.738 . . . . 0.0 111.614 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -71.91 -39.35 69.58 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.036 0.935 . . . . 0.0 110.535 177.092 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 161.28 -177.55 37.57 Favored Glycine 0 C--N 1.345 1.066 0 CA-C-N 115.949 -0.569 . . . . 0.0 112.643 -178.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 73.6 mt -111.52 122.44 65.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 123.783 0.833 . . . . 0.0 110.08 179.175 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.441 ' HB3' ' OG1' ' A' ' 40' ' ' THR . 6.5 tp-100 -105.47 147.01 28.77 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.476 1.11 . . . . 0.0 110.688 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 17.8 t30 79.06 -51.92 0.44 Allowed 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 126.734 2.014 . . . . 0.0 111.582 172.455 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 21.6 tpp180 63.57 121.63 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.686 1.594 . . . . 0.0 113.549 173.088 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.431 ' HG ' ' HB2' ' A' ' 39' ' ' GLU . 45.1 mt -82.25 127.96 33.71 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.458 172.396 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.401 ' O ' HG13 ' A' ' 55' ' ' ILE . 43.8 p -90.2 160.74 16.06 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.039 176.475 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.24 -27.03 66.88 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 122.848 0.459 . . . . 0.0 111.481 177.088 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -69.29 -40.15 77.89 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.73 0.812 . . . . 0.0 111.113 175.16 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.473 ' HB3' HG21 ' A' ' 6' ' ' ILE . 53.7 m-20 -58.32 -47.75 82.72 Favored 'General case' 0 N--CA 1.483 1.212 0 O-C-N 123.35 0.406 . . . . 0.0 110.249 174.421 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.522 HG22 ' HG3' ' A' ' 78' ' ' ARG . 24.8 mt -68.47 -29.64 44.76 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.069 0 O-C-N 124.618 1.199 . . . . 0.0 111.024 -177.684 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.445 ' HA ' HH21 ' A' ' 78' ' ' ARG . . . -71.68 -49.05 43.2 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.68 0.792 . . . . 0.0 111.552 179.458 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -84.82 -12.54 53.37 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.421 0.688 . . . . 0.0 112.157 -175.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.9 99.0 0.11 Allowed 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.546 0.739 . . . . 0.0 111.834 -178.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 25.2 m -61.59 -34.86 76.35 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 124.268 1.027 . . . . 0.0 109.797 170.682 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.561 HG23 HG21 ' A' ' 99' ' ' ILE . 81.5 mt -130.45 138.14 54.51 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 C-N-CA 124.416 1.087 . . . . 0.0 109.61 179.55 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.401 HG23 HG13 ' A' ' 6' ' ' ILE . 34.8 mt -133.06 132.27 58.81 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.358 0 C-N-CA 123.721 0.809 . . . . 0.0 108.821 174.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -121.14 117.01 51.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 174.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 9.9 m170 -90.84 84.52 5.83 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-N 118.879 0.763 . . . . 0.0 108.972 170.01 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.525 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 20.7 p -83.22 81.83 8.53 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 114.674 -1.148 . . . . 0.0 108.763 176.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 34.8 m -128.57 158.31 40.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 CA-C-O 121.699 0.762 . . . . 0.0 111.957 -168.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -111.71 -11.9 13.93 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.013 1.325 . . . . 0.0 109.363 172.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 11.5 m -135.47 151.73 30.59 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 125.397 1.479 . . . . 0.0 108.909 178.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 25.6 m -65.3 110.79 4.77 Favored Pre-proline 0 CA--C 1.55 0.976 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 173.087 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -62.66 153.3 72.91 Favored 'Trans proline' 0 C--N 1.379 2.137 0 C-N-CA 122.342 2.028 . . . . 0.0 112.912 -174.005 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -76.58 -25.4 53.93 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.444 0.698 . . . . 0.0 111.001 -177.236 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -96.02 10.43 37.48 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.813 0.845 . . . . 0.0 111.252 179.127 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.5 -32.95 69.29 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 124.074 0.95 . . . . 0.0 111.354 -174.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.421 ' HA ' ' HB2' ' A' ' 76' ' ' GLU . 0.4 OUTLIER -65.66 -24.87 67.12 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.154 0.581 . . . . 0.0 112.359 178.777 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 77.3 mtt180 -70.5 -23.37 62.65 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.254 0.622 . . . . 0.0 111.646 173.194 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.416 ' HB3' HG21 ' A' ' 80' ' ' VAL . 56.8 m-85 -105.37 2.43 28.77 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.148 0.979 . . . . 0.0 111.301 -179.501 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.421 ' HB2' ' HA ' ' A' ' 73' ' ' GLU . 29.2 tt0 -61.61 -50.39 72.77 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.876 0.87 . . . . 0.0 111.909 -172.446 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 69.7 p -82.71 0.26 44.22 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.054 0.541 . . . . 0.0 111.841 -178.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.522 ' HG3' HG22 ' A' ' 55' ' ' ILE . 15.8 mmt180 -102.4 149.32 24.48 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.634 0.774 . . . . 0.0 110.71 176.343 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -79.37 92.28 5.17 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.712 0.805 . . . . 0.0 110.624 -178.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.416 HG21 ' HB3' ' A' ' 75' ' ' PHE . 45.1 t -98.49 144.79 10.98 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.788 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.096 -179.728 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 -102.45 92.2 4.58 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.82 1.248 . . . . 0.0 107.858 174.61 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -83.16 121.62 27.31 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.579 0.752 . . . . 0.0 110.708 -175.306 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.498 HG13 ' HA ' ' A' ' 64' ' ' SER . 43.9 pt -130.55 -177.59 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 124.675 1.19 . . . . 0.0 109.25 177.391 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 18.5 p -83.79 149.28 26.53 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 167.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.792 HD13 ' SG ' ' A' ' 11' ' ' CYS . 7.7 tt -63.09 -29.22 70.63 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.358 0.663 . . . . 0.0 111.816 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.555 ' HG2' ' HE3' ' A' ' 90' ' ' LYS . 29.4 tt0 -60.22 -41.78 93.79 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.445 0.698 . . . . 0.0 110.755 175.072 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.459 ' HB3' HD12 ' A' ' 83' ' ' ILE . 24.1 t70 -63.18 -32.46 73.86 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.674 0.79 . . . . 0.0 110.728 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.403 ' HB2' ' HB2' ' A' ' 64' ' ' SER . . . -63.74 -29.9 71.06 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.749 0.82 . . . . 0.0 112.697 179.132 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 65.8 mt -83.54 -54.0 10.08 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 C-N-CA 123.603 0.761 . . . . 0.0 110.062 -178.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.555 ' HE3' ' HG2' ' A' ' 86' ' ' GLN . 18.5 ptpt -72.8 -45.4 58.68 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.117 0.567 . . . . 0.0 112.33 -175.256 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -108.61 24.07 13.6 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.185 0.994 . . . . 0.0 110.594 -169.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.554 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -41.73 -62.2 0.94 Allowed 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.286 1.034 . . . . 0.0 113.672 -175.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.35 -36.29 83.2 Favored 'General case' 0 C--N 1.34 0.179 0 CA-C-N 114.922 -1.036 . . . . 0.0 110.806 179.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -61.07 -48.06 88.0 Favored Glycine 0 C--N 1.354 1.546 0 O-C-N 124.703 1.252 . . . . 0.0 112.526 -178.3 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 35.9 mt -56.99 -57.89 8.03 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 C-N-CA 124.597 1.159 . . . . 0.0 110.31 -179.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.9 mp -56.31 -51.65 61.15 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.912 0 O-C-N 124.257 0.973 . . . . 0.0 111.296 -177.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.31 -31.16 72.15 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 -176.758 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -67.19 -36.96 82.84 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 122.877 0.471 . . . . 0.0 110.217 177.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.561 HG21 HG23 ' A' ' 60' ' ' ILE . 56.4 mt -76.47 -37.49 30.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -177.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -57.55 -52.66 64.51 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 114.191 -1.368 . . . . 0.0 111.257 176.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -69.96 -33.51 72.19 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 123.632 0.582 . . . . 0.0 111.534 -177.794 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 67.7 mtm -65.0 -56.9 10.44 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 122.386 0.274 . . . . 0.0 110.817 178.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 48.2 mt -64.35 -39.72 86.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 O-C-N 123.677 0.61 . . . . 0.0 111.037 -179.231 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.43 ' HA ' ' HG2' ' A' ' 107' ' ' GLN . . . -67.55 -37.4 82.64 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.659 0.384 . . . . 0.0 111.433 179.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 33.9 t -68.48 -39.1 81.49 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 122.351 0.26 . . . . 0.0 110.848 -175.365 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -79.98 -29.67 39.57 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 116.106 -0.497 . . . . 0.0 112.173 -178.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.43 ' HG2' ' HA ' ' A' ' 104' ' ' ALA . 3.0 pt20 -85.08 -28.78 25.39 Favored 'General case' 0 N--CA 1.487 1.418 0 CA-C-N 117.991 0.359 . . . . 0.0 111.203 -178.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 . . . . . 0 C--O 1.249 1.034 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 179.037 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.8 pttm . . . . . 0 C--O 1.242 0.693 0 CA-C-O 121.189 0.519 . . . . 0.0 110.617 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.604 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.4 tmtp? -144.37 140.24 28.94 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 -169.736 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.515 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.9 tt -132.26 136.68 47.13 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 178.431 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.511 HD12 HD13 ' A' ' 50' ' ' LEU . 15.8 pt -128.15 161.14 37.1 Favored 'Isoleucine or valine' 0 C--O 1.244 0.769 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 173.715 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.592 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -147.21 168.16 22.39 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.99 177.854 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.0 tt -142.07 113.62 7.8 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 -178.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.52 ' HA ' ' O ' ' A' ' 64' ' ' SER . 56.0 m -103.28 111.42 23.81 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.696 0.798 . . . . 0.0 108.851 177.16 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.451 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -123.31 127.29 48.33 Favored 'General case' 0 N--CA 1.497 1.919 0 C-N-CA 122.521 0.328 . . . . 0.0 111.44 -177.663 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.798 ' SG ' HD13 ' A' ' 85' ' ' LEU . 56.0 m -130.79 145.45 57.74 Favored Pre-proline 0 N--CA 1.481 1.087 0 C-N-CA 123.866 0.866 . . . . 0.0 111.768 -178.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -79.37 -28.16 3.82 Favored 'Trans proline' 0 C--N 1.375 1.929 0 C-N-CA 122.866 2.377 . . . . 0.0 111.466 167.513 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 12.2 tpt -69.74 -50.77 40.27 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.012 0.925 . . . . 0.0 110.744 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 155.68 -176.79 33.11 Favored Glycine 0 C--N 1.345 1.053 0 N-CA-C 114.178 0.431 . . . . 0.0 114.178 175.605 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 71.0 mt -73.62 -20.18 60.66 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.974 0.909 . . . . 0.0 113.393 -172.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.82 -42.66 89.74 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-N 118.574 0.625 . . . . 0.0 110.619 176.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.479 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 7.2 t-160 -67.1 -43.27 82.93 Favored 'General case' 0 C--O 1.246 0.919 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.866 178.28 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 34.7 p -65.8 -31.26 72.13 Favored 'General case' 0 C--N 1.353 0.76 0 CA-C-N 115.509 -0.769 . . . . 0.0 111.558 -177.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -74.15 -33.42 63.5 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 119.028 -0.51 . . . . 0.0 111.192 -178.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 64.6 mtm -65.05 -35.82 82.37 Favored 'General case' 0 N--CA 1.492 1.66 0 CA-C-O 120.961 0.41 . . . . 0.0 110.87 173.275 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.48 -48.67 54.66 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.999 177.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.68 -36.13 82.82 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 124.32 1.048 . . . . 0.0 110.946 -177.301 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -71.04 -41.11 71.24 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 -176.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -72.97 -38.95 66.5 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.919 -178.166 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 76.5 mt -71.68 -33.41 68.81 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.079 0.552 . . . . 0.0 110.784 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.447 ' O ' HG23 ' A' ' 30' ' ' VAL . 37.4 tt0 -61.29 -55.86 27.11 Favored 'General case' 0 C--N 1.35 0.599 0 O-C-N 124.019 0.824 . . . . 0.0 109.209 177.721 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.434 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 44.8 mt-10 -56.22 -48.25 76.82 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 124.36 1.037 . . . . 0.0 110.717 -178.414 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.47 -47.46 79.15 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.119 0.968 . . . . 0.0 111.548 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.03 -22.18 62.18 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.186 0.994 . . . . 0.0 113.537 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 26' ' ' GLU . 37.6 t -79.93 -41.55 21.55 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 -179.425 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 6.9 mm-40 -72.21 -21.72 61.37 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 114.465 -1.243 . . . . 0.0 110.102 175.422 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.437 ' HB1' ' HE1' ' A' ' 34' ' ' TYR . . . -75.61 -31.25 59.83 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 114.726 -1.125 . . . . 0.0 111.436 173.679 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 98.77 22.79 12.93 Favored Glycine 0 C--N 1.344 1.019 0 CA-C-N 115.833 -0.621 . . . . 0.0 114.095 171.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.437 ' HE1' ' HB1' ' A' ' 32' ' ' ALA . 2.5 m-85 -99.75 163.51 12.44 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 171.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.604 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 35.1 tt0 -74.33 130.42 39.65 Favored 'General case' 0 C--O 1.217 -0.646 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 159.636 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.515 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 9.3 p -119.28 134.46 62.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 CA-C-N 119.133 0.879 . . . . 0.0 110.9 -173.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 45.2 tptt -141.0 120.45 13.16 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.592 HG12 ' HB3' ' A' ' 7' ' ' ALA . 43.1 mt -122.28 122.94 67.64 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 C-N-CA 122.712 0.405 . . . . 0.0 112.08 -175.325 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 76.9 tt0 -88.53 116.0 26.46 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.493 1.117 . . . . 0.0 109.904 175.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.511 HG22 ' HB2' ' A' ' 9' ' ' CYS . 24.3 p -100.85 104.96 16.2 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 122.521 0.328 . . . . 0.0 110.366 177.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.451 ' O ' ' HA ' ' A' ' 10' ' ' ALA . 13.9 mt-30 -96.66 144.0 27.1 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.237 0.615 . . . . 0.0 109.45 175.802 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -167.98 177.47 42.19 Favored Glycine 0 C--N 1.335 0.49 0 C-N-CA 121.716 -0.278 . . . . 0.0 112.568 179.419 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.79 -29.27 69.34 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.535 0.734 . . . . 0.0 111.958 179.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -67.53 -42.32 82.93 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.407 0.683 . . . . 0.0 110.205 174.037 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 153.77 -173.01 32.51 Favored Glycine 0 C--N 1.341 0.811 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.93 -176.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 72.6 mt -101.59 135.57 37.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 176.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.416 ' HB3' ' OG1' ' A' ' 40' ' ' THR . 9.1 tp-100 -132.16 144.78 50.91 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.386 0.674 . . . . 0.0 110.383 -172.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 42.2 t30 74.39 -64.87 0.37 Allowed 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 126.43 1.892 . . . . 0.0 108.855 -177.618 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 22.6 ttt-85 63.73 129.19 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 127.048 2.139 . . . . 0.0 113.947 172.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.511 HD13 HD12 ' A' ' 6' ' ' ILE . 26.9 mt -77.76 148.63 34.74 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 113.837 -1.529 . . . . 0.0 110.272 175.884 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 58.5 p -113.72 170.14 8.47 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.505 176.347 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -57.19 -33.41 67.46 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.382 0.673 . . . . 0.0 111.222 -179.211 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -61.17 -54.95 37.95 Favored 'General case' 0 C--N 1.35 0.608 0 O-C-N 124.256 0.972 . . . . 0.0 109.667 175.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 53.1 m-20 -54.56 -41.82 70.26 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 123.966 0.906 . . . . 0.0 112.239 -176.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.673 HD11 HH21 ' A' ' 74' ' ' ARG . 40.4 mt -71.11 -33.47 51.39 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 O-C-N 123.874 0.734 . . . . 0.0 110.604 -176.39 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.23 -39.63 65.34 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.475 0.71 . . . . 0.0 111.299 176.203 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -69.25 -32.28 71.37 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.881 0.872 . . . . 0.0 110.95 179.425 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -56.57 101.88 0.07 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.884 1.274 . . . . 0.0 113.216 -172.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 27.4 m -61.11 -39.59 90.55 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.759 0.824 . . . . 0.0 109.12 165.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.52 HG23 HG21 ' A' ' 99' ' ' ILE . 53.0 mt -127.22 144.37 37.51 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 C-N-CA 123.746 0.818 . . . . 0.0 110.581 179.149 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 28.1 mt -134.42 120.28 32.75 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 C-N-CA 124.014 0.926 . . . . 0.0 108.839 172.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.6 mp -109.46 119.77 59.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 175.167 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . 0.438 ' HB2' ' HG3' ' A' ' 82' ' ' GLU . 12.6 m170 -92.44 83.92 5.05 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-O 121.747 0.784 . . . . 0.0 108.944 168.61 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.52 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 24.8 p -80.45 83.58 6.24 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 114.236 -1.347 . . . . 0.0 109.072 175.551 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 33.7 m -128.29 156.58 40.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 CA-C-O 121.872 0.844 . . . . 0.0 112.29 -169.126 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -109.3 -21.44 12.54 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 113.633 -1.622 . . . . 0.0 109.002 173.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 6.2 m -137.13 148.48 26.29 Favored 'Isoleucine or valine' 0 C--N 1.35 0.613 0 C-N-CA 125.519 1.528 . . . . 0.0 108.015 175.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 67.6 m -59.27 116.18 15.1 Favored Pre-proline 0 CA--C 1.548 0.899 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 176.075 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.407 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 39.9 Cg_endo -64.29 151.46 85.32 Favored 'Trans proline' 0 C--N 1.381 2.241 0 C-N-CA 122.86 2.373 . . . . 0.0 111.475 -176.514 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -64.62 -36.72 85.15 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-O 121.619 0.723 . . . . 0.0 110.408 -178.34 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.509 ' HB3' ' HD3' ' A' ' 74' ' ' ARG . 2.2 m-20 -91.49 13.21 18.33 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.486 1.115 . . . . 0.0 111.919 -173.764 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.407 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 4.8 p30 -56.15 -30.3 61.98 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 124.372 1.069 . . . . 0.0 112.154 -177.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -61.08 -33.61 73.62 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.67 1.188 . . . . 0.0 112.457 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.673 HH21 HD11 ' A' ' 55' ' ' ILE . 27.3 mtp180 -65.11 -29.34 70.2 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.436 1.094 . . . . 0.0 112.007 177.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -100.24 -11.74 20.12 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 114.913 -1.04 . . . . 0.0 111.84 -175.213 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -56.86 -35.27 68.68 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.373 1.069 . . . . 0.0 111.92 -177.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 34.7 t -73.53 -19.01 61.02 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.852 0.861 . . . . 0.0 112.507 -178.608 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.59 ' HG3' HG22 ' A' ' 55' ' ' ILE . 32.3 mmt180 -111.44 173.59 6.27 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.531 0.733 . . . . 0.0 111.781 -171.209 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -84.33 97.68 9.59 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.758 0.823 . . . . 0.0 110.387 -177.289 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 39.3 t -105.87 153.14 7.39 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 CA-C-N 114.966 -1.016 . . . . 0.0 110.255 -179.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 -124.36 91.39 3.44 Favored 'General case' 0 C--O 1.243 0.72 0 C-N-CA 124.815 1.246 . . . . 0.0 107.895 179.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.438 ' HG3' ' HB2' ' A' ' 63' ' ' HIS . 2.2 mp0 -77.08 126.86 31.65 Favored 'General case' 0 C--N 1.353 0.746 0 C-N-CA 122.916 0.486 . . . . 0.0 110.714 -177.613 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.454 HG13 ' HA ' ' A' ' 64' ' ' SER . 43.4 pt -136.46 -178.58 2.43 Favored 'Isoleucine or valine' 0 C--O 1.246 0.911 0 C-N-CA 125.327 1.451 . . . . 0.0 108.317 177.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 23.5 p -83.39 147.44 27.89 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.102 0.477 . . . . 0.0 109.825 169.118 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.798 HD13 ' SG ' ' A' ' 11' ' ' CYS . 8.1 tt -65.85 -28.29 68.86 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.929 179.404 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.434 ' O ' ' HG2' ' A' ' 90' ' ' LYS . 28.6 tt0 -62.6 -44.96 95.01 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.555 0.742 . . . . 0.0 110.428 174.107 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -60.82 -30.95 70.4 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.758 0.823 . . . . 0.0 110.609 179.253 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.7 -21.57 63.48 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.956 0.902 . . . . 0.0 113.318 178.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 65.5 mt -89.27 -41.82 14.1 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 C-N-CA 123.622 0.769 . . . . 0.0 110.36 -179.163 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.434 ' HG2' ' O ' ' A' ' 86' ' ' GLN . 16.2 ptpt -92.68 -47.44 7.09 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.016 0.526 . . . . 0.0 112.172 -174.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -99.48 18.55 17.58 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 123.746 0.818 . . . . 0.0 111.477 -173.296 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.498 ' HA ' HD12 ' A' ' 95' ' ' ILE . . . -45.66 -57.98 3.8 Favored 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 124.158 0.983 . . . . 0.0 113.527 -171.522 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.48 -38.77 81.68 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.39 0.676 . . . . 0.0 111.014 179.041 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -61.77 -46.48 94.09 Favored Glycine 0 C--N 1.352 1.454 0 O-C-N 124.462 1.101 . . . . 0.0 112.696 -179.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.498 HD12 ' HA ' ' A' ' 92' ' ' ALA . 16.8 mt -57.72 -57.95 8.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 124.137 0.975 . . . . 0.0 110.22 -179.752 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.476 ' O ' ' HG3' ' A' ' 100' ' ' GLU . 2.2 mp -57.52 -51.98 62.9 Favored 'Isoleucine or valine' 0 C--N 1.357 0.926 0 O-C-N 124.131 0.894 . . . . 0.0 110.647 -176.51 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -32.14 71.98 Favored 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -175.412 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -65.01 -37.52 87.93 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 123.806 0.691 . . . . 0.0 110.137 176.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.52 HG21 HG23 ' A' ' 60' ' ' ILE . 25.8 mt -79.93 -31.94 13.79 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.834 -178.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.476 ' HG3' ' O ' ' A' ' 96' ' ' ILE . 36.2 mt-10 -59.71 -50.59 73.26 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.396 0.678 . . . . 0.0 110.621 177.319 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -68.99 -36.99 78.47 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 123.835 0.71 . . . . 0.0 111.083 -177.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 71.4 mtm -60.43 -54.04 50.34 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 122.421 0.289 . . . . 0.0 110.323 176.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.5 HD12 HG12 ' A' ' 60' ' ' ILE . 39.7 mt -67.3 -35.71 74.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 123.288 0.635 . . . . 0.0 111.523 -178.358 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.73 -36.72 83.12 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.041 0.537 . . . . 0.0 110.47 178.85 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 70.0 m -79.49 -27.08 41.5 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 122.918 0.487 . . . . 0.0 111.383 -174.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -85.79 -33.44 21.38 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 122.377 0.271 . . . . 0.0 111.639 177.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.494 ' HG3' HE21 ' A' ' 108' ' ' GLN . 4.4 pt20 -80.47 -30.16 37.44 Favored 'General case' 0 N--CA 1.487 1.416 0 CA-C-N 118.086 0.403 . . . . 0.0 111.186 -179.273 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.494 HE21 ' HG3' ' A' ' 107' ' ' GLN . 23.5 mm-40 . . . . . 0 C--O 1.248 1.015 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 175.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.405 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 3.3 pttt . . . . . 0 C--O 1.251 1.139 0 CA-C-O 121.376 0.608 . . . . 0.0 110.348 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.551 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.2 tmtp? -143.69 140.38 30.01 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.615 -0.721 . . . . 0.0 109.163 -175.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.479 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 8.8 tt -126.25 137.19 53.5 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 176.718 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.442 HD12 HD13 ' A' ' 50' ' ' LEU . 16.4 pt -128.88 161.75 37.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 172.447 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.609 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -147.63 168.06 22.99 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.111 0.481 . . . . 0.0 109.86 176.427 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.6 tt -138.65 114.34 9.86 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.515 ' HA ' ' O ' ' A' ' 64' ' ' SER . 80.5 m -106.4 107.65 18.77 Favored 'General case' 0 C--O 1.218 -0.583 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 177.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.424 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -125.97 122.95 37.39 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.025 0.53 . . . . 0.0 110.939 -177.346 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.821 ' SG ' HD13 ' A' ' 85' ' ' LEU . 2.9 m -140.42 146.78 46.8 Favored Pre-proline 0 N--CA 1.477 0.901 0 C-N-CA 123.682 0.793 . . . . 0.0 111.113 178.194 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -85.49 0.78 8.5 Favored 'Trans proline' 0 C--N 1.377 2.069 0 C-N-CA 123.596 2.864 . . . . 0.0 112.19 -179.469 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 27.0 mmt -88.38 -26.01 22.41 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.24 1.016 . . . . 0.0 110.644 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 135.93 177.04 14.69 Favored Glycine 0 C--N 1.344 0.992 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.809 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 47.0 mt -75.53 -13.88 60.38 Favored 'General case' 0 C--N 1.352 0.678 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -179.563 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.23 -46.49 89.57 Favored 'General case' 0 C--O 1.249 1.053 0 CA-C-O 121.168 0.509 . . . . 0.0 110.877 177.2 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.44 ' HD1' ' HG ' ' A' ' 11' ' ' CYS . 12.3 t-160 -65.38 -43.53 90.45 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.742 179.591 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.404 ' HA ' HD11 ' A' ' 85' ' ' LEU . 31.2 p -65.71 -36.0 82.36 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.471 -176.681 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.0 m-30 -70.41 -32.56 70.23 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.381 0.672 . . . . 0.0 111.342 -179.05 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . 0.406 ' HB2' ' HE3' ' A' ' 20' ' ' MET . 65.2 mtm -67.15 -37.96 84.69 Favored 'General case' 0 N--CA 1.484 1.275 0 CA-C-O 120.888 0.375 . . . . 0.0 110.762 175.333 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.38 -39.32 81.77 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.989 173.58 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.06 -40.57 91.02 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.668 0.787 . . . . 0.0 110.662 -178.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -61.4 -51.36 69.06 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.604 0.762 . . . . 0.0 109.616 177.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.405 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -64.52 -48.44 75.09 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 114.765 -1.107 . . . . 0.0 112.502 -174.314 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 91.4 mt -66.12 -33.0 74.79 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.421 0.689 . . . . 0.0 111.69 179.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.502 ' HA ' HG21 ' A' ' 36' ' ' VAL . 32.4 tt0 -64.03 -52.21 60.52 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 123.584 0.552 . . . . 0.0 110.02 178.816 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -54.42 -48.63 71.42 Favored 'General case' 0 N--CA 1.481 1.079 0 O-C-N 124.213 0.945 . . . . 0.0 110.572 179.322 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.9 -47.37 86.03 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.603 1.161 . . . . 0.0 111.955 -178.035 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.42 -28.29 67.78 Favored 'General case' 0 N--CA 1.476 0.866 0 CA-C-N 115.068 -0.969 . . . . 0.0 112.842 178.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 26' ' ' GLU . 41.1 t -72.0 -38.11 62.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 178.296 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -67.88 -25.21 65.4 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.578 1.151 . . . . 0.0 111.317 176.394 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -80.88 -9.39 59.83 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 123.847 0.859 . . . . 0.0 112.075 177.298 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.62 2.81 67.09 Favored Glycine 0 C--N 1.347 1.167 0 N-CA-C 115.442 0.937 . . . . 0.0 115.442 166.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.405 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.1 OUTLIER -113.92 178.66 4.2 Favored 'General case' 0 N--CA 1.49 1.527 0 CA-C-N 117.746 0.773 . . . . 0.0 111.751 179.849 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.551 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 38.9 tt0 -76.47 153.73 35.33 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 123.926 0.766 . . . . 0.0 109.366 178.154 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.502 HG21 ' HA ' ' A' ' 26' ' ' GLU . 7.2 p -136.49 138.83 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 123.073 0.549 . . . . 0.0 110.284 178.493 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 43.7 tptt -146.8 122.1 10.25 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 175.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.609 HG12 ' HB3' ' A' ' 7' ' ' ALA . 45.7 mt -122.69 113.0 36.46 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 123.098 0.559 . . . . 0.0 111.788 -173.433 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 68.8 tt0 -81.25 107.46 14.06 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.669 0.788 . . . . 0.0 109.667 174.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.48 HG22 ' HB2' ' A' ' 9' ' ' CYS . 22.3 p -88.72 109.31 20.04 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.233 0.613 . . . . 0.0 110.15 175.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.517 HE22 ' HB2' ' A' ' 70' ' ' GLU . 42.0 mt-30 -103.6 155.42 18.56 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.685 0.755 . . . . 0.0 111.542 178.182 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 178.52 167.95 37.08 Favored Glycine 0 C--O 1.24 0.474 0 CA-C-N 114.529 -1.214 . . . . 0.0 110.406 172.285 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.12 -19.49 65.63 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-N 116.944 0.372 . . . . 0.0 110.2 173.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -64.63 -40.74 96.01 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 124.548 1.139 . . . . 0.0 110.856 171.178 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 162.47 -176.68 38.8 Favored Glycine 0 C--N 1.344 1.003 0 CA-C-N 115.43 -0.805 . . . . 0.0 112.176 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.532 HD13 ' NH2' ' A' ' 49' ' ' ARG . 85.0 mt -129.25 134.24 64.22 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 C-N-CA 123.972 0.909 . . . . 0.0 108.789 176.123 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 9.7 tp-100 -140.8 149.65 42.31 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.013 0.925 . . . . 0.0 110.398 -172.141 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.455 ' HB3' ' O ' ' A' ' 38' ' ' ILE . 33.8 t30 57.22 34.42 24.77 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 125.275 1.43 . . . . 0.0 110.392 177.377 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.532 ' NH2' HD13 ' A' ' 46' ' ' ILE . 20.4 ttm180 -57.39 131.51 50.31 Favored 'General case' 0 C--N 1.351 0.664 0 C-N-CA 124.695 1.198 . . . . 0.0 112.737 -171.209 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.594 ' HB2' HH22 ' A' ' 74' ' ' ARG . 27.8 mt -72.95 149.04 43.7 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 113.871 -1.513 . . . . 0.0 110.961 177.246 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.431 ' O ' HG13 ' A' ' 55' ' ' ILE . 42.7 p -103.38 174.3 5.93 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.287 173.409 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.72 -31.42 71.58 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 122.716 0.406 . . . . 0.0 110.631 173.44 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -66.23 -42.36 88.79 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.883 0.873 . . . . 0.0 110.686 178.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -57.19 -48.92 77.55 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.423 0.689 . . . . 0.0 111.035 175.881 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.677 HD11 HH21 ' A' ' 74' ' ' ARG . 23.1 mt -69.21 -36.39 72.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 O-C-N 124.143 0.902 . . . . 0.0 111.24 -175.292 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.75 -46.16 69.58 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.831 0.853 . . . . 0.0 111.451 -178.156 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -84.96 -10.73 56.75 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.248 0.619 . . . . 0.0 111.557 -178.061 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.95 106.93 1.12 Allowed 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.339 0.656 . . . . 0.0 110.761 178.165 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 13.7 m -63.35 -36.0 82.26 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.27 1.028 . . . . 0.0 109.831 169.495 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.513 HG23 HG21 ' A' ' 99' ' ' ILE . 75.8 mt -132.07 140.83 46.98 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 124.193 0.997 . . . . 0.0 110.082 -177.716 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 32.4 mt -135.96 125.43 39.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 C-N-CA 123.746 0.818 . . . . 0.0 108.964 174.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.3 mp -112.28 127.96 69.18 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 175.394 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . 0.405 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 5.7 m170 -99.82 86.15 3.24 Favored 'General case' 0 N--CA 1.486 1.353 0 CA-C-O 121.773 0.797 . . . . 0.0 109.111 169.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.515 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 19.7 m -81.09 81.63 7.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 114.254 -1.339 . . . . 0.0 109.173 175.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 34.9 m -128.5 159.68 39.74 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.413 0 CA-C-O 121.741 0.782 . . . . 0.0 111.608 -171.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -110.43 -25.4 10.08 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 114.494 -1.23 . . . . 0.0 108.994 172.411 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 14.6 m -135.96 164.39 32.18 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 C-N-CA 125.523 1.529 . . . . 0.0 108.868 -178.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 96.2 m -68.53 114.1 19.89 Favored Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 122.999 0.52 . . . . 0.0 110.272 -179.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.561 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 46.1 Cg_endo -68.45 152.97 74.87 Favored 'Trans proline' 0 C--N 1.382 2.323 0 C-N-CA 122.445 2.097 . . . . 0.0 112.489 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.517 ' HB2' HE22 ' A' ' 41' ' ' GLN . 40.1 mm-40 -67.29 -29.31 68.88 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.368 0.667 . . . . 0.0 111.637 -175.581 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.487 ' HB3' ' HD3' ' A' ' 74' ' ' ARG . 2.1 m-20 -104.32 18.69 21.64 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.607 -175.251 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.561 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 41.7 t30 -57.62 -35.46 70.5 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.166 0.986 . . . . 0.0 112.341 -177.654 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.53 -31.37 72.51 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 123.385 0.674 . . . . 0.0 112.632 -179.745 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.677 HH21 HD11 ' A' ' 55' ' ' ILE . 35.5 mtp180 -59.26 -33.79 71.47 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.87 0.868 . . . . 0.0 112.416 175.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -98.95 -16.49 18.74 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 115.083 -0.962 . . . . 0.0 111.448 -175.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -54.97 -33.43 62.44 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 124.14 0.976 . . . . 0.0 112.39 -176.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 40.4 p -78.75 -6.39 55.76 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.793 0.837 . . . . 0.0 112.909 -177.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.57 ' HG3' HG22 ' A' ' 55' ' ' ILE . 25.2 mmt180 -120.24 171.13 8.72 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.909 0.884 . . . . 0.0 111.343 -172.58 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -78.37 92.69 4.59 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.361 0.665 . . . . 0.0 110.014 -177.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 43.6 t -109.05 139.48 31.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 123.169 0.588 . . . . 0.0 110.946 -177.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -108.11 91.01 3.47 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.981 1.312 . . . . 0.0 107.92 -179.299 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.405 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 44.7 mt-10 -78.41 128.89 34.27 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.526 -177.016 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.423 HG13 ' HA ' ' A' ' 64' ' ' SER . 40.9 pt -141.87 -174.85 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 C-N-CA 125.433 1.493 . . . . 0.0 108.819 -179.408 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 25.5 p -83.34 148.83 27.11 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.033 0.444 . . . . 0.0 109.956 167.523 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.821 HD13 ' SG ' ' A' ' 11' ' ' CYS . 7.8 tt -63.68 -29.91 71.08 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.285 177.098 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.523 ' HG2' ' HE3' ' A' ' 90' ' ' LYS . 27.6 tt0 -70.15 -36.27 74.63 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.954 178.323 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -60.64 -33.23 72.48 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.703 0.801 . . . . 0.0 110.367 173.491 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.1 -20.63 64.94 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.827 0.851 . . . . 0.0 113.274 178.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 68.4 mt -87.32 -55.26 6.69 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 123.189 0.595 . . . . 0.0 109.654 178.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.523 ' HE3' ' HG2' ' A' ' 86' ' ' GLN . 18.0 ptpt -77.78 -43.84 29.42 Favored 'General case' 0 N--CA 1.482 1.174 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.626 -173.552 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -105.51 20.46 18.86 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.032 0.933 . . . . 0.0 110.522 -173.454 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.405 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -44.03 -58.99 2.51 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 124.007 0.923 . . . . 0.0 113.052 -175.342 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.07 -41.15 91.77 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.032 -0.986 . . . . 0.0 110.785 178.317 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -58.21 -46.02 93.34 Favored Glycine 0 C--N 1.352 1.459 0 O-C-N 124.493 1.121 . . . . 0.0 112.539 -179.189 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 26.8 mt -59.74 -57.42 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 124.516 1.127 . . . . 0.0 109.625 -178.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.8 mp -55.31 -50.97 60.87 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.99 0 O-C-N 124.302 1.002 . . . . 0.0 111.027 -177.225 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.95 -29.27 68.28 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 122.897 0.479 . . . . 0.0 112.097 -175.774 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -68.74 -33.72 74.39 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 123.493 0.496 . . . . 0.0 110.16 176.589 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.513 HG21 HG23 ' A' ' 60' ' ' ILE . 66.4 mt -75.82 -41.2 39.81 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 -179.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -58.03 -45.09 87.53 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 114.194 -1.366 . . . . 0.0 111.965 177.403 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -74.45 -30.29 61.82 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 123.208 0.317 . . . . 0.0 111.232 -178.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 69.9 mtm -66.99 -49.93 63.83 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 122.368 0.267 . . . . 0.0 110.404 175.335 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 50.4 mt -62.5 -36.74 76.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 123.364 0.666 . . . . 0.0 110.233 176.182 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.402 ' HA ' ' HG2' ' A' ' 107' ' ' GLN . . . -65.52 -38.95 91.15 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.118 0.567 . . . . 0.0 110.867 176.62 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 26.5 t -68.61 -33.52 74.19 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.43 0.692 . . . . 0.0 111.312 -174.441 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -85.67 -29.3 24.1 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-N 116.096 -0.502 . . . . 0.0 112.255 179.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.402 ' HG2' ' HA ' ' A' ' 104' ' ' ALA . 4.3 pt20 -86.7 -30.02 22.0 Favored 'General case' 0 N--CA 1.492 1.67 0 CA-C-N 118.333 0.515 . . . . 0.0 111.593 -174.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 . . . . . 0 N--CA 1.48 1.056 0 C-N-CA 123.422 0.689 . . . . 0.0 110.8 179.825 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.656 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 15.0 pttt . . . . . 0 N--CA 1.481 1.117 0 CA-C-O 120.964 0.411 . . . . 0.0 110.195 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.538 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.4 tmtp? -145.22 143.25 30.17 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-O 121.377 0.608 . . . . 0.0 110.501 -174.3 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.432 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 8.4 tt -131.47 138.56 49.07 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.542 1.137 . . . . 0.0 108.075 174.491 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.467 HG13 HG23 ' A' ' 61' ' ' ILE . 17.4 pt -129.01 163.91 32.78 Favored 'Isoleucine or valine' 0 C--O 1.24 0.588 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 170.41 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.603 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -152.39 168.47 25.35 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 120.95 0.405 . . . . 0.0 110.074 178.683 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.7 tt -141.12 120.8 13.37 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 107.513 -1.291 . . . . 0.0 107.513 -177.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.553 ' HA ' ' O ' ' A' ' 64' ' ' SER . 60.0 m -110.73 113.78 26.65 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.664 0.786 . . . . 0.0 108.913 175.285 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.409 ' HB3' HG12 ' A' ' 65' ' ' VAL . . . -125.64 112.61 16.35 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 122.78 0.432 . . . . 0.0 110.925 -175.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.546 ' SG ' ' HB2' ' A' ' 13' ' ' MET . 44.0 t -121.27 136.61 25.92 Favored Pre-proline 0 N--CA 1.47 0.537 0 C-N-CA 123.928 0.891 . . . . 0.0 110.183 -179.589 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -69.58 -23.26 31.8 Favored 'Trans proline' 0 C--N 1.37 1.682 0 C-N-CA 122.781 2.321 . . . . 0.0 112.477 175.26 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.546 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 0.3 OUTLIER -71.65 -43.15 66.58 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.596 0.758 . . . . 0.0 111.209 -178.097 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 156.8 -172.06 34.39 Favored Glycine 0 C--N 1.345 1.055 0 CA-C-N 116.381 -0.372 . . . . 0.0 113.265 179.343 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 65.4 mt -82.6 -18.94 39.44 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 -175.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.85 -42.33 99.71 Favored 'General case' 0 N--CA 1.485 1.295 0 CA-C-N 118.818 0.736 . . . . 0.0 111.234 -177.832 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.456 ' CD2' HD22 ' A' ' 85' ' ' LEU . 16.4 t60 -65.76 -42.22 91.15 Favored 'General case' 0 C--O 1.247 0.966 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.124 177.417 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.453 HG22 HD11 ' A' ' 85' ' ' LEU . 35.3 p -67.38 -32.61 73.65 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.238 -178.517 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -74.47 -31.37 62.2 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.357 0.663 . . . . 0.0 111.738 -178.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 56.3 mtm -64.8 -41.27 95.94 Favored 'General case' 0 N--CA 1.485 1.316 0 CA-C-O 120.921 0.391 . . . . 0.0 110.234 172.681 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.35 -38.4 84.76 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.324 174.541 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.84 -32.79 72.73 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.401 0.68 . . . . 0.0 111.059 -179.334 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.417 HE21 ' HG3' ' A' ' 27' ' ' GLU . 25.2 tp60 -74.22 -42.77 59.22 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 122.944 0.498 . . . . 0.0 109.832 177.728 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.37 -51.01 61.5 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.489 -176.469 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.417 HD11 ' OG ' ' A' ' 64' ' ' SER . 94.3 mt -63.55 -34.26 77.41 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.502 0.721 . . . . 0.0 111.374 177.799 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.573 ' HA ' HG21 ' A' ' 36' ' ' VAL . 31.0 tt0 -56.38 -56.83 16.21 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 123.916 0.76 . . . . 0.0 110.455 174.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.471 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 44.8 mt-10 -52.79 -48.81 66.62 Favored 'General case' 0 N--CA 1.478 0.966 0 O-C-N 124.535 1.147 . . . . 0.0 111.238 -179.785 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.94 -49.14 78.96 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.303 1.041 . . . . 0.0 112.199 -177.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.26 -26.3 67.28 Favored 'General case' 0 CA--C 1.546 0.81 0 CA-C-N 115.372 -0.831 . . . . 0.0 112.863 178.519 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 26' ' ' GLU . 55.4 t -72.31 -38.3 61.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 178.21 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.471 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 8.4 mm-40 -71.54 -22.64 61.74 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 114.836 -1.074 . . . . 0.0 111.051 178.313 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -82.43 -20.19 37.5 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.318 0.647 . . . . 0.0 111.105 174.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 113.48 -37.56 3.55 Favored Glycine 0 C--N 1.348 1.225 0 N-CA-C 113.951 0.34 . . . . 0.0 113.951 167.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.656 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -76.0 174.39 10.05 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 -175.07 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.538 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 12.4 tp10 -72.56 151.65 42.29 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 113.935 -1.484 . . . . 0.0 109.507 178.515 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.573 HG21 ' HA ' ' A' ' 26' ' ' GLU . 9.6 p -136.05 128.71 46.26 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 C-N-CA 123.045 0.538 . . . . 0.0 110.753 -179.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 48.5 tptt -138.03 114.97 10.78 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.654 0.782 . . . . 0.0 109.071 176.276 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.603 HG12 ' HB3' ' A' ' 7' ' ' ALA . 43.2 mt -118.69 111.01 31.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -174.098 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -72.9 148.11 44.67 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 171.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.8 p -133.69 122.21 23.07 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.863 0.865 . . . . 0.0 109.182 -177.577 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -114.52 134.27 55.15 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -162.25 179.74 37.38 Favored Glycine 0 C--N 1.341 0.807 0 N-CA-C 112.699 -0.16 . . . . 0.0 112.699 -176.459 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.35 -24.19 67.21 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.943 0.897 . . . . 0.0 112.123 179.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -75.61 -36.3 60.3 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.598 0.759 . . . . 0.0 110.548 176.511 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 147.36 -156.52 27.02 Favored Glycine 0 C--N 1.346 1.099 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.417 -177.589 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.413 HD12 HH22 ' A' ' 49' ' ' ARG . 77.5 mt -113.12 141.5 28.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 174.198 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -135.54 150.25 49.68 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.258 1.023 . . . . 0.0 109.145 179.17 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 8.8 t30 64.3 39.29 7.37 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.533 1.133 . . . . 0.0 110.085 174.366 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.413 HH22 HD12 ' A' ' 46' ' ' ILE . 22.8 tpp180 -42.03 125.69 3.04 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 125.961 1.704 . . . . 0.0 113.31 -178.176 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 42.7 mt -82.48 126.95 32.82 Favored 'General case' 0 C--O 1.242 0.663 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.221 174.074 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.418 ' O ' HG13 ' A' ' 55' ' ' ILE . 60.2 p -96.64 164.35 12.63 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.932 -178.062 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.87 -29.92 63.37 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.462 0.705 . . . . 0.0 111.247 177.299 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.413 ' O ' ' HG3' ' A' ' 57' ' ' GLU . 47.7 tt0 -57.54 -61.14 2.72 Favored 'General case' 0 C--N 1.354 0.763 0 C-N-CA 123.783 0.833 . . . . 0.0 110.104 170.807 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.454 ' HB3' HG21 ' A' ' 6' ' ' ILE . 38.9 m-20 -52.02 -44.11 64.03 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 124.134 0.973 . . . . 0.0 112.343 -176.555 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ILE . . . . . 0.527 HG22 ' HG3' ' A' ' 78' ' ' ARG . 29.4 mt -67.4 -38.11 80.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 O-C-N 124.285 0.991 . . . . 0.0 111.742 -175.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -79.88 -28.69 39.9 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.218 179.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' A' ' 53' ' ' GLN . 53.0 mt-10 -71.07 -35.97 72.09 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.534 0.734 . . . . 0.0 110.274 173.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -58.53 108.01 0.58 Allowed 'General case' 0 C--N 1.348 0.521 0 CA-C-N 114.643 -1.162 . . . . 0.0 111.997 -171.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 37.3 m -62.68 -40.43 97.06 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 115.046 -0.979 . . . . 0.0 109.041 165.01 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 80.4 mt -129.27 140.26 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.317 -178.194 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.467 HG23 HG13 ' A' ' 6' ' ' ILE . 20.2 mt -130.31 135.0 61.63 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 171.595 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -119.42 133.98 64.47 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 173.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . 0.441 ' HB2' ' HG3' ' A' ' 82' ' ' GLU . 13.2 m170 -107.46 84.35 1.95 Allowed 'General case' 0 N--CA 1.484 1.232 0 CA-C-O 121.481 0.658 . . . . 0.0 109.648 170.421 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.553 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 20.4 m -78.54 80.59 4.92 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 124.659 1.184 . . . . 0.0 110.344 177.014 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.409 HG12 ' HB3' ' A' ' 10' ' ' ALA . 34.7 m -125.37 160.0 31.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 CA-C-O 121.665 0.745 . . . . 0.0 112.175 -169.567 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -110.59 -23.13 11.27 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 114.589 -1.187 . . . . 0.0 109.071 173.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 17.0 m -130.86 165.87 30.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 C-N-CA 125.545 1.538 . . . . 0.0 108.638 178.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 88.8 m -62.29 117.17 27.75 Favored Pre-proline 0 CA--C 1.547 0.848 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 175.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.606 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 38.5 Cg_endo -63.92 142.91 83.89 Favored 'Trans proline' 0 C--N 1.376 2.002 0 C-N-CA 122.06 1.84 . . . . 0.0 111.544 177.907 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -68.61 -37.49 79.82 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.45 0.7 . . . . 0.0 110.715 -174.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -97.6 25.06 6.07 Favored 'General case' 0 C--O 1.219 -0.503 0 CA-C-N 115.21 -0.905 . . . . 0.0 110.683 -177.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.606 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 38.6 t30 -55.11 -37.35 66.77 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.148 0.579 . . . . 0.0 111.407 177.285 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.65 -22.1 66.89 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.613 0.765 . . . . 0.0 112.778 -179.181 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.6 mmp_? -66.71 -33.09 74.86 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.146 0.578 . . . . 0.0 111.455 174.097 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -107.62 -29.48 9.14 Favored 'General case' 0 N--CA 1.485 1.298 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -168.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -54.94 -27.43 43.4 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 -165.403 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 20.9 t -84.8 7.19 21.6 Favored 'General case' 0 CA--C 1.56 1.352 0 C-N-CA 123.638 0.775 . . . . 0.0 112.204 -179.412 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.527 ' HG3' HG22 ' A' ' 55' ' ' ILE . 34.9 mmt180 -121.28 -177.03 3.42 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 124.595 1.158 . . . . 0.0 110.036 179.511 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -79.5 86.79 5.14 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.062 0.545 . . . . 0.0 110.893 178.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 22.5 t -108.68 146.64 14.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 123.75 0.82 . . . . 0.0 109.877 179.184 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -125.73 96.04 4.64 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.819 0.848 . . . . 0.0 109.737 177.589 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.441 ' HG3' ' HB2' ' A' ' 63' ' ' HIS . 1.8 mp0 -72.3 129.1 37.62 Favored 'General case' 0 C--N 1.352 0.696 0 CA-C-O 121.233 0.54 . . . . 0.0 110.404 178.261 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.485 HG13 ' HA ' ' A' ' 64' ' ' SER . 45.8 pt -138.45 -176.48 1.35 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.83 0 C-N-CA 125.231 1.412 . . . . 0.0 108.386 177.271 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 13.1 p -83.63 147.44 27.71 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 122.63 0.372 . . . . 0.0 110.158 170.42 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.518 HD13 ' HB2' ' A' ' 11' ' ' CYS . 4.8 tt -63.26 -30.23 71.41 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.341 0.656 . . . . 0.0 111.153 178.074 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -61.38 -43.76 98.32 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.39 0.676 . . . . 0.0 110.946 173.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.425 ' HB3' HD12 ' A' ' 83' ' ' ILE . 9.6 t70 -59.77 -32.99 71.11 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.628 0.771 . . . . 0.0 110.901 179.427 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.483 ' HB2' ' HB3' ' A' ' 64' ' ' SER . . . -65.46 -23.59 66.96 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.837 0.855 . . . . 0.0 113.244 179.112 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 34.9 mt -93.89 -51.12 11.51 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 123.091 0.556 . . . . 0.0 109.895 -179.187 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 58.1 pttt -75.62 -29.73 59.28 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.329 0.652 . . . . 0.0 112.297 -174.759 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -126.45 18.75 7.5 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 122.989 0.516 . . . . 0.0 110.886 -168.736 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -44.98 -57.35 3.88 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -174.671 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.27 -36.07 79.01 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.024 -0.989 . . . . 0.0 111.491 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -62.48 -56.55 20.97 Favored Glycine 0 C--N 1.351 1.365 0 O-C-N 124.152 0.908 . . . . 0.0 111.554 179.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.405 ' O ' HG13 ' A' ' 99' ' ' ILE . 33.7 mt -47.05 -57.76 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 125.039 1.336 . . . . 0.0 111.09 -179.383 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.9 mp -57.48 -53.49 43.48 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 O-C-N 124.244 0.965 . . . . 0.0 111.212 -176.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -27.26 67.64 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -176.567 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 24.3 mm-40 -69.33 -36.4 76.89 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.762 0.825 . . . . 0.0 109.744 178.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.405 HG13 ' O ' ' A' ' 95' ' ' ILE . 30.3 mt -77.99 -38.94 25.01 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -55.71 -47.84 76.17 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 114.22 -1.355 . . . . 0.0 111.489 176.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -74.56 -33.76 62.77 Favored 'General case' 0 C--N 1.349 0.557 0 O-C-N 123.566 0.541 . . . . 0.0 111.278 -177.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 70.3 mtm -60.46 -51.41 69.6 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 176.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 60.2 mt -65.76 -45.27 92.2 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.916 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.562 178.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.73 -31.53 72.24 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -175.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 66.1 m -84.2 -24.74 29.97 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -176.004 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -84.46 -31.8 24.38 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 122.002 0.121 . . . . 0.0 110.973 174.131 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -84.08 -33.32 24.41 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 122.847 0.459 . . . . 0.0 111.248 -178.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 27.3 mm-40 . . . . . 0 C--O 1.251 1.183 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 177.293 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.6 mmt . . . . . 0 N--CA 1.484 1.268 0 N-CA-C 110.479 -0.193 . . . . 0.0 110.479 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 54.2 m -68.27 100.14 1.01 Allowed 'General case' 0 C--N 1.353 0.731 0 C-N-CA 123.328 0.651 . . . . 0.0 110.406 178.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.622 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 17.1 pttt -74.07 178.83 4.75 Favored 'General case' 0 N--CA 1.48 1.038 0 CA-C-O 121.302 0.573 . . . . 0.0 110.847 174.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.54 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.0 tmtp? -146.34 143.61 29.22 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -170.374 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.486 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.2 tt -132.29 141.9 49.17 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 175.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.496 HD13 ' HA ' ' A' ' 55' ' ' ILE . 21.0 pt -132.57 169.79 21.26 Favored 'Isoleucine or valine' 0 C--O 1.241 0.653 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 170.501 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.615 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -153.64 169.74 22.53 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.354 175.636 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.1 tt -143.03 113.5 7.38 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 178.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 64' ' ' SER . 56.3 m -101.05 113.53 26.63 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 175.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.474 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -126.8 119.0 25.79 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 122.626 0.37 . . . . 0.0 110.405 -178.035 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.514 ' SG ' ' HB2' ' A' ' 13' ' ' MET . 51.7 t -125.26 138.53 31.86 Favored Pre-proline 0 N--CA 1.472 0.64 0 C-N-CA 123.339 0.656 . . . . 0.0 111.185 -172.635 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -68.38 -20.42 42.27 Favored 'Trans proline' 0 C--N 1.378 2.109 0 C-N-CA 123.096 2.531 . . . . 0.0 112.606 172.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.514 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 60.5 mtt -75.91 -46.36 30.38 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.635 0.774 . . . . 0.0 110.01 178.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 141.92 -161.49 27.13 Favored Glycine 0 C--N 1.346 1.138 0 CA-C-N 116.038 -0.528 . . . . 0.0 113.307 176.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 52.9 mt -74.2 -26.61 60.37 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 -170.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.73 -43.34 94.25 Favored 'General case' 0 N--CA 1.485 1.32 0 CA-C-O 121.498 0.666 . . . . 0.0 110.971 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 8.6 t-160 -71.56 -38.1 71.0 Favored 'General case' 0 C--O 1.247 0.935 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.385 -178.353 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 51.6 p -66.45 -32.02 73.14 Favored 'General case' 0 C--N 1.35 0.604 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.869 178.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 18.6 m-30 -72.14 -30.35 64.95 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.049 0.54 . . . . 0.0 111.694 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 41.0 mtm -67.28 -40.19 86.09 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 120.758 0.313 . . . . 0.0 110.456 173.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.46 -36.6 74.01 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.363 176.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.56 -50.38 58.78 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.828 0.851 . . . . 0.0 110.301 -178.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.484 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 8.7 tp-100 -58.32 -43.94 88.4 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.737 0.815 . . . . 0.0 110.44 179.098 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.48 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -62.73 -54.39 39.88 Favored 'General case' 0 CA--C 1.55 0.96 0 CA-C-N 115.66 -0.7 . . . . 0.0 112.052 -178.204 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 92.1 mt -64.69 -29.61 70.61 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.196 0.598 . . . . 0.0 111.536 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.503 ' O ' HG23 ' A' ' 30' ' ' VAL . 32.9 tt0 -65.91 -55.27 17.78 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.812 0.695 . . . . 0.0 110.012 -179.385 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.51 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 27.5 mm-40 -52.44 -47.5 66.37 Favored 'General case' 0 N--CA 1.484 1.261 0 O-C-N 124.359 1.037 . . . . 0.0 110.432 178.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.49 -51.68 67.59 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.502 1.121 . . . . 0.0 111.925 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.55 -23.39 65.42 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 115.332 -0.849 . . . . 0.0 113.184 178.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.503 HG23 ' O ' ' A' ' 26' ' ' GLU . 53.9 t -74.88 -37.6 42.13 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 178.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.51 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 17.4 mm-40 -72.75 -21.48 61.01 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.745 177.393 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -80.64 -13.76 58.76 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.532 0.733 . . . . 0.0 111.76 174.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 105.0 -37.79 3.62 Favored Glycine 0 C--N 1.347 1.191 0 N-CA-C 114.278 0.471 . . . . 0.0 114.278 167.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.622 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -76.75 -179.4 5.35 Favored 'General case' 0 N--CA 1.483 1.207 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -175.897 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.54 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 8.8 tp10 -73.05 153.06 41.01 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 114.453 -1.248 . . . . 0.0 110.31 176.496 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.486 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 6.7 p -142.46 128.06 17.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 123.273 0.629 . . . . 0.0 110.595 176.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 49.7 tptt -136.39 114.51 11.48 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 177.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.615 HG12 ' HB3' ' A' ' 7' ' ' ALA . 59.2 mt -117.39 111.31 34.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.925 0 C-N-CA 122.6 0.36 . . . . 0.0 111.877 -174.327 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -77.99 141.79 38.7 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.614 0.766 . . . . 0.0 109.099 171.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.417 HG22 ' HB2' ' A' ' 9' ' ' CYS . 17.4 p -124.64 117.51 24.44 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.53 0.732 . . . . 0.0 109.294 -177.666 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.474 ' O ' ' HA ' ' A' ' 10' ' ' ALA . 42.1 mt-30 -109.81 135.79 50.16 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.578 0.751 . . . . 0.0 110.146 178.44 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -161.68 179.59 36.97 Favored Glycine 0 C--N 1.336 0.57 0 N-CA-C 111.929 -0.468 . . . . 0.0 111.929 178.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.24 -14.51 63.0 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.127 0.571 . . . . 0.0 111.998 -179.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -84.78 -27.37 26.91 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.468 0.707 . . . . 0.0 111.347 176.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 147.19 -157.67 27.48 Favored Glycine 0 C--N 1.344 0.986 0 CA-C-N 116.413 -0.358 . . . . 0.0 112.545 -179.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.418 HG12 ' HG2' ' A' ' 41' ' ' GLN . 70.2 mt -127.48 132.35 69.39 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 C-N-CA 123.711 0.804 . . . . 0.0 109.995 178.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.408 ' HB3' ' OG1' ' A' ' 40' ' ' THR . 8.2 tp-100 -126.91 150.25 49.4 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.198 0.999 . . . . 0.0 110.586 -178.143 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 19.7 t30 61.43 41.5 12.69 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 124.966 1.306 . . . . 0.0 110.219 174.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 22.6 tpp180 -48.35 122.34 5.27 Favored 'General case' 0 C--N 1.356 0.873 0 C-N-CA 125.277 1.431 . . . . 0.0 112.544 -176.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.43 ' HB2' HH22 ' A' ' 74' ' ' ARG . 36.9 mt -66.73 148.99 51.18 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 114.605 -1.179 . . . . 0.0 110.621 170.107 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 34.4 p -104.45 167.81 9.5 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 172.24 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.61 -34.49 71.19 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-O 121.019 0.438 . . . . 0.0 110.461 175.52 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -63.76 -48.64 76.12 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.847 175.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -54.18 -42.35 69.57 Favored 'General case' 0 N--CA 1.496 1.873 0 C-N-CA 123.321 0.648 . . . . 0.0 111.791 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.617 HG22 ' HG3' ' A' ' 78' ' ' ARG . 43.2 mt -75.28 -27.96 19.97 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.939 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.041 -176.205 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -75.51 -45.9 35.49 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.485 0.714 . . . . 0.0 111.117 176.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -61.38 -35.3 77.1 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.342 1.057 . . . . 0.0 110.77 178.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -53.15 100.49 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.579 0 O-C-N 125.001 1.438 . . . . 0.0 112.582 -174.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 30.2 m -63.94 -36.45 84.0 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 114.673 -1.149 . . . . 0.0 109.067 167.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.5 HG23 HG21 ' A' ' 99' ' ' ILE . 80.0 mt -129.05 140.45 49.2 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 CA-C-N 114.769 -1.105 . . . . 0.0 109.794 178.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.529 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 35.1 mt -129.89 141.37 46.6 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 N-CA-C 107.972 -1.122 . . . . 0.0 107.972 171.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.6 mp -127.02 112.55 29.22 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 CA-C-N 118.344 0.52 . . . . 0.0 109.632 172.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 8.6 m170 -89.17 83.95 6.52 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-O 121.745 0.783 . . . . 0.0 109.322 170.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.462 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 20.6 p -80.32 79.86 6.85 Favored 'General case' 0 C--O 1.24 0.567 0 CA-C-N 114.361 -1.29 . . . . 0.0 109.312 176.509 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 27.6 m -126.21 161.52 31.79 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 CA-C-O 121.685 0.755 . . . . 0.0 111.943 -170.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -123.08 -17.24 6.75 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 114.491 -1.231 . . . . 0.0 109.592 175.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 6.7 m -131.92 159.22 43.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 124.699 1.2 . . . . 0.0 108.401 173.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 79.0 m -64.45 111.83 6.46 Favored Pre-proline 0 CA--C 1.544 0.714 0 O-C-N 123.8 0.688 . . . . 0.0 109.663 177.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.512 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 55.8 Cg_endo -68.14 142.23 55.17 Favored 'Trans proline' 0 C--N 1.376 2.01 0 C-N-CA 122.175 1.916 . . . . 0.0 110.651 -179.157 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.425 ' HB2' HE22 ' A' ' 41' ' ' GLN . 18.4 mm-40 -65.36 -21.87 66.74 Favored 'General case' 0 N--CA 1.482 1.141 0 CA-C-O 121.327 0.584 . . . . 0.0 111.63 -173.496 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.838 ' HB3' HH11 ' A' ' 74' ' ' ARG . 4.0 m-20 -104.46 12.61 33.1 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.201 1.0 . . . . 0.0 112.737 -174.511 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.512 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 5.6 p30 -60.06 -24.95 64.98 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.558 0.743 . . . . 0.0 112.384 -176.044 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -60.89 -32.4 71.86 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.887 1.275 . . . . 0.0 113.08 -179.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.838 HH11 ' HB3' ' A' ' 71' ' ' ASP . 40.1 mtp180 -68.36 -25.32 65.02 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 124.338 1.055 . . . . 0.0 111.569 -179.418 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.433 ' HB3' HG21 ' A' ' 80' ' ' VAL . 33.0 m-85 -103.07 -2.21 27.87 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 114.139 -1.392 . . . . 0.0 111.277 -175.511 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -54.79 -42.76 72.16 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 124.639 1.176 . . . . 0.0 111.933 -179.136 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 58.5 p -82.86 -13.69 55.68 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.642 0.777 . . . . 0.0 112.358 -177.087 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.617 ' HG3' HG22 ' A' ' 55' ' ' ILE . 33.3 mmt180 -103.64 164.54 11.6 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.706 0.802 . . . . 0.0 111.63 -169.01 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -83.38 99.35 10.0 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 123.748 0.819 . . . . 0.0 110.146 -177.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.529 ' HA ' ' HB ' ' A' ' 61' ' ' ILE . 51.4 t -112.28 135.68 50.87 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 C-N-CA 123.643 0.777 . . . . 0.0 110.514 -174.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 73.6 m-85 -104.26 88.58 3.02 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 107.367 -1.345 . . . . 0.0 107.367 175.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -86.92 116.13 24.79 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 114.619 -1.173 . . . . 0.0 109.676 -172.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.439 HG13 ' HA ' ' A' ' 64' ' ' SER . 43.6 pt -126.24 -172.58 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 124.693 1.197 . . . . 0.0 110.106 -179.459 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 15.9 p -82.79 147.34 28.45 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.728 169.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.444 HD13 ' HB2' ' A' ' 11' ' ' CYS . 6.5 tt -62.85 -27.69 69.51 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.381 176.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.659 ' HG2' ' HE2' ' A' ' 90' ' ' LYS . 10.1 tt0 -71.11 -40.52 71.42 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 122.725 0.41 . . . . 0.0 111.113 177.016 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.43 ' HB3' HD12 ' A' ' 83' ' ' ILE . 24.5 t70 -59.86 -33.54 71.94 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.101 0.561 . . . . 0.0 110.195 176.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -62.54 -28.44 69.86 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.881 0.872 . . . . 0.0 112.739 177.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 63.9 mt -88.03 -49.04 14.77 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.992 0 C-N-CA 123.287 0.635 . . . . 0.0 110.273 -179.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.659 ' HE2' ' HG2' ' A' ' 86' ' ' GLN . 0.1 OUTLIER -79.46 -30.69 42.24 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 -173.599 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -123.31 16.8 9.81 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.148 0.579 . . . . 0.0 110.851 -170.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.48 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -40.22 -59.01 1.36 Allowed 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 124.304 1.042 . . . . 0.0 113.584 -173.111 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.56 -39.5 94.55 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 114.919 -1.037 . . . . 0.0 111.165 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -60.6 -46.78 93.76 Favored Glycine 0 C--N 1.354 1.553 0 O-C-N 124.304 1.003 . . . . 0.0 112.055 -178.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.428 HD12 ' HA ' ' A' ' 92' ' ' ALA . 34.1 mt -53.53 -62.21 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 124.893 1.277 . . . . 0.0 110.219 177.478 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.7 mp -55.04 -53.8 30.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 O-C-N 124.178 0.924 . . . . 0.0 111.227 -174.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.16 -28.93 69.15 Favored 'General case' 0 N--CA 1.485 1.302 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -175.072 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 50.5 mm-40 -71.93 -36.76 70.02 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 122.572 0.349 . . . . 0.0 110.418 176.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.5 HG21 HG23 ' A' ' 60' ' ' ILE . 55.3 mt -71.82 -35.59 55.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 179.403 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -59.05 -49.46 77.8 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-N 114.337 -1.301 . . . . 0.0 111.13 177.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -79.5 -25.96 41.69 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -175.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 65.2 mtm -69.04 -53.68 19.17 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 122.575 0.35 . . . . 0.0 110.393 174.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 26.6 mt -61.44 -49.22 85.36 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.281 177.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.524 ' O ' ' HG2' ' A' ' 108' ' ' GLN . . . -56.02 -39.97 72.73 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 122.961 0.505 . . . . 0.0 111.55 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 30.6 t -62.28 -45.84 91.46 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 123.981 0.8 . . . . 0.0 110.652 -177.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -78.82 -19.8 51.22 Favored 'General case' 0 N--CA 1.483 1.193 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 179.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 20.3 mm-40 -85.25 -12.62 52.06 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 122.84 0.456 . . . . 0.0 111.841 178.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.524 ' HG2' ' O ' ' A' ' 104' ' ' ALA . 76.8 mm-40 . . . . . 0 CA--C 1.556 1.21 0 CA-C-O 119.214 -0.422 . . . . 0.0 110.129 175.057 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.2 mtp . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 120.711 0.291 . . . . 0.0 110.317 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.7 m -67.29 99.69 0.73 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.566 0.746 . . . . 0.0 110.769 178.052 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.456 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 3.2 pttt -80.44 179.4 7.73 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.97 0.908 . . . . 0.0 110.229 177.201 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.431 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 3.6 tmtp? -143.86 139.56 29.31 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 -172.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.472 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 8.6 tt -128.86 140.15 51.82 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 176.45 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 23.1 pt -128.87 158.4 41.44 Favored 'Isoleucine or valine' 0 C--O 1.24 0.594 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 170.381 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.636 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -147.19 169.53 19.14 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 177.386 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.443 HD21 ' OE1' ' A' ' 41' ' ' GLN . 5.4 tt -143.68 117.9 9.56 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 -179.144 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.511 ' HA ' ' O ' ' A' ' 64' ' ' SER . 61.5 m -108.39 108.41 19.36 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.88 0.872 . . . . 0.0 109.364 176.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -123.3 124.11 42.25 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 122.783 0.433 . . . . 0.0 110.697 -179.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.772 ' SG ' HD13 ' A' ' 85' ' ' LEU . 1.3 m -142.67 144.61 30.74 Favored Pre-proline 0 N--CA 1.483 1.209 0 C-N-CA 123.218 0.607 . . . . 0.0 111.766 -179.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -83.65 -14.57 7.74 Favored 'Trans proline' 0 C--N 1.373 1.868 0 C-N-CA 123.496 2.797 . . . . 0.0 112.447 174.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 23.1 ttt -60.38 -53.23 60.14 Favored 'General case' 0 C--N 1.357 0.908 0 C-N-CA 123.411 0.684 . . . . 0.0 109.671 174.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 157.48 175.26 28.21 Favored Glycine 0 C--O 1.246 0.87 0 CA-C-N 115.136 -0.938 . . . . 0.0 112.047 -179.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 29.9 mt -67.37 -20.61 65.59 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 122.925 0.49 . . . . 0.0 111.877 177.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.9 -45.53 82.54 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-O 121.008 0.433 . . . . 0.0 110.792 174.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.474 ' HD1' ' HG ' ' A' ' 11' ' ' CYS . 12.1 t-160 -68.48 -44.8 73.97 Favored 'General case' 0 C--O 1.242 0.666 0 CA-C-N 115.366 -0.833 . . . . 0.0 109.86 -179.174 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.491 ' HA ' HD11 ' A' ' 85' ' ' LEU . 47.5 p -64.7 -37.99 89.48 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.413 -176.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.479 ' HZ ' ' HG2' ' A' ' 47' ' ' GLN . 13.2 m-85 -74.25 -28.2 61.11 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.191 0.596 . . . . 0.0 112.0 -178.044 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 67.5 mtm -69.63 -36.7 76.36 Favored 'General case' 0 N--CA 1.483 1.222 0 CA-C-N 118.024 0.375 . . . . 0.0 110.483 173.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.02 -40.2 71.92 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.95 174.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.32 -42.75 83.11 Favored 'General case' 0 C--O 1.217 -0.613 0 C-N-CA 123.715 0.806 . . . . 0.0 110.334 -178.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.476 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 8.9 tp-100 -61.7 -47.23 86.23 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.463 0.705 . . . . 0.0 109.503 178.556 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.563 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -62.03 -52.8 62.51 Favored 'General case' 0 CA--C 1.552 1.038 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.698 -177.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 75.6 mt -64.54 -32.63 74.35 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.535 0.734 . . . . 0.0 111.635 -179.193 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.58 ' HA ' HG21 ' A' ' 36' ' ' VAL . 30.6 tt0 -65.89 -55.7 15.6 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 123.688 0.617 . . . . 0.0 110.141 -179.129 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.558 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 19.9 mm-40 -55.82 -44.36 77.8 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 124.456 1.097 . . . . 0.0 110.255 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -57.01 -50.44 72.72 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.162 0.985 . . . . 0.0 111.66 177.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.62 -22.88 65.32 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 123.671 0.788 . . . . 0.0 113.096 178.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 26' ' ' GLU . 55.1 t -75.97 -40.16 37.81 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.558 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 7.1 mm-40 -72.67 -18.53 61.55 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.513 177.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -80.93 -12.28 59.43 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.112 0.965 . . . . 0.0 111.302 173.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 82.77 23.43 55.88 Favored Glycine 0 C--N 1.349 1.298 0 N-CA-C 114.764 0.666 . . . . 0.0 114.764 167.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.456 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.1 OUTLIER -129.55 176.96 7.57 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.283 0.633 . . . . 0.0 111.089 173.138 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.431 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 11.7 tp10 -72.86 153.39 41.06 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.131 178.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.58 HG21 ' HA ' ' A' ' 26' ' ' GLU . 6.4 p -141.5 128.96 21.36 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 C-N-CA 123.426 0.69 . . . . 0.0 110.637 179.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 47.7 tptt -135.78 111.13 9.08 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.521 0.728 . . . . 0.0 109.568 179.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.636 HG12 ' HB3' ' A' ' 7' ' ' ALA . 48.4 mt -116.15 113.45 43.23 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.235 0 N-CA-C 112.767 0.654 . . . . 0.0 112.767 -172.604 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -79.22 117.65 20.43 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 123.933 0.893 . . . . 0.0 110.047 176.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.437 ' OG1' ' HB3' ' A' ' 47' ' ' GLN . 3.3 p -103.51 103.93 13.95 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.237 0.615 . . . . 0.0 110.623 -179.612 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.443 ' OE1' HD21 ' A' ' 8' ' ' LEU . 31.3 mt-30 -98.62 132.17 44.23 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 -179.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -148.29 179.85 24.82 Favored Glycine 0 C--O 1.241 0.588 0 N-CA-C 111.483 -0.647 . . . . 0.0 111.483 177.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.78 -23.75 67.49 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.46 0.704 . . . . 0.0 111.348 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -67.76 -44.47 77.44 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.819 1.247 . . . . 0.0 110.173 174.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 150.61 -175.79 29.47 Favored Glycine 0 C--N 1.336 0.54 0 CA-C-N 114.822 -1.081 . . . . 0.0 111.482 -175.292 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.467 HG21 ' NH1' ' A' ' 49' ' ' ARG . 67.6 mt -98.86 111.66 29.03 Favored 'Isoleucine or valine' 0 C--O 1.24 0.587 0 C-N-CA 123.685 0.794 . . . . 0.0 109.78 -179.412 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.479 ' HG2' ' HZ ' ' A' ' 19' ' ' PHE . 8.5 tp-100 -96.33 148.48 22.71 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.104 0.962 . . . . 0.0 110.084 177.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 25.8 t30 79.82 -54.21 0.39 Allowed 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 126.264 1.826 . . . . 0.0 111.571 173.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.467 ' NH1' HG21 ' A' ' 46' ' ' ILE . 17.7 tpp180 65.32 144.63 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.238 0 C-N-CA 125.347 1.459 . . . . 0.0 112.918 176.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 37.8 mt -112.29 129.9 56.12 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.391 1.077 . . . . 0.0 109.86 173.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 39.7 p -95.92 165.34 12.32 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.931 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.53 -30.46 63.08 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.479 0.712 . . . . 0.0 111.317 177.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -67.79 -47.34 69.4 Favored 'General case' 0 C--N 1.353 0.731 0 C-N-CA 123.699 0.8 . . . . 0.0 110.959 176.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -56.33 -44.42 79.98 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.386 0.674 . . . . 0.0 110.902 178.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.503 HG22 ' HG3' ' A' ' 78' ' ' ARG . 33.1 mt -72.39 -36.85 56.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 O-C-N 124.483 1.115 . . . . 0.0 111.277 -175.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.42 -44.01 68.79 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.385 0.674 . . . . 0.0 111.124 -178.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -86.31 -8.1 57.97 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.305 0.642 . . . . 0.0 111.998 -177.006 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.69 108.45 1.72 Allowed 'General case' 0 N--CA 1.473 0.71 0 O-C-N 123.709 0.63 . . . . 0.0 111.053 178.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 17.3 m -62.1 -37.22 84.28 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.429 167.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.584 HG23 HG21 ' A' ' 99' ' ' ILE . 76.5 mt -132.25 141.89 44.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 C-N-CA 124.363 1.065 . . . . 0.0 110.346 -176.543 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 27.2 mt -131.85 132.2 61.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 C-N-CA 123.916 0.887 . . . . 0.0 108.812 172.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.4 mp -119.23 133.25 66.67 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 172.126 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . 0.523 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 11.7 m170 -109.58 84.96 2.01 Favored 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 167.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.511 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 28.0 p -81.31 85.39 6.41 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 114.514 -1.221 . . . . 0.0 108.995 174.095 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 35.9 m -126.85 160.59 35.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-O 121.783 0.802 . . . . 0.0 111.982 -171.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -118.2 -19.01 9.18 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 114.007 -1.452 . . . . 0.0 109.116 176.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 5.8 m -132.19 160.49 42.45 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 C-N-CA 125.533 1.533 . . . . 0.0 108.037 176.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 63.8 m -59.47 116.78 17.77 Favored Pre-proline 0 C--O 1.244 0.766 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 174.243 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.524 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 37.9 Cg_endo -63.27 140.15 75.7 Favored 'Trans proline' 0 C--N 1.372 1.792 0 C-N-CA 121.949 1.766 . . . . 0.0 110.702 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -59.34 -38.11 79.51 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 123.92 0.762 . . . . 0.0 110.551 -174.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.435 ' HB3' ' HG3' ' A' ' 74' ' ' ARG . 4.4 m-20 -104.12 30.45 5.21 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 114.51 -1.223 . . . . 0.0 111.385 -174.13 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.524 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 7.2 p30 -59.89 -27.82 67.03 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.413 0.685 . . . . 0.0 110.858 177.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -60.04 -32.83 71.27 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.258 1.423 . . . . 0.0 112.262 176.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.435 ' HG3' ' HB3' ' A' ' 71' ' ' ASP . 12.1 mmp_? -66.26 -30.82 71.33 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 124.202 1.001 . . . . 0.0 111.715 -176.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -108.29 -2.06 19.56 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.962 -169.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -62.3 -35.27 78.52 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.265 0.626 . . . . 0.0 112.204 -172.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 69.8 p -75.74 -15.43 60.28 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.412 0.685 . . . . 0.0 112.014 -179.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.503 ' HG3' HG22 ' A' ' 55' ' ' ILE . 38.0 mmt180 -109.32 163.22 13.59 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.751 0.82 . . . . 0.0 111.153 -173.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 33.2 m-20 -76.42 109.25 9.98 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.463 0.705 . . . . 0.0 110.357 177.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 44.3 t -113.69 137.58 46.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 123.437 0.695 . . . . 0.0 109.918 179.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 79.7 m-85 -101.75 89.82 3.81 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 176.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.523 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 42.5 mt-10 -83.19 125.54 31.66 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.725 -174.631 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.509 HG13 ' HA ' ' A' ' 64' ' ' SER . 42.1 pt -136.09 -174.35 1.08 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 C-N-CA 124.928 1.291 . . . . 0.0 108.84 -179.558 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 22.0 p -87.45 152.3 22.34 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 120.911 0.386 . . . . 0.0 110.02 169.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.772 HD13 ' SG ' ' A' ' 11' ' ' CYS . 8.0 tt -66.26 -27.34 67.87 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.905 178.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.594 ' HG2' ' HE3' ' A' ' 90' ' ' LYS . 35.6 tt0 -63.76 -43.45 96.39 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.461 0.705 . . . . 0.0 110.719 173.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -61.61 -31.64 71.72 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.577 0.751 . . . . 0.0 110.818 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.02 -33.17 75.4 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.664 0.785 . . . . 0.0 112.433 177.159 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 86.0 mt -79.03 -46.79 23.44 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.846 0 C-N-CA 123.634 0.773 . . . . 0.0 110.524 -177.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.594 ' HE3' ' HG2' ' A' ' 86' ' ' GLN . 18.6 ptpt -81.9 -43.04 18.69 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.114 0.566 . . . . 0.0 111.994 -174.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 62.9 t30 -113.77 28.49 8.72 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.762 0.825 . . . . 0.0 110.907 -169.022 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.563 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -45.02 -62.1 1.37 Allowed 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -175.562 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.56 -36.51 82.9 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.056 -0.974 . . . . 0.0 110.913 -179.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -61.1 -48.54 85.45 Favored Glycine 0 C--N 1.354 1.569 0 O-C-N 124.616 1.198 . . . . 0.0 112.752 -178.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 22.5 mt -55.74 -56.77 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.169 0.988 . . . . 0.0 110.245 178.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.425 HG23 ' OH ' ' A' ' 34' ' ' TYR . 1.7 mp -55.75 -50.91 64.85 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.048 0 O-C-N 124.247 0.967 . . . . 0.0 111.71 -177.342 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -32.19 73.14 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 112.041 0.386 . . . . 0.0 112.041 -176.577 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -64.81 -39.02 92.9 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 123.7 0.625 . . . . 0.0 109.734 178.234 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.584 HG21 HG23 ' A' ' 60' ' ' ILE . 53.2 mt -73.14 -39.07 56.32 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.983 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -56.7 -48.99 76.47 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.973 0.909 . . . . 0.0 111.243 178.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -74.66 -32.35 62.21 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 123.631 0.582 . . . . 0.0 111.483 -175.282 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 69.3 mtm -66.02 -47.75 73.39 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 122.582 0.353 . . . . 0.0 110.688 175.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 30.5 mt -68.02 -39.18 81.09 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.795 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.411 179.103 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.15 -28.65 69.56 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.045 0.538 . . . . 0.0 111.083 177.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 18.2 t -74.15 -43.27 58.05 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 123.155 0.582 . . . . 0.0 110.949 -178.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -76.63 -34.88 58.32 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 122.93 0.492 . . . . 0.0 111.513 -179.144 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -75.85 -24.1 55.76 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 122.966 0.507 . . . . 0.0 111.574 -178.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 32.3 mm-40 . . . . . 0 N--CA 1.478 0.964 0 CA-C-O 118.458 -0.782 . . . . 0.0 109.789 177.608 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.1 mtt . . . . . 0 N--CA 1.482 1.133 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.1 t -70.63 86.42 0.65 Allowed 'General case' 0 CA--C 1.544 0.715 0 CA-C-O 121.322 0.582 . . . . 0.0 109.922 178.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 43.9 pttt -72.92 162.09 29.91 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.607 175.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.596 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.1 tmtp? -141.25 137.37 32.49 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 -170.187 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.477 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 10.2 tt -130.01 130.32 44.84 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 178.381 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.5 HD12 HD13 ' A' ' 50' ' ' LEU . 14.2 pt -121.34 165.61 16.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 172.589 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.599 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -152.09 169.15 23.11 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.641 176.51 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.9 tt -141.45 115.46 9.25 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.528 ' HA ' ' O ' ' A' ' 64' ' ' SER . 62.1 m -107.24 111.61 24.09 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 177.68 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.449 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -125.69 112.66 16.37 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 122.474 0.31 . . . . 0.0 111.106 -175.181 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.521 ' HB2' HD13 ' A' ' 85' ' ' LEU . 36.0 t -127.43 136.2 28.58 Favored Pre-proline 0 N--CA 1.473 0.693 0 C-N-CA 123.791 0.836 . . . . 0.0 110.442 -179.261 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -76.07 -19.48 15.65 Favored 'Trans proline' 0 C--N 1.365 1.447 0 C-N-CA 122.972 2.448 . . . . 0.0 112.791 177.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.447 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 21.7 mmt -71.89 -31.94 66.93 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.513 0.725 . . . . 0.0 110.663 -178.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 149.24 175.67 21.82 Favored Glycine 0 C--N 1.348 1.216 0 CA-C-N 115.789 -0.642 . . . . 0.0 112.675 177.198 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.6 mt -73.67 -19.57 60.79 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.582 0.753 . . . . 0.0 112.509 -179.395 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.04 -44.09 87.2 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-O 121.189 0.518 . . . . 0.0 111.325 177.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 11.9 t-160 -66.69 -41.51 87.93 Favored 'General case' 0 C--O 1.247 0.923 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.275 179.075 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 34.2 p -66.77 -32.78 74.29 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.99 -178.595 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.6 m-30 -69.49 -31.63 70.01 Favored 'General case' 0 C--N 1.354 0.772 0 C-N-CA 123.246 0.618 . . . . 0.0 111.25 178.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 64.5 mtm -67.01 -41.15 87.14 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-O 120.639 0.257 . . . . 0.0 110.901 175.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.14 -44.55 83.88 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.065 174.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.13 -41.28 97.27 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.954 0.901 . . . . 0.0 110.895 -177.415 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -57.17 -54.75 43.21 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.981 0.912 . . . . 0.0 109.949 177.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.06 -42.87 93.79 Favored 'General case' 0 CA--C 1.553 1.06 0 CA-C-N 114.953 -1.021 . . . . 0.0 111.99 -174.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.424 HD11 ' OG ' ' A' ' 64' ' ' SER . 89.2 mt -68.11 -35.77 78.68 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 123.13 0.572 . . . . 0.0 111.265 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.558 ' HA ' HG21 ' A' ' 36' ' ' VAL . 35.6 tt0 -62.19 -53.0 61.56 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 123.837 0.71 . . . . 0.0 109.725 -178.455 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.447 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 45.3 mt-10 -54.59 -46.77 73.82 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 114.547 -1.206 . . . . 0.0 110.402 179.442 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.58 -52.12 67.03 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.323 1.049 . . . . 0.0 111.729 -178.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.94 -24.31 67.48 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 178.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 26' ' ' GLU . 50.5 t -77.09 -42.35 31.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.414 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 19.6 mm-40 -66.67 -28.39 68.42 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 114.604 -1.18 . . . . 0.0 110.344 175.24 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -80.18 -25.08 39.89 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.211 1.005 . . . . 0.0 111.923 176.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.96 32.74 7.74 Favored Glycine 0 C--N 1.344 0.999 0 N-CA-C 114.264 0.466 . . . . 0.0 114.264 170.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -102.4 163.48 12.21 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 117.36 0.58 . . . . 0.0 109.592 168.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.596 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 41.0 tt0 -73.66 124.97 26.99 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 106.502 -1.666 . . . . 0.0 106.502 158.509 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.558 HG21 ' HA ' ' A' ' 26' ' ' GLU . 13.5 p -111.27 137.32 44.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 CA-C-N 118.635 0.652 . . . . 0.0 110.72 -174.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 45.0 tptt -148.21 111.77 5.02 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 178.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.599 HG12 ' HB3' ' A' ' 7' ' ' ALA . 48.9 mt -116.94 110.63 31.98 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 122.602 0.361 . . . . 0.0 111.891 -173.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -77.92 115.25 17.52 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 123.238 0.615 . . . . 0.0 109.658 176.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 7.0 p -95.76 108.09 20.38 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.938 177.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.54 ' HG2' HG12 ' A' ' 46' ' ' ILE . 42.2 mt-30 -100.97 154.02 19.04 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.256 0.623 . . . . 0.0 110.679 176.2 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -171.08 -178.39 41.56 Favored Glycine 0 C--O 1.238 0.379 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.617 178.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.34 -26.05 66.3 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.089 0.556 . . . . 0.0 111.327 178.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -65.8 -39.41 90.91 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.495 0.718 . . . . 0.0 110.117 171.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 142.18 -151.99 23.32 Favored Glycine 0 C--N 1.341 0.852 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.969 -178.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.54 HG12 ' HG2' ' A' ' 41' ' ' GLN . 65.2 mt -113.21 145.25 19.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 C-N-CA 123.683 0.793 . . . . 0.0 110.067 -174.112 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -140.01 149.28 43.02 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.865 0.866 . . . . 0.0 110.137 -179.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 44.1 t30 79.1 -49.94 0.43 Allowed 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 126.487 1.915 . . . . 0.0 110.043 178.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 21.7 tpp180 66.86 122.82 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.869 1.667 . . . . 0.0 113.339 169.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.5 HD13 HD12 ' A' ' 6' ' ' ILE . 39.4 mt -92.31 146.41 23.72 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 114.772 -1.104 . . . . 0.0 110.55 172.481 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.42 ' O ' HG13 ' A' ' 55' ' ' ILE . 66.4 p -105.12 166.63 10.26 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.744 0.818 . . . . 0.0 109.693 176.478 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.06 -29.49 69.77 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 122.931 0.492 . . . . 0.0 110.562 176.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -72.27 -41.14 67.06 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.43 177.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -59.5 -43.49 93.34 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 122.836 0.454 . . . . 0.0 110.927 177.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.663 HG22 ' HG3' ' A' ' 78' ' ' ARG . 23.1 mt -74.38 -32.32 30.62 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 O-C-N 123.961 0.788 . . . . 0.0 110.891 -176.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.57 -41.5 62.83 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.434 0.694 . . . . 0.0 111.619 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -91.27 -3.04 57.26 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.554 0.742 . . . . 0.0 111.398 -177.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.55 106.22 1.11 Allowed 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 122.948 0.499 . . . . 0.0 110.437 176.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 27.7 m -60.26 -36.92 78.9 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.846 0.858 . . . . 0.0 109.44 169.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 72.8 mt -137.27 143.35 34.68 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 123.904 0.882 . . . . 0.0 110.315 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.498 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 26.3 mt -127.81 135.64 62.48 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 171.46 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -124.12 111.16 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 CA-C-N 118.405 0.548 . . . . 0.0 109.526 173.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 12.1 m170 -88.24 85.28 6.89 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-O 121.586 0.708 . . . . 0.0 109.524 174.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.528 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 25.0 m -81.01 82.64 6.92 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.542 176.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 29.5 m -125.93 155.78 35.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 CA-C-O 121.965 0.888 . . . . 0.0 112.209 -170.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -107.87 -25.07 11.39 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 113.91 -1.496 . . . . 0.0 109.365 175.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 15.0 m -131.4 171.15 18.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 125.328 1.451 . . . . 0.0 108.664 176.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 22.1 m -64.72 116.87 32.85 Favored Pre-proline 0 CA--C 1.55 0.974 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 171.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.43 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 37.0 Cg_endo -66.71 145.56 75.91 Favored 'Trans proline' 0 C--N 1.372 1.773 0 C-N-CA 121.506 1.471 . . . . 0.0 110.388 174.393 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.451 ' HB2' HE22 ' A' ' 41' ' ' GLN . 42.2 mm-40 -64.52 -28.98 70.02 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.241 0.616 . . . . 0.0 111.406 -176.138 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.601 ' HB3' HH11 ' A' ' 74' ' ' ARG . 0.9 OUTLIER -103.17 18.24 22.19 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.468 1.107 . . . . 0.0 111.616 -173.901 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.43 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 6.7 p30 -56.65 -32.4 65.32 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 124.385 1.074 . . . . 0.0 113.018 -175.274 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.46 ' HA ' ' HB2' ' A' ' 76' ' ' GLU . 2.1 pp20? -76.38 -18.16 59.01 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.704 0.802 . . . . 0.0 112.515 -171.17 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.601 HH11 ' HB3' ' A' ' 71' ' ' ASP . 41.0 mtp180 -67.4 -26.68 66.55 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.018 0.927 . . . . 0.0 111.312 174.063 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -104.01 -4.36 23.43 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 114.463 -1.244 . . . . 0.0 111.017 -176.042 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.46 ' HB2' ' HA ' ' A' ' 73' ' ' GLU . 37.9 tt0 -61.96 -32.2 72.61 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 124.579 1.152 . . . . 0.0 112.474 -173.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 32.0 t -92.13 3.91 54.29 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.392 0.677 . . . . 0.0 111.836 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.663 ' HG3' HG22 ' A' ' 55' ' ' ILE . 39.8 mmt180 -117.61 166.3 12.56 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.718 0.807 . . . . 0.0 111.446 -177.036 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -79.35 94.24 5.46 Favored 'General case' 0 C--O 1.244 0.789 0 C-N-CA 123.675 0.79 . . . . 0.0 110.673 -177.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.498 ' HA ' ' HB ' ' A' ' 61' ' ' ILE . 60.8 t -104.97 141.35 20.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 124.151 0.98 . . . . 0.0 110.727 -178.369 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -114.52 88.71 2.92 Favored 'General case' 0 C--O 1.24 0.553 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 174.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -84.59 120.97 26.97 Favored 'General case' 0 C--N 1.346 0.442 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.363 -174.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.434 HD12 ' HB3' ' A' ' 87' ' ' ASP . 48.5 pt -125.24 -179.33 2.35 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 124.434 1.094 . . . . 0.0 109.466 177.491 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 24.1 p -76.83 148.22 36.68 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.533 168.464 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.521 HD13 ' HB2' ' A' ' 11' ' ' CYS . 4.7 tt -62.51 -28.64 69.98 Favored 'General case' 0 N--CA 1.481 1.098 0 O-C-N 124.046 0.841 . . . . 0.0 111.27 179.47 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -64.3 -44.92 90.14 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.285 0.634 . . . . 0.0 111.266 176.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.434 ' HB3' HD12 ' A' ' 83' ' ' ILE . 24.3 t70 -59.98 -31.47 69.94 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.542 0.737 . . . . 0.0 110.649 -177.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.19 -26.61 64.92 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.943 0.897 . . . . 0.0 112.922 179.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 57.0 mt -85.24 -40.1 14.55 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.964 0 C-N-CA 123.111 0.564 . . . . 0.0 110.459 -179.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.44 -56.1 3.45 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 122.793 0.437 . . . . 0.0 111.795 -176.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -95.46 20.53 9.35 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.843 0.857 . . . . 0.0 110.959 -170.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.508 ' HA ' HD12 ' A' ' 95' ' ' ILE . . . -43.22 -62.34 1.08 Allowed 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 124.607 1.163 . . . . 0.0 114.132 -172.575 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.21 -34.59 75.35 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.028 178.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.07 -43.04 99.38 Favored Glycine 0 C--N 1.351 1.407 0 O-C-N 124.495 1.122 . . . . 0.0 112.758 178.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.508 HD12 ' HA ' ' A' ' 92' ' ' ALA . 22.2 mt -62.37 -57.96 9.71 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 C-N-CA 124.185 0.994 . . . . 0.0 109.973 -177.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.43 HG13 HD11 ' A' ' 5' ' ' LEU . 2.0 mp -58.4 -45.71 89.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 O-C-N 124.093 0.87 . . . . 0.0 110.608 -175.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 2.5 pptp? -69.72 -27.62 65.13 Favored 'General case' 0 N--CA 1.48 1.047 0 O-C-N 123.605 0.565 . . . . 0.0 111.556 -177.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 38.9 mm-40 -62.91 -42.55 99.83 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 174.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 13.1 mt -78.43 -33.36 17.22 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.387 -175.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -54.79 -53.69 51.87 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.604 1.162 . . . . 0.0 111.281 171.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -72.16 -33.77 67.97 Favored 'General case' 0 N--CA 1.48 1.064 0 O-C-N 123.594 0.559 . . . . 0.0 111.25 -175.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 71.1 mtm -64.29 -49.3 72.34 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 122.937 0.495 . . . . 0.0 110.592 177.134 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 36.8 mt -67.05 -42.16 88.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 C-N-CA 123.232 0.613 . . . . 0.0 110.302 177.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.88 -12.56 61.61 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 122.925 0.49 . . . . 0.0 111.843 -179.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 29.9 t -92.4 -39.71 11.28 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 122.609 0.364 . . . . 0.0 110.804 176.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -78.71 -28.18 45.07 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.757 0.423 . . . . 0.0 111.458 -177.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.7 mm-40 -84.35 -41.33 16.87 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.175 0.59 . . . . 0.0 109.876 178.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 76.3 mm-40 . . . . . 0 C--O 1.255 1.35 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.632 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.9 mtt . . . . . 0 N--CA 1.48 1.049 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.7 t -72.13 90.96 1.23 Allowed 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 176.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.63 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 13.4 pttt -65.96 174.25 2.57 Favored 'General case' 0 C--O 1.247 0.962 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.179 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.514 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.2 tmtp? -142.96 142.48 31.66 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 121.102 0.477 . . . . 0.0 109.81 -171.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.474 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.0 tt -131.34 136.17 47.86 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 176.084 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.411 HG22 ' HE2' ' A' ' 4' ' ' LYS . 17.1 pt -126.72 159.1 36.76 Favored 'Isoleucine or valine' 0 C--O 1.239 0.509 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 170.306 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.619 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -145.28 168.91 19.32 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 176.534 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.427 HD21 ' OE1' ' A' ' 41' ' ' GLN . 4.3 tt -144.88 112.09 6.02 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 -176.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.522 ' HA ' ' O ' ' A' ' 64' ' ' SER . 49.9 m -101.25 109.65 21.54 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.068 0.947 . . . . 0.0 109.12 176.385 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.42 ' HB3' HG12 ' A' ' 65' ' ' VAL . . . -127.47 115.81 19.46 Favored 'General case' 0 N--CA 1.489 1.513 0 CA-C-O 120.839 0.352 . . . . 0.0 110.674 -178.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.559 ' HB2' HD13 ' A' ' 85' ' ' LEU . 44.0 t -123.43 142.93 40.06 Favored Pre-proline 0 N--CA 1.476 0.855 0 C-N-CA 123.926 0.89 . . . . 0.0 110.247 -176.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -72.58 -16.64 26.97 Favored 'Trans proline' 0 C--N 1.37 1.687 0 C-N-CA 122.938 2.425 . . . . 0.0 113.093 174.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 82.8 mtp -72.67 -54.91 7.72 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.393 0.677 . . . . 0.0 111.078 -179.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.413 ' HA2' ' H ' ' A' ' 43' ' ' ALA . . . 161.3 -177.76 37.5 Favored Glycine 0 C--N 1.342 0.875 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.845 -175.713 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 39.9 mt -75.19 -14.44 60.54 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -177.399 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.41 -49.73 76.42 Favored 'General case' 0 C--O 1.249 1.066 0 CA-C-O 121.337 0.589 . . . . 0.0 111.086 177.168 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.402 ' ND1' HD22 ' A' ' 85' ' ' LEU . 5.8 t-160 -64.98 -40.24 94.67 Favored 'General case' 0 C--O 1.248 1.004 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.224 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 32.7 p -67.3 -36.43 81.49 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.307 -178.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.8 m-30 -69.26 -32.84 72.31 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.127 0.571 . . . . 0.0 111.453 -178.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 62.5 mtm -67.93 -38.2 82.58 Favored 'General case' 0 N--CA 1.483 1.175 0 O-C-N 123.175 0.297 . . . . 0.0 110.81 175.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -69.7 -40.53 76.26 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.364 174.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.7 -37.1 81.81 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.899 0.88 . . . . 0.0 110.562 -178.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.477 ' O ' ' HG3' ' A' ' 27' ' ' GLU . 32.6 tt0 -62.52 -53.01 61.14 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.846 175.661 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.45 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -64.75 -47.5 77.98 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 115.587 -0.733 . . . . 0.0 112.183 -173.074 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 85.1 mt -64.43 -34.46 78.25 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.07 0.548 . . . . 0.0 111.431 178.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.505 ' O ' HG23 ' A' ' 30' ' ' VAL . 38.3 tt0 -61.92 -54.76 37.5 Favored 'General case' 0 C--N 1.349 0.578 0 O-C-N 123.686 0.616 . . . . 0.0 109.894 177.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.567 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 44.9 mt-10 -49.42 -52.12 30.78 Favored 'General case' 0 N--CA 1.48 1.048 0 O-C-N 124.632 1.207 . . . . 0.0 110.73 179.54 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.417 ' HB1' ' HA ' ' A' ' 93' ' ' ALA . . . -56.18 -52.05 65.81 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.807 1.243 . . . . 0.0 112.098 -179.664 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.38 -22.52 66.25 Favored 'General case' 0 CA--C 1.55 0.947 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 179.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 26' ' ' GLU . 55.8 t -76.25 -37.5 32.08 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.256 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 178.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.567 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 16.2 mm-40 -76.48 -19.89 57.55 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 114.725 -1.125 . . . . 0.0 110.475 178.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -78.44 -19.0 54.11 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.672 0.789 . . . . 0.0 111.198 172.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 97.01 1.24 59.75 Favored Glycine 0 C--N 1.349 1.263 0 N-CA-C 115.2 0.84 . . . . 0.0 115.2 165.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.63 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -108.24 173.58 6.26 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-N 117.85 0.825 . . . . 0.0 112.089 176.255 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.514 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 34.2 tt0 -71.07 145.91 49.6 Favored 'General case' 0 C--N 1.35 0.612 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.656 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.493 HG21 ' HA ' ' A' ' 26' ' ' GLU . 7.4 p -135.34 128.64 48.72 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 122.741 0.416 . . . . 0.0 111.165 -179.566 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.5 tptt -135.75 115.55 13.02 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 176.44 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.619 HG12 ' HB3' ' A' ' 7' ' ' ALA . 49.3 mt -117.09 113.42 42.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 N-CA-C 111.995 0.369 . . . . 0.0 111.995 -176.16 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -75.62 147.81 39.25 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.894 0.878 . . . . 0.0 109.221 171.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.443 HG22 ' HB2' ' A' ' 9' ' ' CYS . 13.6 p -134.57 123.93 24.65 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.156 0.983 . . . . 0.0 109.208 -176.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.469 ' HG2' HG23 ' A' ' 46' ' ' ILE . 23.7 mt-30 -125.62 136.5 53.33 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 -176.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -163.59 -160.42 11.58 Favored Glycine 0 N--CA 1.465 0.605 0 C-N-CA 121.851 -0.214 . . . . 0.0 112.677 -179.1 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.413 ' H ' ' HA2' ' A' ' 14' ' ' GLY . . . -60.91 -28.77 69.16 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.957 0.903 . . . . 0.0 111.787 177.235 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -86.27 2.35 47.54 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.021 0.928 . . . . 0.0 111.51 -178.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 94.22 -157.48 22.65 Favored Glycine 0 C--N 1.34 0.773 0 N-CA-C 112.134 -0.386 . . . . 0.0 112.134 -176.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.469 HG23 ' HG2' ' A' ' 41' ' ' GLN . 40.8 mt -106.44 144.86 14.94 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 C-N-CA 123.601 0.76 . . . . 0.0 110.306 -172.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -143.02 148.12 36.23 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.005 1.322 . . . . 0.0 108.822 -174.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 10.1 t30 58.86 40.96 22.14 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 124.362 1.065 . . . . 0.0 110.517 175.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 9.5 tpp180 -47.35 133.28 12.62 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.763 1.625 . . . . 0.0 113.069 -172.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 47.5 mt -83.35 126.75 33.03 Favored 'General case' 0 C--O 1.242 0.693 0 C-N-CA 123.879 0.872 . . . . 0.0 110.383 173.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.408 ' O ' HG13 ' A' ' 55' ' ' ILE . 37.0 p -88.79 164.5 15.21 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.664 178.323 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.74 -30.37 67.45 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.148 0.579 . . . . 0.0 110.963 175.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.405 ' O ' ' HG3' ' A' ' 57' ' ' GLU . 29.2 tt0 -66.91 -48.48 68.57 Favored 'General case' 0 C--N 1.355 0.819 0 C-N-CA 122.972 0.509 . . . . 0.0 110.57 175.36 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -50.84 -44.96 59.47 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 123.504 0.721 . . . . 0.0 111.355 177.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.408 HG13 ' O ' ' A' ' 51' ' ' THR . 26.4 mt -72.5 -35.68 51.99 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.051 0 CA-C-N 114.449 -1.25 . . . . 0.0 111.107 -177.152 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.45 -37.17 77.22 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.49 0.716 . . . . 0.0 111.172 179.41 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.405 ' HG3' ' O ' ' A' ' 53' ' ' GLN . 57.6 mt-10 -75.13 -33.46 61.57 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.746 0.818 . . . . 0.0 110.773 177.723 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -54.93 99.81 0.03 OUTLIER 'General case' 0 C--N 1.355 0.81 0 O-C-N 124.699 1.249 . . . . 0.0 112.315 -172.315 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 23.8 m -63.19 -32.9 74.4 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-N 114.531 -1.213 . . . . 0.0 109.241 168.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.481 HG23 HG21 ' A' ' 99' ' ' ILE . 81.5 mt -133.71 139.04 49.6 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 C-N-CA 124.367 1.067 . . . . 0.0 109.827 -179.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.6 mt -131.39 130.55 62.94 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 173.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.3 mp -116.25 126.09 73.58 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 172.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 14.8 m170 -99.98 86.09 3.19 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 167.271 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.522 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 20.0 p -80.41 81.87 6.57 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 114.633 -1.167 . . . . 0.0 108.94 174.363 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.42 HG12 ' HB3' ' A' ' 10' ' ' ALA . 29.8 m -129.87 165.05 30.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.225 -170.377 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -121.98 -14.83 7.95 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.445 1.098 . . . . 0.0 109.318 170.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 9.4 m -127.97 177.05 6.45 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 125.013 1.325 . . . . 0.0 109.516 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 37.2 m -75.9 118.47 71.34 Favored Pre-proline 0 CA--C 1.545 0.75 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 173.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.54 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 48.4 Cg_endo -65.97 146.81 83.63 Favored 'Trans proline' 0 C--N 1.373 1.82 0 C-N-CA 122.141 1.894 . . . . 0.0 111.18 175.239 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -65.33 -41.06 94.36 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.341 0.657 . . . . 0.0 110.624 -177.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -88.39 15.2 8.14 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 115.349 -0.841 . . . . 0.0 112.146 -175.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.54 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 6.0 p30 -55.69 -28.62 56.56 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 123.859 0.864 . . . . 0.0 112.041 -177.144 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.563 ' HG3' ' HG3' ' A' ' 74' ' ' ARG . 8.9 pt-20 -56.53 -37.22 70.18 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 124.694 1.198 . . . . 0.0 112.343 175.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.563 ' HG3' ' HG3' ' A' ' 73' ' ' GLU . 81.4 mtt85 -80.11 -17.05 53.61 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.815 1.246 . . . . 0.0 112.079 -176.713 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.517 ' HB3' HG21 ' A' ' 80' ' ' VAL . 66.6 m-85 -107.4 -2.68 20.31 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.574 0.749 . . . . 0.0 110.999 178.041 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -55.06 -49.04 72.62 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.494 1.118 . . . . 0.0 112.663 -172.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 81.0 p -91.6 0.51 57.49 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.127 0.571 . . . . 0.0 112.379 -176.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -104.62 161.52 14.06 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.276 0.63 . . . . 0.0 111.202 -170.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 -72.67 93.57 1.65 Allowed 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.355 0.662 . . . . 0.0 110.929 -175.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.517 HG21 ' HB3' ' A' ' 75' ' ' PHE . 44.2 t -116.85 133.01 64.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 123.206 0.602 . . . . 0.0 110.86 -175.077 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 66.1 m-85 -105.84 91.3 3.69 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.776 1.23 . . . . 0.0 108.553 177.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -78.88 110.12 13.78 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.611 0.764 . . . . 0.0 110.87 -175.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.445 HG13 ' HA ' ' A' ' 64' ' ' SER . 42.1 pt -117.31 -173.78 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 124.471 1.109 . . . . 0.0 109.561 176.043 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 40.4 p -86.8 149.73 24.64 Favored 'General case' 0 C--O 1.239 0.539 0 CA-C-O 121.071 0.462 . . . . 0.0 110.376 170.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.559 HD13 ' HB2' ' A' ' 11' ' ' CYS . 7.2 tt -64.52 -30.61 71.64 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.779 177.149 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -64.47 -43.79 93.1 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.879 176.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -63.74 -28.84 70.16 Favored 'General case' 0 N--CA 1.479 1.015 0 O-C-N 123.516 0.51 . . . . 0.0 110.629 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.1 -32.89 74.82 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.739 0.816 . . . . 0.0 112.292 177.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 64.6 mt -79.96 -42.69 22.28 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.835 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.414 -177.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -85.85 -47.34 9.77 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -175.086 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -106.15 25.45 10.98 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 124.081 0.952 . . . . 0.0 110.736 -170.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.45 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -41.92 -60.79 1.29 Allowed 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 124.253 1.021 . . . . 0.0 113.372 -175.144 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.417 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . . . -65.0 -34.1 77.64 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.602 -178.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.69 -45.8 93.6 Favored Glycine 0 C--N 1.346 1.103 0 O-C-N 124.183 0.927 . . . . 0.0 112.253 -178.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 22.6 mt -60.1 -57.09 13.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 124.445 1.098 . . . . 0.0 110.266 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.9 mp -56.42 -50.05 74.24 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 O-C-N 123.945 0.778 . . . . 0.0 110.846 -178.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.87 -27.98 67.14 Favored 'General case' 0 N--CA 1.485 1.298 0 O-C-N 123.389 0.431 . . . . 0.0 111.304 -176.245 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.419 ' O ' ' HG3' ' A' ' 102' ' ' MET . 48.4 mm-40 -65.65 -40.78 92.82 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.316 0.646 . . . . 0.0 109.896 175.365 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.481 HG21 HG23 ' A' ' 60' ' ' ILE . 32.7 mt -75.83 -34.05 27.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 N-CA-C 109.152 -0.685 . . . . 0.0 109.152 -176.815 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -60.54 -50.34 73.92 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 114.419 -1.264 . . . . 0.0 111.147 174.249 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -72.19 -33.3 67.55 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 122.751 0.42 . . . . 0.0 110.969 -176.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.419 ' HG3' ' O ' ' A' ' 98' ' ' GLU . 69.3 mtm -63.63 -58.2 7.69 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 122.751 0.42 . . . . 0.0 110.148 177.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 63.4 mt -62.38 -41.29 91.17 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.929 0 O-C-N 123.893 0.746 . . . . 0.0 110.587 -179.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.22 -32.52 74.24 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 122.541 0.337 . . . . 0.0 111.562 179.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 38.5 t -73.52 -37.43 65.65 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-O 120.887 0.375 . . . . 0.0 110.717 -176.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -85.16 -25.77 27.23 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.808 -177.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -85.6 -40.17 16.53 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 122.811 0.444 . . . . 0.0 111.516 178.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 81.8 mm-40 . . . . . 0 CA--C 1.55 0.978 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 174.943 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.3 ttm . . . . . 0 N--CA 1.479 1.002 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.5 t -80.08 171.04 15.62 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.99 0.916 . . . . 0.0 110.245 174.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.6 pttt -101.08 -178.85 3.87 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.022 0.929 . . . . 0.0 110.782 -174.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.534 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 3.8 tmtp? -144.03 143.67 31.29 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -173.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.483 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.0 tt -134.56 142.18 46.9 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 177.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.416 HD13 ' HA ' ' A' ' 55' ' ' ILE . 21.6 pt -133.39 168.43 24.13 Favored 'Isoleucine or valine' 0 C--O 1.243 0.742 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 170.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.622 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -152.3 169.99 21.15 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.342 175.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.4 tt -140.24 112.19 7.57 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 106.811 -1.551 . . . . 0.0 106.811 178.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.529 ' HB2' HG22 ' A' ' 40' ' ' THR . 68.9 m -102.05 109.35 21.04 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 177.263 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.447 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -128.71 113.79 15.81 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 122.759 0.424 . . . . 0.0 111.273 -176.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.74 ' SG ' HD13 ' A' ' 85' ' ' LEU . 2.2 m -130.98 146.61 62.9 Favored Pre-proline 0 N--CA 1.474 0.727 0 C-N-CA 123.481 0.712 . . . . 0.0 110.111 174.038 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -88.39 15.76 2.01 Favored 'Trans proline' 0 C--N 1.37 1.694 0 C-N-CA 123.331 2.688 . . . . 0.0 111.427 175.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 16.9 tpt -138.27 76.13 1.56 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.455 1.102 . . . . 0.0 109.16 178.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.77 132.31 4.25 Favored Glycine 0 C--N 1.34 0.802 0 CA-C-N 115.123 -0.944 . . . . 0.0 114.186 167.25 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 22.4 mt -66.39 -22.45 66.24 Favored 'General case' 0 C--O 1.216 -0.707 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 163.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.21 -40.09 73.48 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.316 0.646 . . . . 0.0 110.921 171.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.496 ' ND1' HD22 ' A' ' 85' ' ' LEU . 4.5 t-80 -68.99 -45.13 71.39 Favored 'General case' 0 C--O 1.245 0.865 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 178.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 35.5 p -66.19 -30.0 70.38 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.798 -178.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -80.12 -27.21 39.18 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.181 0.593 . . . . 0.0 111.418 -178.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 66.6 mtm -66.7 -38.72 87.32 Favored 'General case' 0 N--CA 1.482 1.142 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 171.098 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -72.55 -40.15 66.92 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.518 176.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.61 -51.58 58.54 Favored 'General case' 0 C--O 1.217 -0.635 0 C-N-CA 123.851 0.86 . . . . 0.0 109.979 -177.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.483 HE21 ' HG2' ' A' ' 27' ' ' GLU . 23.8 tp60 -62.81 -38.89 92.49 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 123.766 0.666 . . . . 0.0 110.52 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.584 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -62.42 -53.43 54.94 Favored 'General case' 0 CA--C 1.551 1.013 0 O-C-N 123.642 0.589 . . . . 0.0 111.419 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 93.4 mt -66.47 -29.86 70.07 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 123.491 0.716 . . . . 0.0 111.295 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.557 ' HA ' HG21 ' A' ' 36' ' ' VAL . 38.4 tt0 -64.84 -54.73 26.51 Favored 'General case' 0 C--N 1.346 0.449 0 C-N-CA 123.581 0.753 . . . . 0.0 109.807 -179.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.492 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 12.7 mm-40 -55.21 -49.09 72.82 Favored 'General case' 0 N--CA 1.479 1.025 0 O-C-N 124.505 1.128 . . . . 0.0 110.355 178.64 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.78 -46.68 81.35 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.656 1.183 . . . . 0.0 111.795 -178.102 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.78 -28.96 68.05 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 115.147 -0.933 . . . . 0.0 112.681 177.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 26' ' ' GLU . 56.1 t -72.86 -37.35 54.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 179.148 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 9.1 mm-40 -72.21 -26.98 62.26 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.641 178.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.45 -32.85 72.05 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.294 0.638 . . . . 0.0 110.902 172.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 104.33 18.8 12.42 Favored Glycine 0 C--N 1.346 1.121 0 N-CA-C 114.606 0.602 . . . . 0.0 114.606 169.359 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -122.19 -179.85 4.3 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.174 0.59 . . . . 0.0 111.334 175.51 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.534 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 12.2 tp10 -73.31 152.53 40.91 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.093 178.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.557 HG21 ' HA ' ' A' ' 26' ' ' GLU . 7.3 p -142.45 128.41 17.81 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 C-N-CA 123.296 0.638 . . . . 0.0 110.796 178.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.8 tptt -136.87 114.82 11.4 Favored 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 176.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.622 HG12 ' HB3' ' A' ' 7' ' ' ALA . 50.6 mt -119.17 116.39 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 122.746 0.418 . . . . 0.0 111.786 -173.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -87.08 119.81 27.69 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.894 0.877 . . . . 0.0 110.024 175.467 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.529 HG22 ' HB2' ' A' ' 9' ' ' CYS . 26.7 p -99.71 109.21 21.68 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.679 0.792 . . . . 0.0 111.144 178.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.447 ' O ' ' HA ' ' A' ' 10' ' ' ALA . 46.4 mt-30 -96.93 139.4 33.02 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.425 0.69 . . . . 0.0 110.095 173.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -164.89 175.73 40.78 Favored Glycine 0 C--N 1.341 0.806 0 N-CA-C 111.882 -0.487 . . . . 0.0 111.882 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -74.85 -12.33 60.35 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 122.625 0.37 . . . . 0.0 111.504 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -77.71 -28.22 50.85 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.27 0.628 . . . . 0.0 110.147 171.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 143.26 -169.79 25.68 Favored Glycine 0 C--N 1.346 1.137 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.391 -177.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 64.5 mt -113.29 145.5 19.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 123.123 0.569 . . . . 0.0 109.465 176.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -142.86 151.31 40.94 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.349 0.659 . . . . 0.0 110.197 -176.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.432 ' HB3' ' O ' ' A' ' 38' ' ' ILE . 10.4 t30 58.74 45.88 15.05 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 125.017 1.327 . . . . 0.0 110.075 178.173 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.6 tpp180 -52.21 120.77 5.83 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.111 1.364 . . . . 0.0 112.16 -175.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 37.5 mt -64.11 146.12 54.75 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.276 1.03 . . . . 0.0 110.979 172.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 67.2 p -104.29 167.3 9.84 Favored 'General case' 0 C--O 1.244 0.77 0 C-N-CA 123.304 0.642 . . . . 0.0 110.145 175.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.99 -35.27 74.66 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.049 0.54 . . . . 0.0 110.321 174.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 -60.98 -51.84 67.54 Favored 'General case' 0 CA--C 1.546 0.81 0 CA-C-N 114.393 -1.276 . . . . 0.0 110.53 174.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 31.3 m-20 -53.67 -46.28 70.59 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 123.633 0.773 . . . . 0.0 112.261 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.556 HG22 ' HG3' ' A' ' 78' ' ' ARG . 23.0 mt -73.2 -31.01 32.81 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.078 0 O-C-N 123.834 0.708 . . . . 0.0 110.974 -175.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.64 -37.57 70.84 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.229 0.612 . . . . 0.0 111.103 177.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -77.33 -26.42 52.12 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.032 0.933 . . . . 0.0 111.118 179.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -56.93 99.65 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.063 0.945 . . . . 0.0 112.431 -175.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 27.4 m -63.56 -37.9 89.09 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 115.156 -0.929 . . . . 0.0 108.901 168.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.533 HG23 HG21 ' A' ' 99' ' ' ILE . 80.5 mt -128.45 140.71 48.48 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.767 179.369 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.447 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 33.2 mt -131.3 137.23 56.02 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 173.006 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.2 mp -123.29 112.84 35.2 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 173.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 9.9 m170 -89.91 84.03 6.19 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-O 121.815 0.817 . . . . 0.0 108.972 171.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.454 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 23.4 p -83.27 84.58 7.44 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 114.302 -1.317 . . . . 0.0 108.926 177.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.418 HG12 ' HB3' ' A' ' 10' ' ' ALA . 34.6 m -127.88 163.61 31.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 121.535 0.684 . . . . 0.0 111.988 -170.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -113.67 -28.78 7.34 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.761 1.224 . . . . 0.0 108.98 174.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 12.9 m -124.18 162.67 25.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 125.18 1.392 . . . . 0.0 108.591 176.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 55.4 m -68.67 116.52 41.56 Favored Pre-proline 0 CA--C 1.549 0.912 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 174.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.536 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 31.1 Cg_endo -64.35 150.43 88.29 Favored 'Trans proline' 0 C--N 1.375 1.97 0 C-N-CA 122.466 2.111 . . . . 0.0 112.081 178.346 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -67.45 -30.95 70.81 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.589 0.756 . . . . 0.0 110.261 178.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.508 ' HB3' ' HD3' ' A' ' 74' ' ' ARG . 3.8 m-20 -94.13 12.73 25.51 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 114.42 -1.264 . . . . 0.0 112.162 -174.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.536 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 59.5 t30 -60.22 -35.29 75.1 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.097 0.959 . . . . 0.0 112.471 -174.695 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.96 -17.86 62.04 Favored 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -175.651 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.508 ' HD3' ' HB3' ' A' ' 71' ' ' ASP . 58.3 mtp180 -64.41 -25.96 68.25 Favored 'General case' 0 N--CA 1.485 1.304 0 CA-C-O 121.427 0.632 . . . . 0.0 111.631 174.525 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -100.69 17.85 20.84 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.652 1.181 . . . . 0.0 110.556 -175.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -50.18 -52.09 38.39 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 125.356 1.462 . . . . 0.0 113.105 -174.223 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 21.6 t -99.41 5.62 46.27 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.409 0.683 . . . . 0.0 112.082 -171.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.556 ' HG3' HG22 ' A' ' 55' ' ' ILE . 34.7 mmt180 -106.18 145.78 31.09 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.473 0.709 . . . . 0.0 111.063 -173.34 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -68.65 99.58 1.02 Allowed 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.718 0.807 . . . . 0.0 110.923 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.447 ' HA ' ' HB ' ' A' ' 61' ' ' ILE . 57.5 t -109.69 128.25 65.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 123.515 0.726 . . . . 0.0 110.322 -178.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 73.3 m-85 -98.25 92.51 5.75 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 124.423 1.089 . . . . 0.0 108.16 174.363 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -85.76 129.86 34.71 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.473 -175.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.436 HG13 ' HA ' ' A' ' 64' ' ' SER . 41.7 pt -137.45 -172.78 0.78 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.844 0 C-N-CA 124.926 1.29 . . . . 0.0 108.86 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 26.2 p -84.98 149.98 25.23 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 121.061 0.458 . . . . 0.0 109.969 167.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.74 HD13 ' SG ' ' A' ' 11' ' ' CYS . 8.2 tt -65.42 -29.04 69.68 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.578 177.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.488 ' HG2' ' HE3' ' A' ' 90' ' ' LYS . 35.7 tt0 -59.99 -46.06 90.71 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.638 173.703 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -62.41 -32.67 73.54 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.327 0.651 . . . . 0.0 110.633 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.37 -32.64 74.12 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.584 0.754 . . . . 0.0 112.365 176.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 94.3 mt -78.21 -50.72 18.93 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 123.491 0.716 . . . . 0.0 110.713 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.488 ' HE3' ' HG2' ' A' ' 86' ' ' GLN . 18.6 ptpt -82.56 -33.36 28.14 Favored 'General case' 0 N--CA 1.484 1.26 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -172.126 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -120.5 22.99 11.06 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.896 0.879 . . . . 0.0 110.442 -168.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.584 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -42.33 -60.28 1.54 Allowed 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 124.353 1.061 . . . . 0.0 113.428 -174.575 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.42 -36.96 85.45 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.072 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -62.13 -47.55 89.06 Favored Glycine 0 C--N 1.355 1.618 0 O-C-N 124.479 1.112 . . . . 0.0 112.078 -177.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.402 ' O ' HG13 ' A' ' 99' ' ' ILE . 23.2 mt -55.79 -58.66 4.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 124.598 1.159 . . . . 0.0 110.333 177.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.8 mp -55.25 -51.3 57.14 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 O-C-N 124.246 0.966 . . . . 0.0 111.043 -177.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.74 -29.53 68.78 Favored 'General case' 0 N--CA 1.486 1.357 0 O-C-N 123.417 0.448 . . . . 0.0 112.163 -175.357 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 59.7 mm-40 -71.25 -32.41 68.72 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.153 0.581 . . . . 0.0 110.381 177.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.533 HG21 HG23 ' A' ' 60' ' ' ILE . 48.0 mt -78.22 -36.23 20.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -57.86 -48.48 79.66 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 114.446 -1.252 . . . . 0.0 111.275 177.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -74.22 -34.93 63.83 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 123.92 0.762 . . . . 0.0 111.44 -178.173 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 64.5 mtm -64.58 -50.82 65.74 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 122.679 0.392 . . . . 0.0 110.615 178.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 39.2 mt -66.41 -42.45 90.47 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.383 178.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.24 -28.23 69.21 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 117.683 0.22 . . . . 0.0 111.049 178.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 36.8 t -75.03 -41.52 59.1 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 122.044 -0.41 . . . . 0.0 110.364 -178.136 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -78.56 -34.77 46.77 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 122.84 0.456 . . . . 0.0 111.469 -177.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 14.3 mm-40 -82.67 -43.37 16.99 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.072 0.549 . . . . 0.0 111.81 -174.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 . . . . . 0 CA--C 1.554 1.112 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 177.546 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.2 mtt . . . . . 0 N--CA 1.484 1.245 0 N-CA-C 109.919 -0.401 . . . . 0.0 109.919 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 55.8 p -78.92 82.55 5.1 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-O 121.616 0.722 . . . . 0.0 110.543 -179.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.524 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 4.7 pttt -66.18 -174.42 0.26 Allowed 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.915 0.886 . . . . 0.0 110.669 172.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.529 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 5.0 tmtp? -143.71 144.2 31.75 Favored 'General case' 0 N--CA 1.481 1.091 0 CA-C-O 121.454 0.645 . . . . 0.0 110.66 -175.099 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.499 ' N ' ' HD3' ' A' ' 4' ' ' LYS . 8.8 tt -130.8 135.67 47.97 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 125.246 1.418 . . . . 0.0 107.902 175.04 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.439 HG13 HG23 ' A' ' 61' ' ' ILE . 20.3 pt -126.1 161.94 30.7 Favored 'Isoleucine or valine' 0 C--O 1.242 0.693 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 171.656 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.631 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -148.94 166.61 28.09 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 122.96 0.504 . . . . 0.0 110.015 175.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.467 HD21 ' HG3' ' A' ' 41' ' ' GLN . 4.1 tt -136.58 123.38 21.24 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 178.268 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.56 ' HA ' ' O ' ' A' ' 64' ' ' SER . 78.0 m -112.51 112.63 24.31 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 123.61 0.764 . . . . 0.0 109.244 177.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.428 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -126.27 120.74 30.74 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 122.855 0.462 . . . . 0.0 111.547 -176.51 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.801 ' SG ' HD13 ' A' ' 85' ' ' LEU . 1.4 m -127.31 144.64 51.45 Favored Pre-proline 0 N--CA 1.485 1.323 0 C-N-CA 123.957 0.903 . . . . 0.0 111.45 -178.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -74.53 -23.61 14.7 Favored 'Trans proline' 0 C--N 1.379 2.176 0 C-N-CA 122.869 2.379 . . . . 0.0 113.161 177.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 76.9 mtm -76.11 -41.28 50.72 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 173.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 138.08 -156.03 23.65 Favored Glycine 0 C--N 1.347 1.173 0 N-CA-C 114.675 0.63 . . . . 0.0 114.675 172.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.3 mt -75.18 -18.48 60.16 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 114.783 1.401 . . . . 0.0 114.783 -164.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.98 -48.65 80.82 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-O 121.466 0.65 . . . . 0.0 110.761 178.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -66.18 -39.25 89.57 Favored 'General case' 0 C--O 1.246 0.868 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.264 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.407 HG21 ' O ' ' A' ' 41' ' ' GLN . 40.8 p -67.89 -36.34 80.07 Favored 'General case' 0 C--N 1.349 0.581 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.444 -175.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -72.49 -25.24 61.34 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 123.389 0.43 . . . . 0.0 111.616 178.329 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 56.3 mtm -63.08 -45.44 92.11 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-O 120.87 0.367 . . . . 0.0 110.055 170.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -69.72 -38.07 76.78 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.423 177.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.94 -43.09 84.11 Favored 'General case' 0 C--O 1.216 -0.682 0 C-N-CA 123.599 0.76 . . . . 0.0 110.735 -177.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.411 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 8.4 tp-100 -66.06 -42.2 89.79 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.064 0.546 . . . . 0.0 110.23 -179.558 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.03 -49.61 67.11 Favored 'General case' 0 CA--C 1.556 1.179 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.988 -178.543 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.431 HD11 ' OG ' ' A' ' 64' ' ' SER . 86.6 mt -66.52 -32.6 74.05 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.184 0.594 . . . . 0.0 111.789 178.595 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.519 ' HA ' HG21 ' A' ' 36' ' ' VAL . 46.0 tt0 -59.89 -53.54 56.72 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 123.907 0.754 . . . . 0.0 109.686 179.069 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 23' ' ' GLN . 30.4 mm-40 -54.07 -52.4 61.06 Favored 'General case' 0 N--CA 1.477 0.888 0 O-C-N 124.719 1.262 . . . . 0.0 110.834 178.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.15 -45.84 79.5 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.515 1.126 . . . . 0.0 112.109 -177.247 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.21 -29.71 67.73 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 115.364 -0.834 . . . . 0.0 113.063 177.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.48 HG23 ' O ' ' A' ' 26' ' ' GLU . 52.2 t -72.63 -38.55 59.16 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -71.79 -23.35 61.56 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 114.548 -1.205 . . . . 0.0 111.061 178.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.49 -22.31 59.14 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.411 0.684 . . . . 0.0 111.657 176.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 105.06 0.34 41.49 Favored Glycine 0 C--N 1.352 1.423 0 CA-C-O 119.555 -0.581 . . . . 0.0 114.512 171.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.524 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.1 OUTLIER -113.38 -179.87 3.76 Favored 'General case' 0 N--CA 1.485 1.319 0 CA-C-N 117.642 0.721 . . . . 0.0 111.901 177.427 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.529 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 38.2 tt0 -79.06 152.76 30.68 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.053 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.519 HG21 ' HA ' ' A' ' 26' ' ' GLU . 11.0 p -132.18 141.68 44.74 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 123.647 0.779 . . . . 0.0 110.548 177.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 49.1 tptt -147.22 119.52 8.37 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 172.012 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.631 HG12 ' HB3' ' A' ' 7' ' ' ALA . 47.9 mt -120.74 112.45 36.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 C-N-CA 122.938 0.495 . . . . 0.0 111.954 -175.43 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 46.5 tt0 -80.98 117.13 21.33 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.467 0.707 . . . . 0.0 109.423 174.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.409 HG22 ' HB2' ' A' ' 9' ' ' CYS . 21.7 p -98.87 115.74 29.53 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.814 0.845 . . . . 0.0 110.177 178.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.467 ' HG3' HD21 ' A' ' 8' ' ' LEU . 11.0 mt-30 -108.64 151.43 26.15 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.414 0.686 . . . . 0.0 109.917 175.767 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -172.81 -177.14 41.93 Favored Glycine 0 C--N 1.337 0.596 0 CA-C-N 116.73 -0.214 . . . . 0.0 112.872 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.69 -19.23 65.14 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.637 0.775 . . . . 0.0 112.527 -179.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -79.61 -31.74 41.71 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.623 0.769 . . . . 0.0 110.775 174.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 143.18 -158.71 27.31 Favored Glycine 0 C--N 1.339 0.738 0 N-CA-C 111.184 -0.766 . . . . 0.0 111.184 -176.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.43 HG23 ' HG2' ' A' ' 41' ' ' GLN . 30.0 mt -117.62 154.99 19.47 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 123.031 0.532 . . . . 0.0 109.963 179.541 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -149.8 152.62 35.49 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.198 0.999 . . . . 0.0 109.937 -179.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 18.8 t30 60.99 42.02 13.26 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 124.72 1.208 . . . . 0.0 109.89 176.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 10.1 tpt180 -54.68 121.59 8.83 Favored 'General case' 0 C--N 1.356 0.853 0 C-N-CA 125.098 1.359 . . . . 0.0 112.157 -169.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 44.4 mt -67.31 144.27 55.96 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.805 0.842 . . . . 0.0 110.118 172.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.431 ' O ' HG13 ' A' ' 55' ' ' ILE . 31.6 p -111.53 172.46 6.88 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.822 0.849 . . . . 0.0 109.392 177.053 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.44 -30.07 68.23 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 122.862 0.465 . . . . 0.0 111.381 176.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -64.33 -47.54 79.01 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.827 0.851 . . . . 0.0 110.814 176.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -59.74 -45.04 93.44 Favored 'General case' 0 N--CA 1.48 1.041 0 O-C-N 123.858 0.724 . . . . 0.0 111.028 179.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.561 HG22 ' HG3' ' A' ' 78' ' ' ARG . 26.7 mt -73.23 -28.87 26.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 C-N-CA 123.671 0.788 . . . . 0.0 111.017 -176.125 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -74.74 -49.04 22.47 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.249 0.62 . . . . 0.0 111.13 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -81.16 -9.34 59.82 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.407 0.683 . . . . 0.0 111.753 -176.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.59 101.15 0.17 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.521 0.729 . . . . 0.0 111.299 179.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 24.0 m -61.53 -38.03 85.93 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 115.021 -0.99 . . . . 0.0 109.102 168.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.516 HG23 HG21 ' A' ' 99' ' ' ILE . 73.1 mt -130.32 140.4 48.95 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.767 0 CA-C-N 114.819 -1.082 . . . . 0.0 110.174 -179.316 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.439 HG23 HG13 ' A' ' 6' ' ' ILE . 20.5 mt -133.01 131.56 58.88 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 C-N-CA 123.685 0.794 . . . . 0.0 109.098 172.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.0 mp -119.84 134.77 62.3 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 173.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 7.5 m170 -109.35 85.43 2.1 Favored 'General case' 0 N--CA 1.487 1.419 0 CA-C-N 118.931 0.787 . . . . 0.0 109.339 168.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.56 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 19.4 m -77.78 82.11 4.18 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 114.288 -1.324 . . . . 0.0 109.595 175.011 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.404 ' O ' ' HA ' ' A' ' 84' ' ' THR . 21.6 m -127.26 152.67 35.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 121.47 0.652 . . . . 0.0 111.313 -172.426 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -103.13 -29.02 11.59 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.315 1.046 . . . . 0.0 108.936 174.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 16.4 m -133.9 163.35 37.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 125.479 1.512 . . . . 0.0 108.447 177.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 26.3 m -64.72 117.59 39.78 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 122.942 0.497 . . . . 0.0 110.618 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.437 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 37.9 Cg_endo -67.6 148.81 78.94 Favored 'Trans proline' 0 C--N 1.374 1.874 0 C-N-CA 122.149 1.9 . . . . 0.0 111.079 175.037 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -63.51 -33.12 74.88 Favored 'General case' 0 N--CA 1.483 1.223 0 CA-C-O 121.242 0.544 . . . . 0.0 110.572 -179.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.504 ' HB3' ' HD3' ' A' ' 74' ' ' ARG . 1.3 m-20 -94.9 16.23 16.58 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.322 1.049 . . . . 0.0 112.357 -174.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.437 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 5.1 p30 -60.37 -36.08 77.2 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.256 0.622 . . . . 0.0 112.403 -174.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.64 -21.15 63.57 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.761 0.824 . . . . 0.0 112.945 -174.12 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.504 ' HD3' ' HB3' ' A' ' 71' ' ' ASP . 77.1 mtp180 -62.66 -42.89 99.86 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-O 122.215 1.007 . . . . 0.0 110.286 174.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -89.91 -17.97 27.01 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 113.72 -1.582 . . . . 0.0 111.04 -172.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -63.5 -27.38 69.23 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.311 0.645 . . . . 0.0 110.488 178.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 45.1 t -62.89 -34.73 78.04 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 124.071 0.948 . . . . 0.0 111.554 172.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.561 ' HG3' HG22 ' A' ' 55' ' ' ILE . 20.7 mmt180 -95.39 -175.98 3.64 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.329 1.052 . . . . 0.0 111.62 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -94.44 120.29 34.45 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.576 0.751 . . . . 0.0 109.826 173.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 62.1 t -130.42 148.49 33.13 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.163 0 C-N-CA 124.213 1.005 . . . . 0.0 110.296 -174.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -107.68 90.89 3.44 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.02 0.928 . . . . 0.0 109.342 173.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -75.68 111.52 11.1 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.42 0.688 . . . . 0.0 110.362 178.28 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.462 HG13 ' HA ' ' A' ' 64' ' ' SER . 44.2 pt -119.36 -175.53 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 124.489 1.116 . . . . 0.0 109.16 175.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.404 ' HA ' ' O ' ' A' ' 65' ' ' VAL . 22.0 p -83.2 148.14 27.62 Favored 'General case' 0 C--O 1.238 0.455 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 168.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.801 HD13 ' SG ' ' A' ' 11' ' ' CYS . 5.8 tt -62.41 -26.9 68.73 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.665 0.786 . . . . 0.0 111.482 178.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.522 ' HG2' ' HE3' ' A' ' 90' ' ' LYS . 33.7 tt0 -67.04 -40.62 87.2 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 123.795 0.838 . . . . 0.0 111.171 175.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.432 ' HB3' HD12 ' A' ' 83' ' ' ILE . 22.8 t70 -61.52 -29.84 70.25 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.456 0.702 . . . . 0.0 111.067 178.495 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -70.31 -18.52 63.1 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.715 0.806 . . . . 0.0 112.998 178.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 66.2 mt -95.91 -40.58 10.94 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.826 0 C-N-CA 123.518 0.727 . . . . 0.0 110.392 -179.258 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.522 ' HE3' ' HG2' ' A' ' 86' ' ' GLN . 18.1 ptpt -88.67 -31.05 18.7 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.196 0.598 . . . . 0.0 112.361 -175.044 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.509 HD22 HG13 ' A' ' 95' ' ' ILE . 6.0 t30 -126.58 26.78 6.23 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.374 0.669 . . . . 0.0 110.185 -170.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -49.15 -61.12 2.25 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.817 0.847 . . . . 0.0 113.026 -174.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.24 -39.74 83.73 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.872 177.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -55.97 -47.38 80.29 Favored Glycine 0 C--N 1.353 1.517 0 O-C-N 124.886 1.366 . . . . 0.0 112.991 179.296 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.509 HG13 HD22 ' A' ' 91' ' ' ASN . 26.0 mt -58.32 -56.9 13.31 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 124.052 0.941 . . . . 0.0 110.053 -179.824 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.8 mp -57.25 -50.62 76.12 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.185 0 O-C-N 124.034 0.834 . . . . 0.0 111.42 -176.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.65 -29.73 70.34 Favored 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -176.751 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -66.71 -38.44 86.74 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.487 0.715 . . . . 0.0 110.236 177.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.516 HG21 HG23 ' A' ' 60' ' ' ILE . 22.2 mt -77.92 -34.31 19.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 -177.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -61.14 -46.17 91.66 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.553 1.141 . . . . 0.0 111.821 177.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -74.53 -32.84 62.61 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 123.158 0.286 . . . . 0.0 111.465 -178.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 65.1 mtm -65.74 -45.57 82.11 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 122.638 0.375 . . . . 0.0 110.62 175.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 48.0 mt -65.93 -38.83 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 O-C-N 123.46 0.475 . . . . 0.0 109.938 176.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.36 -21.78 66.24 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.147 0.579 . . . . 0.0 111.371 177.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 44.6 t -88.58 -38.15 15.11 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 122.944 0.497 . . . . 0.0 111.199 -178.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -77.24 -25.48 51.61 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 122.396 0.278 . . . . 0.0 110.885 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 17.0 mm-40 -85.04 -50.24 7.62 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.02 0.528 . . . . 0.0 110.054 174.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 24.4 mm-40 . . . . . 0 CA--C 1.55 0.945 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 177.664 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 81.6 mtp . . . . . 0 N--CA 1.486 1.362 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.3 t -81.39 78.68 8.14 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 121.314 0.578 . . . . 0.0 110.216 -178.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 47.9 pttt -80.88 162.46 23.95 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 115.413 -0.812 . . . . 0.0 108.986 166.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.6 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.3 tmtp? -141.8 140.84 33.12 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 -172.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.467 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 10.1 tt -129.36 134.9 48.11 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 177.528 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.431 HD12 HD13 ' A' ' 50' ' ' LEU . 17.7 pt -128.01 165.17 27.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 173.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.618 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -152.48 169.08 23.48 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 122.775 0.43 . . . . 0.0 110.078 178.18 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.5 tt -139.73 114.28 9.25 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 -179.574 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.494 ' HA ' ' O ' ' A' ' 64' ' ' SER . 85.6 m -106.39 111.09 23.52 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 177.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.513 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -127.38 122.48 33.76 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 122.785 0.434 . . . . 0.0 111.235 -176.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.712 ' SG ' HD13 ' A' ' 85' ' ' LEU . 1.2 m -136.55 139.65 30.01 Favored Pre-proline 0 N--CA 1.474 0.74 0 C-N-CA 123.728 0.811 . . . . 0.0 109.878 176.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -75.91 -10.01 19.66 Favored 'Trans proline' 0 C--N 1.373 1.867 0 C-N-CA 122.856 2.371 . . . . 0.0 111.504 178.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 44.6 mtt -69.3 -56.97 5.98 Favored 'General case' 0 C--N 1.35 0.624 0 C-N-CA 124.93 1.292 . . . . 0.0 109.718 177.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 163.0 175.1 33.68 Favored Glycine 0 C--N 1.349 1.266 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.89 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 28.9 mt -69.89 -22.52 63.22 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.388 0.675 . . . . 0.0 112.759 -179.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -55.66 -44.65 77.45 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-O 120.956 0.408 . . . . 0.0 111.025 175.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -71.33 -36.5 71.57 Favored 'General case' 0 C--O 1.247 0.934 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.81 -178.537 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.414 ' HA ' HD11 ' A' ' 85' ' ' LEU . 44.8 p -70.97 -31.22 67.72 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.822 -178.396 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 -74.4 -28.13 60.95 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.298 0.639 . . . . 0.0 111.013 178.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 71.0 mtp -58.92 -51.26 70.81 Favored 'General case' 0 N--CA 1.483 1.189 0 CA-C-O 121.214 0.53 . . . . 0.0 109.838 169.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.01 -40.08 94.37 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.771 177.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.93 -37.11 78.7 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.876 0.87 . . . . 0.0 111.461 -176.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.424 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 8.4 tp-100 -64.5 -48.13 76.34 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.264 0.626 . . . . 0.0 109.715 178.273 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.465 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -63.11 -51.36 66.84 Favored 'General case' 0 CA--C 1.554 1.101 0 CA-C-N 115.221 -0.9 . . . . 0.0 111.934 -176.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 85.4 mt -63.91 -34.57 78.27 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.415 0.686 . . . . 0.0 112.048 -179.309 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.461 ' O ' HG23 ' A' ' 30' ' ' VAL . 39.0 tt0 -60.66 -56.72 17.9 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 123.979 0.799 . . . . 0.0 110.324 -179.022 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.482 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 21.3 mm-40 -56.96 -44.58 82.76 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 124.673 1.233 . . . . 0.0 111.196 -178.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.59 -49.45 77.42 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.839 0.855 . . . . 0.0 111.688 -179.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.15 -21.99 63.97 Favored 'General case' 0 CA--C 1.552 1.04 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 177.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.461 HG23 ' O ' ' A' ' 26' ' ' GLU . 42.3 t -73.61 -42.79 55.35 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.261 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 179.272 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 9.0 mm-40 -76.08 -20.3 57.82 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 114.559 -1.201 . . . . 0.0 110.814 -178.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -84.09 -14.6 50.0 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.719 0.808 . . . . 0.0 111.586 173.212 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 86.25 33.4 14.47 Favored Glycine 0 C--N 1.344 0.986 0 N-CA-C 114.792 0.677 . . . . 0.0 114.792 166.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -101.95 -179.19 3.93 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 117.781 0.791 . . . . 0.0 109.371 165.478 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.6 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 11.4 tp10 -87.71 132.31 34.17 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 156.618 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.467 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 8.7 p -117.47 135.74 56.88 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.27 0 CA-C-N 119.057 0.844 . . . . 0.0 110.667 -176.269 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.4 tptt -144.44 119.0 9.71 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.333 0.653 . . . . 0.0 109.278 177.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.618 HG12 ' HB3' ' A' ' 7' ' ' ALA . 46.6 mt -121.21 112.22 34.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 C-N-CA 123.082 0.553 . . . . 0.0 111.725 -173.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 49.0 tt0 -80.86 116.41 20.83 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.409 0.684 . . . . 0.0 110.115 175.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.404 HG22 ' HB2' ' A' ' 9' ' ' CYS . 22.6 p -97.26 114.31 26.04 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.841 0.856 . . . . 0.0 110.749 178.197 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.513 ' O ' ' HA ' ' A' ' 10' ' ' ALA . 45.7 mt-30 -105.09 137.27 43.11 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.918 0.887 . . . . 0.0 109.08 174.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -170.35 -165.84 28.33 Favored Glycine 0 C--N 1.345 1.041 0 C-N-CA 121.423 -0.417 . . . . 0.0 113.597 -177.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.99 -29.22 68.18 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.908 0.883 . . . . 0.0 112.601 -176.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -80.08 -11.25 59.78 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.283 0.633 . . . . 0.0 110.955 176.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 119.75 -157.35 15.57 Favored Glycine 0 C--N 1.345 1.075 0 N-CA-C 111.642 -0.583 . . . . 0.0 111.642 -179.537 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.405 HD12 HH22 ' A' ' 49' ' ' ARG . 55.4 mt -107.31 144.74 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 179.292 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -145.7 150.42 36.24 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.944 0.898 . . . . 0.0 109.514 -174.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.6 t30 60.64 43.87 12.08 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.554 1.142 . . . . 0.0 110.058 177.119 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.405 HH22 HD12 ' A' ' 46' ' ' ILE . 19.9 tpp180 -53.37 124.2 14.08 Favored 'General case' 0 C--N 1.357 0.921 0 C-N-CA 124.863 1.265 . . . . 0.0 112.796 -173.152 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.468 ' HB2' HH22 ' A' ' 74' ' ' ARG . 51.4 mt -69.9 140.45 53.12 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 114.49 -1.232 . . . . 0.0 110.96 170.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 70.1 p -101.86 164.74 11.57 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.627 0.771 . . . . 0.0 109.76 178.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.59 -32.13 64.94 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 122.913 0.485 . . . . 0.0 110.744 173.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 44.8 tt0 -61.9 -53.65 52.84 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.96 0.904 . . . . 0.0 110.962 173.304 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -57.68 -41.06 80.8 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 123.257 0.623 . . . . 0.0 111.886 -177.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.561 HG22 ' HG3' ' A' ' 78' ' ' ARG . 55.0 mt -72.08 -31.32 39.52 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.125 0 C-N-CA 123.77 0.828 . . . . 0.0 110.962 -177.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.72 -45.19 53.72 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.362 0.665 . . . . 0.0 111.337 176.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -65.7 -32.92 74.74 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.159 0.984 . . . . 0.0 111.121 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -51.92 102.6 0.05 OUTLIER 'General case' 0 CA--C 1.543 0.693 0 O-C-N 124.857 1.348 . . . . 0.0 112.322 -174.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 29.0 m -61.25 -37.96 84.99 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.089 165.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 91.7 mt -137.05 139.52 44.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 124.255 1.022 . . . . 0.0 110.371 -176.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.442 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 23.5 mt -126.05 141.21 46.36 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 172.6 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 5.0 mp -129.52 111.92 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 CA-C-N 118.248 0.476 . . . . 0.0 109.827 174.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . 0.411 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 12.7 m170 -87.74 85.67 7.08 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-O 121.618 0.723 . . . . 0.0 110.021 174.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.494 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 19.6 m -82.87 83.22 7.84 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 114.605 -1.179 . . . . 0.0 109.7 176.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.409 ' O ' ' HA ' ' A' ' 84' ' ' THR . 31.3 m -129.17 158.76 41.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 CA-C-O 121.668 0.747 . . . . 0.0 112.487 -170.482 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -113.97 -14.66 12.42 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.116 1.366 . . . . 0.0 109.445 175.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.3 m -134.1 150.24 31.03 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 125.786 1.635 . . . . 0.0 107.94 174.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 50.0 m -64.12 111.39 5.34 Favored Pre-proline 0 CA--C 1.548 0.903 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 174.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.531 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 33.4 Cg_endo -62.79 148.43 93.42 Favored 'Trans proline' 0 C--N 1.38 2.187 0 C-N-CA 122.467 2.111 . . . . 0.0 112.223 -173.721 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -65.13 -32.46 74.16 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.645 -179.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -96.55 15.66 20.96 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 115.084 -0.962 . . . . 0.0 112.424 -175.12 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.531 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 51.6 t30 -58.16 -33.51 69.3 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 124.033 0.933 . . . . 0.0 112.137 -179.189 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.42 -23.54 65.55 Favored 'General case' 0 N--CA 1.485 1.283 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -175.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.468 HH22 ' HB2' ' A' ' 50' ' ' LEU . 40.7 mtp180 -64.51 -38.12 89.92 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.385 0.674 . . . . 0.0 112.021 174.44 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -91.13 -3.04 57.43 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-N 114.615 -1.175 . . . . 0.0 111.357 -174.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -60.46 -30.65 69.81 Favored 'General case' 0 CA--C 1.554 1.099 0 C-N-CA 124.471 1.108 . . . . 0.0 112.021 -176.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 52.7 p -74.95 -18.68 60.35 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 124.048 0.939 . . . . 0.0 112.802 179.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.561 ' HG3' HG22 ' A' ' 55' ' ' ILE . 19.9 mmt180 -116.7 168.62 10.04 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.594 0.757 . . . . 0.0 111.881 -166.173 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -76.95 102.65 6.5 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.719 0.808 . . . . 0.0 110.349 -178.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.442 ' HA ' ' HB ' ' A' ' 61' ' ' ILE . 58.1 t -112.75 129.28 68.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 123.427 0.691 . . . . 0.0 110.807 -177.47 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 -99.87 90.08 4.31 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.387 1.075 . . . . 0.0 108.41 176.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.411 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 47.3 mt-10 -79.29 126.87 31.35 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.953 -176.514 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.55 HD12 ' HB3' ' A' ' 87' ' ' ASP . 38.2 pt -140.91 -172.9 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 C-N-CA 125.278 1.431 . . . . 0.0 109.137 178.729 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.409 ' HA ' ' O ' ' A' ' 65' ' ' VAL . 34.4 p -85.21 153.89 22.33 Favored 'General case' 0 C--N 1.346 0.45 0 CA-C-O 121.071 0.463 . . . . 0.0 110.324 168.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.712 HD13 ' SG ' ' A' ' 11' ' ' CYS . 7.6 tt -63.99 -27.54 69.19 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.039 176.179 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.471 ' HG2' ' HE2' ' A' ' 90' ' ' LYS . 35.7 tt0 -64.34 -42.96 96.0 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.864 0.866 . . . . 0.0 111.48 176.226 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.55 ' HB3' HD12 ' A' ' 83' ' ' ILE . 30.1 t70 -62.12 -30.86 71.32 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.462 0.705 . . . . 0.0 111.131 -179.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.46 -27.44 67.03 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.852 0.861 . . . . 0.0 112.885 178.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 37.6 mt -88.11 -45.96 15.83 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 C-N-CA 123.01 0.524 . . . . 0.0 109.996 -178.357 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.471 ' HE2' ' HG2' ' A' ' 86' ' ' GLN . 0.2 OUTLIER -78.82 -38.06 39.08 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 122.942 0.497 . . . . 0.0 112.089 -175.423 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -122.25 25.34 9.01 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.377 0.671 . . . . 0.0 110.56 -167.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.465 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -47.07 -59.37 3.18 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.401 0.68 . . . . 0.0 112.499 -176.186 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.06 -37.4 76.96 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 114.781 -1.1 . . . . 0.0 111.109 178.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.55 -50.7 60.03 Favored Glycine 0 C--N 1.354 1.548 0 O-C-N 124.578 1.174 . . . . 0.0 112.62 -178.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.407 ' O ' HG13 ' A' ' 99' ' ' ILE . 33.4 mt -54.38 -57.38 6.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 124.463 1.105 . . . . 0.0 110.126 -179.082 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.0 mp -56.8 -51.36 68.33 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.986 0 O-C-N 124.192 0.932 . . . . 0.0 111.021 -176.534 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.48 -28.12 68.32 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -176.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 35.7 mm-40 -70.91 -33.2 70.3 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.554 0.742 . . . . 0.0 110.652 178.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 95' ' ' ILE . 19.4 mt -82.14 -33.19 11.38 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 178.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -57.0 -49.76 74.8 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.479 1.112 . . . . 0.0 111.091 174.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -74.12 -33.93 63.75 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 123.576 0.548 . . . . 0.0 111.7 -177.046 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 66.8 mtm -63.13 -53.55 51.76 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 122.173 0.189 . . . . 0.0 110.6 175.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 21.7 mt -64.57 -39.32 85.2 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 O-C-N 123.821 0.701 . . . . 0.0 110.674 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.82 -42.08 99.57 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 122.263 0.225 . . . . 0.0 110.833 178.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 14.8 t -69.78 -35.4 74.85 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 122.703 0.401 . . . . 0.0 111.166 -172.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -81.18 -28.69 34.86 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 122.811 0.444 . . . . 0.0 111.618 179.169 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -87.26 -21.78 25.59 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.078 0.551 . . . . 0.0 112.033 -178.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 . . . . . 0 N--CA 1.481 1.089 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 175.032 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.0 ttp . . . . . 0 N--CA 1.485 1.305 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.8 p -81.48 90.7 6.24 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-O 121.315 0.578 . . . . 0.0 109.545 177.134 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 37.8 pttt -95.91 170.46 9.28 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.516 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.575 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.2 tmtp? -142.42 134.49 27.36 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 -175.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.441 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.9 tt -127.08 136.82 52.69 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 179.091 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 19.6 pt -128.22 164.23 30.42 Favored 'Isoleucine or valine' 0 C--O 1.243 0.724 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 173.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.607 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -152.28 165.74 33.98 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.877 177.504 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.515 HD21 ' HG3' ' A' ' 41' ' ' GLN . 3.2 tt -137.34 109.95 7.51 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 -179.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.509 ' HA ' ' O ' ' A' ' 64' ' ' SER . 64.1 m -102.25 113.25 26.37 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 123.725 0.81 . . . . 0.0 108.966 177.472 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.415 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -129.01 124.08 34.01 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 122.703 0.401 . . . . 0.0 111.032 -176.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.738 ' SG ' HD13 ' A' ' 85' ' ' LEU . 1.3 m -144.17 148.88 43.13 Favored Pre-proline 0 N--CA 1.477 0.891 0 C-N-CA 123.753 0.821 . . . . 0.0 110.552 178.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -81.61 -7.16 12.62 Favored 'Trans proline' 0 C--N 1.373 1.863 0 C-N-CA 122.725 2.283 . . . . 0.0 111.411 176.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 55.0 mtt -70.52 -20.83 62.8 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.68 1.192 . . . . 0.0 110.991 177.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.17 -178.59 17.89 Favored Glycine 0 C--N 1.344 1.007 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.943 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 39.2 mt -72.33 -22.55 61.16 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 112.832 0.679 . . . . 0.0 112.832 -175.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.66 -43.53 93.91 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-N 118.484 0.584 . . . . 0.0 111.479 178.074 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.4 t-160 -70.07 -39.63 75.52 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.391 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.444 ' HA ' HD11 ' A' ' 85' ' ' LEU . 48.7 p -68.45 -28.08 66.73 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.419 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.1 m-30 -75.7 -28.23 58.55 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.599 0.76 . . . . 0.0 111.185 177.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 78.7 mtp -61.26 -46.14 91.59 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-O 121.303 0.573 . . . . 0.0 109.654 171.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.93 -38.05 69.93 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-N 114.888 -1.051 . . . . 0.0 111.507 178.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.23 -42.32 93.5 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.65 0.78 . . . . 0.0 110.837 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.407 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 24.2 tp60 -66.22 -43.49 86.52 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 122.812 0.445 . . . . 0.0 109.991 178.265 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.546 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -60.27 -56.53 20.42 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.912 -177.102 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.414 HD11 ' OG ' ' A' ' 64' ' ' SER . 96.6 mt -65.59 -30.49 71.23 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.789 0.835 . . . . 0.0 111.894 -179.275 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.515 ' HA ' HG21 ' A' ' 36' ' ' VAL . 35.5 tt0 -60.03 -55.37 34.77 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 123.733 0.646 . . . . 0.0 110.054 176.504 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.552 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 55.4 mm-40 -53.03 -51.12 62.72 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 124.513 1.133 . . . . 0.0 110.518 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.74 -49.8 72.1 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.454 1.102 . . . . 0.0 112.032 -177.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.94 -23.57 64.17 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 113.508 0.929 . . . . 0.0 113.508 177.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' ' 26' ' ' GLU . 49.0 t -75.87 -43.23 39.75 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 -179.707 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.552 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 24.6 mm-40 -69.81 -33.36 72.24 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 114.486 -1.234 . . . . 0.0 110.134 179.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -77.35 -19.21 56.63 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.558 0.743 . . . . 0.0 111.707 176.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 89.67 39.16 6.32 Favored Glycine 0 C--N 1.342 0.861 0 N-CA-C 114.722 0.649 . . . . 0.0 114.722 166.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -104.53 170.27 7.99 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 165.197 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.575 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 45.4 tt0 -78.99 129.45 34.46 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 106.591 -1.633 . . . . 0.0 106.591 156.048 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.515 HG21 ' HA ' ' A' ' 26' ' ' GLU . 12.2 p -113.97 137.5 46.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 CA-C-N 118.336 0.516 . . . . 0.0 110.01 -175.626 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 47.8 tptt -144.38 113.33 6.8 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 177.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.607 HG12 ' HB3' ' A' ' 7' ' ' ALA . 61.3 mt -118.3 110.96 32.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 122.55 0.34 . . . . 0.0 111.418 -175.321 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -74.29 142.1 45.26 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 123.805 0.691 . . . . 0.0 109.136 171.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 14.0 p -128.0 117.55 21.9 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.745 0.818 . . . . 0.0 109.219 -176.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.515 ' HG3' HD21 ' A' ' 8' ' ' LEU . 8.2 mt-30 -110.17 128.85 55.7 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 178.428 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -152.79 -176.37 25.28 Favored Glycine 0 C--N 1.336 0.564 0 N-CA-C 112.113 -0.395 . . . . 0.0 112.113 -177.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.51 -27.67 69.43 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.711 0.805 . . . . 0.0 111.695 -179.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -72.57 -36.32 68.16 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.972 0.909 . . . . 0.0 110.751 177.205 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 146.64 -159.42 27.99 Favored Glycine 0 C--N 1.347 1.155 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.054 -177.052 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 76.1 mt -111.57 131.96 61.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 123.397 0.679 . . . . 0.0 109.58 178.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -128.29 150.47 50.04 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.458 1.103 . . . . 0.0 109.691 -177.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 17.0 t30 60.63 41.42 15.32 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 124.61 1.164 . . . . 0.0 110.259 176.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 18.7 tpp180 -47.35 125.39 8.01 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 125.496 1.519 . . . . 0.0 113.142 -174.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 42.2 mt -75.09 127.93 34.35 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.778 173.526 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 50.1 p -87.34 161.2 18.06 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.423 176.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -57.48 -29.63 64.41 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 122.971 0.509 . . . . 0.0 111.47 175.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -73.06 -37.1 66.95 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.648 0.779 . . . . 0.0 111.378 178.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -62.02 -40.83 97.04 Favored 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 110.332 -0.247 . . . . 0.0 110.332 174.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.567 HG22 ' HG3' ' A' ' 78' ' ' ARG . 31.9 mt -73.6 -30.04 28.43 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.991 0 O-C-N 124.206 0.941 . . . . 0.0 110.888 -178.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.97 -48.99 31.75 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.598 0.759 . . . . 0.0 111.173 179.303 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -84.23 -4.38 58.79 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.593 0.757 . . . . 0.0 112.025 -177.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.91 104.19 0.82 Allowed 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.912 0.387 . . . . 0.0 110.58 177.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 26.1 m -60.64 -37.66 82.23 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.226 167.353 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 73.0 mt -135.65 142.45 39.32 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 C-N-CA 123.527 0.731 . . . . 0.0 110.646 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.406 HD13 ' HD2' ' A' ' 75' ' ' PHE . 23.4 mt -129.17 135.79 61.09 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 C-N-CA 124.105 0.962 . . . . 0.0 108.446 171.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -125.82 112.69 31.44 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 C-N-CA 123.106 0.562 . . . . 0.0 109.586 174.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . 0.459 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 16.4 m170 -88.25 86.22 7.04 Favored 'General case' 0 N--CA 1.485 1.319 0 CA-C-N 118.833 0.742 . . . . 0.0 109.45 172.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.509 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 23.1 m -82.92 81.62 8.54 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-N 114.808 -1.087 . . . . 0.0 109.466 176.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 28.0 m -126.88 159.05 37.25 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-O 121.677 0.751 . . . . 0.0 112.252 -170.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -117.54 -21.57 8.52 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.106 1.362 . . . . 0.0 108.822 173.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 12.3 m -126.04 156.83 36.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 125.106 1.362 . . . . 0.0 108.197 175.203 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 38.7 m -65.79 118.29 50.23 Favored Pre-proline 0 CA--C 1.546 0.812 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 177.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.545 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 56.2 Cg_endo -69.49 146.38 61.67 Favored 'Trans proline' 0 C--N 1.373 1.839 0 C-N-CA 121.683 1.589 . . . . 0.0 110.705 175.385 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.424 ' HG2' HE22 ' A' ' 41' ' ' GLN . 21.6 mm-40 -62.69 -48.28 79.99 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-O 121.538 0.685 . . . . 0.0 111.196 -175.358 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -94.76 26.58 3.47 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 114.76 -1.109 . . . . 0.0 111.789 -170.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.545 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 6.5 p30 -60.19 -27.75 67.41 Favored 'General case' 0 CA--C 1.557 1.237 0 C-N-CA 124.616 1.166 . . . . 0.0 112.043 -178.557 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.98 -13.1 60.01 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.06 0.944 . . . . 0.0 112.809 -177.334 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -69.53 -23.28 63.57 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-O 121.34 0.591 . . . . 0.0 110.66 171.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.406 ' HD2' HD13 ' A' ' 61' ' ' ILE . 27.3 m-85 -104.21 7.72 36.08 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 124.932 1.293 . . . . 0.0 110.563 -177.042 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -56.6 -52.47 64.72 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 124.883 1.273 . . . . 0.0 112.584 -171.069 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 48.4 t -86.79 -2.6 58.69 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.193 0.997 . . . . 0.0 112.046 -175.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.567 ' HG3' HG22 ' A' ' 55' ' ' ILE . 25.2 mmt180 -103.41 159.72 15.33 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.925 0.89 . . . . 0.0 110.12 -173.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -77.1 99.2 5.28 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-O 121.222 0.534 . . . . 0.0 111.211 -176.291 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 41.6 t -112.44 142.02 26.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 123.982 0.913 . . . . 0.0 110.501 -177.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -116.94 93.29 4.13 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.487 1.115 . . . . 0.0 108.656 177.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.459 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 42.1 mt-10 -81.81 114.53 20.5 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.598 -176.589 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.529 HD12 ' HB3' ' A' ' 87' ' ' ASP . 45.2 pt -125.46 -173.78 0.95 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.882 0 C-N-CA 124.704 1.201 . . . . 0.0 109.008 177.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 40.4 p -80.88 152.52 28.09 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-O 120.935 0.397 . . . . 0.0 110.0 168.184 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.738 HD13 ' SG ' ' A' ' 11' ' ' CYS . 6.7 tt -62.59 -26.09 68.42 Favored 'General case' 0 CA--C 1.551 1.012 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.724 173.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.59 ' HG2' ' HE2' ' A' ' 90' ' ' LYS . 34.6 tt0 -64.98 -45.6 84.97 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.733 0.813 . . . . 0.0 111.292 176.387 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.529 ' HB3' HD12 ' A' ' 83' ' ' ILE . 20.3 t70 -61.57 -30.71 70.84 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.375 0.67 . . . . 0.0 111.102 -178.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.97 -43.42 95.83 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.514 0.726 . . . . 0.0 111.794 175.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 75.3 mt -68.45 -41.22 83.16 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.926 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.271 -177.164 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.59 ' HE2' ' HG2' ' A' ' 86' ' ' GLN . 0.2 OUTLIER -87.35 -53.22 4.95 Favored 'General case' 0 N--CA 1.485 1.299 0 CA-C-O 120.964 0.412 . . . . 0.0 111.938 -175.607 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -102.73 28.15 6.36 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.3 1.04 . . . . 0.0 110.667 -166.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.546 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -43.56 -62.5 1.06 Allowed 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.835 0.854 . . . . 0.0 112.922 -175.272 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.24 -39.17 85.79 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.177 -0.92 . . . . 0.0 110.958 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.412 ' O ' ' HG2' ' A' ' 98' ' ' GLU . . . -58.79 -53.91 42.35 Favored Glycine 0 C--N 1.353 1.508 0 O-C-N 124.72 1.262 . . . . 0.0 112.828 -178.162 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 25.8 mt -51.18 -55.74 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 124.481 1.113 . . . . 0.0 110.624 178.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.8 mp -57.96 -50.61 77.37 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.112 0 O-C-N 124.199 0.937 . . . . 0.0 111.298 -176.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.36 -27.42 66.23 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 122.91 0.484 . . . . 0.0 112.174 -176.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.412 ' HG2' ' O ' ' A' ' 94' ' ' GLY . 57.7 mm-40 -67.15 -38.75 86.03 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.232 0.613 . . . . 0.0 109.753 176.811 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.41 ' O ' HG13 ' A' ' 103' ' ' ILE . 21.1 mt -77.06 -37.17 25.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -52.13 -51.72 56.11 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 124.735 1.214 . . . . 0.0 111.981 174.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -71.46 -33.14 69.06 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 123.505 0.503 . . . . 0.0 111.218 -177.01 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 71.0 mtm -67.49 -39.24 85.21 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 122.617 0.367 . . . . 0.0 111.042 175.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.478 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 9.3 mt -70.08 -42.8 79.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 176.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.37 -21.2 66.23 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.242 0.617 . . . . 0.0 111.23 179.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 26.3 t -85.19 -42.18 14.95 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 122.931 0.492 . . . . 0.0 110.09 179.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.478 ' HG2' ' HA ' ' A' ' 103' ' ' ILE . 13.1 pt-20 -76.35 -23.3 54.19 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 122.897 0.479 . . . . 0.0 111.599 -178.05 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.9 mm-40 -90.02 -39.86 12.68 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.122 0.569 . . . . 0.0 110.535 177.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 80.3 mm-40 . . . . . 0 CA--C 1.554 1.104 0 CA-C-O 118.587 -0.72 . . . . 0.0 109.495 179.891 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.9 ptt? . . . . . 0 N--CA 1.483 1.188 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.8 m -73.73 91.44 1.91 Allowed 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.373 0.669 . . . . 0.0 110.394 -179.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.673 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 27.9 pttt -82.18 170.12 15.81 Favored 'General case' 0 C--O 1.245 0.838 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.04 176.056 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.592 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.9 tmtp? -143.75 143.68 31.49 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.477 -172.606 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.477 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.0 tt -128.01 131.13 49.22 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 174.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 18.7 pt -122.98 161.72 24.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 108.482 -0.932 . . . . 0.0 108.482 170.097 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.586 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -146.48 171.34 15.21 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.001 176.444 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.5 tt -146.48 117.31 7.66 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 -178.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.516 ' HA ' ' O ' ' A' ' 64' ' ' SER . 56.2 m -104.73 112.86 26.11 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.932 0.893 . . . . 0.0 109.239 176.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.531 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -128.36 117.24 21.08 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 122.496 0.318 . . . . 0.0 111.183 -178.206 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.767 ' SG ' HD13 ' A' ' 85' ' ' LEU . 1.3 m -138.78 141.78 31.77 Favored Pre-proline 0 N--CA 1.484 1.226 0 C-N-CA 123.89 0.876 . . . . 0.0 110.868 178.186 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -82.94 -7.66 11.21 Favored 'Trans proline' 0 C--N 1.375 1.928 0 C-N-CA 123.434 2.756 . . . . 0.0 111.533 176.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 47.9 ttm -65.12 -30.15 71.07 Favored 'General case' 0 C--N 1.354 0.764 0 C-N-CA 124.738 1.215 . . . . 0.0 110.318 170.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 125.79 -176.08 17.43 Favored Glycine 0 C--N 1.346 1.126 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.407 179.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 48.9 mt -78.17 -21.75 49.72 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 -173.038 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.82 -41.96 88.06 Favored 'General case' 0 N--CA 1.488 1.463 0 CA-C-N 118.922 0.783 . . . . 0.0 110.898 178.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.429 ' ND1' HD22 ' A' ' 85' ' ' LEU . 4.9 t-80 -67.55 -44.63 77.83 Favored 'General case' 0 C--O 1.247 0.94 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.165 -179.603 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 50.1 p -65.76 -36.43 83.53 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 114.816 -1.084 . . . . 0.0 110.916 -178.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -68.62 -30.82 69.64 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.34 0.656 . . . . 0.0 111.352 -179.182 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 64.7 mtm -68.28 -40.55 81.77 Favored 'General case' 0 N--CA 1.485 1.293 0 CA-C-O 120.473 0.178 . . . . 0.0 111.1 175.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.63 -38.48 83.94 Favored 'General case' 0 N--CA 1.485 1.29 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.133 175.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.8 -39.35 80.17 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.084 0.953 . . . . 0.0 110.975 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.4 tp60 -62.71 -50.91 69.24 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.672 0.789 . . . . 0.0 109.513 178.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.15 -50.63 69.66 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 124.265 0.978 . . . . 0.0 111.956 -175.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 68.2 mt -63.93 -34.22 77.48 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 122.95 0.5 . . . . 0.0 111.743 179.048 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.44 ' O ' HG23 ' A' ' 30' ' ' VAL . 42.4 tt0 -63.39 -54.12 41.75 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 122.463 0.305 . . . . 0.0 110.313 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -51.28 -50.74 58.7 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 124.616 1.198 . . . . 0.0 111.445 179.357 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.421 ' HB3' HD12 ' A' ' 96' ' ' ILE . . . -67.48 -35.85 79.96 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 115.177 -0.92 . . . . 0.0 112.195 -176.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.04 -25.84 59.01 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.073 0.549 . . . . 0.0 111.716 178.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.44 HG23 ' O ' ' A' ' 26' ' ' GLU . 53.7 t -71.73 -39.37 68.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 175.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -65.87 -29.52 69.98 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 114.688 -1.142 . . . . 0.0 111.088 174.521 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -82.49 1.5 37.38 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 123.45 0.7 . . . . 0.0 112.41 177.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 96.96 -45.93 1.77 Allowed Glycine 0 C--N 1.353 1.503 0 N-CA-C 114.423 0.529 . . . . 0.0 114.423 165.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.673 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.1 OUTLIER -71.56 175.72 5.34 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -174.418 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.592 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 37.8 tt0 -77.07 144.03 38.83 Favored 'General case' 0 C--N 1.351 0.638 0 CA-C-N 114.446 -1.252 . . . . 0.0 109.111 178.515 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.477 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 9.3 p -128.66 135.92 61.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 122.66 0.384 . . . . 0.0 110.944 -178.612 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.9 tptt -142.46 113.35 7.5 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.248 0.619 . . . . 0.0 109.482 174.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.586 HG12 ' HB3' ' A' ' 7' ' ' ALA . 40.7 mt -117.54 112.78 40.24 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 122.854 0.462 . . . . 0.0 111.536 -176.376 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.532 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 32.0 tt0 -84.59 124.14 31.1 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.176 0.591 . . . . 0.0 110.288 177.262 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 24.9 p -100.95 105.27 16.49 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.871 0.868 . . . . 0.0 110.413 177.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.531 ' O ' ' HA ' ' A' ' 10' ' ' ALA . 40.0 mt-30 -95.35 141.83 28.45 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 172.219 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -162.19 -176.95 34.81 Favored Glycine 0 N--CA 1.464 0.564 0 CA-C-O 120.019 -0.323 . . . . 0.0 112.718 -177.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.6 -28.91 67.6 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.73 0.812 . . . . 0.0 111.807 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -72.69 -43.93 62.45 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.147 0.979 . . . . 0.0 110.363 175.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 148.69 -158.58 27.72 Favored Glycine 0 C--N 1.345 1.044 0 CA-C-N 115.257 -0.883 . . . . 0.0 112.007 -175.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 64.8 mt -106.82 138.6 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 123.699 0.8 . . . . 0.0 110.146 -175.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -140.02 151.23 45.29 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.903 0.881 . . . . 0.0 109.191 -177.384 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 21.7 t30 57.57 48.27 14.61 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 124.507 1.123 . . . . 0.0 109.702 -177.016 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 32.0 tpt180 -48.4 123.36 6.46 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 126.228 1.811 . . . . 0.0 113.704 -173.09 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.532 ' HG ' ' HB2' ' A' ' 39' ' ' GLU . 52.2 mt -75.17 135.54 41.08 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 124.086 0.954 . . . . 0.0 110.318 170.595 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 44.4 p -103.77 173.03 6.48 Favored 'General case' 0 C--O 1.244 0.808 0 C-N-CA 124.164 0.985 . . . . 0.0 109.38 177.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.09 -33.81 73.93 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 122.813 0.445 . . . . 0.0 110.759 175.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -63.96 -44.75 91.83 Favored 'General case' 0 C--N 1.359 0.982 0 O-C-N 124.066 0.854 . . . . 0.0 110.944 178.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -57.99 -47.84 81.81 Favored 'General case' 0 N--CA 1.48 1.045 0 O-C-N 123.8 0.688 . . . . 0.0 110.983 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.546 HG22 ' HG3' ' A' ' 78' ' ' ARG . 14.2 mt -74.94 -28.83 21.57 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 O-C-N 123.741 0.65 . . . . 0.0 111.256 -177.191 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.94 -44.17 70.11 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.561 0.744 . . . . 0.0 111.401 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -89.36 -9.02 51.97 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.322 0.649 . . . . 0.0 111.602 -176.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.35 96.74 0.11 Allowed 'General case' 0 C--N 1.351 0.67 0 C-N-CA 123.548 0.739 . . . . 0.0 111.647 -177.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 26.3 m -62.58 -35.99 81.25 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 114.836 -1.075 . . . . 0.0 109.745 172.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.456 HG23 HG21 ' A' ' 99' ' ' ILE . 79.8 mt -131.55 137.18 55.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 CA-C-N 114.883 -1.053 . . . . 0.0 109.209 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 30.1 mt -131.23 133.66 62.14 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 175.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -124.95 111.11 26.72 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 174.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 11.8 m170 -89.19 85.49 6.65 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-O 121.576 0.703 . . . . 0.0 109.626 173.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.516 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 18.5 p -79.29 81.27 5.58 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-N 114.531 -1.213 . . . . 0.0 108.973 175.138 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.406 ' O ' ' HA ' ' A' ' 84' ' ' THR . 35.9 m -126.51 159.72 35.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 121.631 0.729 . . . . 0.0 111.553 -171.027 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -128.89 -3.22 5.21 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.068 1.347 . . . . 0.0 109.275 176.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.8 m -138.71 158.25 30.31 Favored 'Isoleucine or valine' 0 C--N 1.349 0.564 0 C-N-CA 125.912 1.685 . . . . 0.0 107.356 168.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 39.2 m -63.41 118.43 43.78 Favored Pre-proline 0 CA--C 1.547 0.828 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 175.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.479 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 58.9 Cg_endo -67.37 146.44 75.05 Favored 'Trans proline' 0 C--N 1.377 2.054 0 C-N-CA 122.095 1.863 . . . . 0.0 110.686 179.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.458 ' HB2' HE22 ' A' ' 41' ' ' GLN . 9.1 mm-40 -61.82 -38.79 89.47 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-O 121.752 0.787 . . . . 0.0 110.752 -176.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -94.57 16.54 15.19 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 114.514 -1.221 . . . . 0.0 112.417 -172.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.479 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 4.1 p30 -54.11 -26.59 28.2 Favored 'General case' 0 CA--C 1.565 1.541 0 C-N-CA 123.965 0.906 . . . . 0.0 110.766 174.404 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -56.13 -45.52 79.52 Favored 'General case' 0 CA--C 1.565 1.52 0 C-N-CA 125.836 1.654 . . . . 0.0 112.702 171.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 58.7 mtt85 -71.02 -17.77 62.61 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 124.6 1.16 . . . . 0.0 112.656 -176.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.539 ' HB3' HG21 ' A' ' 80' ' ' VAL . 77.1 m-85 -103.23 19.12 20.22 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.048 0.939 . . . . 0.0 110.991 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 13.7 tp10 -57.33 -56.51 20.91 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.409 1.083 . . . . 0.0 112.305 -174.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 64.8 p -86.2 -9.78 55.93 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.674 0.789 . . . . 0.0 112.453 -174.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.546 ' HG3' HG22 ' A' ' 55' ' ' ILE . 38.5 mmt180 -91.37 157.11 17.28 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 123.357 0.663 . . . . 0.0 111.927 -170.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -82.14 97.96 8.46 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.668 0.787 . . . . 0.0 109.751 -178.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.539 HG21 ' HB3' ' A' ' 75' ' ' PHE . 41.6 t -110.73 118.43 57.22 Favored 'Isoleucine or valine' 0 C--O 1.24 0.602 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.96 -174.854 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -86.39 89.41 7.87 Favored 'General case' 0 C--O 1.24 0.574 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 172.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -84.52 125.37 32.34 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.157 -177.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.627 HD12 ' HB3' ' A' ' 87' ' ' ASP . 39.0 pt -135.2 -175.37 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 125.024 1.33 . . . . 0.0 109.224 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.406 ' HA ' ' O ' ' A' ' 65' ' ' VAL . 24.8 p -79.57 151.35 30.71 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.847 0.356 . . . . 0.0 110.475 168.241 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.767 HD13 ' SG ' ' A' ' 11' ' ' CYS . 6.5 tt -61.88 -32.15 72.49 Favored 'General case' 0 N--CA 1.48 1.059 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.492 176.066 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 31.2 tt0 -59.83 -43.55 94.51 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.794 0.838 . . . . 0.0 111.181 175.21 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.627 ' HB3' HD12 ' A' ' 83' ' ' ILE . 5.1 t70 -60.31 -31.67 70.5 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.95 0.9 . . . . 0.0 110.773 -176.621 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.93 -28.74 63.67 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.468 0.707 . . . . 0.0 112.831 178.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 86.0 mt -77.92 -48.14 24.01 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.874 0 C-N-CA 123.041 0.536 . . . . 0.0 110.32 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -80.31 -43.17 21.71 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.075 0.55 . . . . 0.0 112.323 -176.25 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -114.46 27.86 9.16 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.507 0.723 . . . . 0.0 110.557 -168.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -45.38 -60.08 2.34 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 124.063 0.945 . . . . 0.0 112.781 -177.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.66 -41.38 94.9 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 114.074 -1.421 . . . . 0.0 110.702 177.318 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -62.81 -42.1 99.74 Favored Glycine 0 C--N 1.354 1.566 0 O-C-N 124.391 1.057 . . . . 0.0 113.301 -173.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.403 ' O ' HG13 ' A' ' 99' ' ' ILE . 19.7 mt -63.25 -57.51 11.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 123.909 0.884 . . . . 0.0 108.682 179.45 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.421 HD12 ' HB3' ' A' ' 28' ' ' ALA . 82.6 mt -58.61 -45.77 90.44 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 CA-C-N 114.04 -1.437 . . . . 0.0 111.722 -174.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -33.07 73.5 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 122.755 0.422 . . . . 0.0 111.365 -177.531 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -67.5 -37.56 83.01 Favored 'General case' 0 C--N 1.355 0.809 0 O-C-N 123.614 0.571 . . . . 0.0 110.404 177.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.456 HG21 HG23 ' A' ' 60' ' ' ILE . 57.1 mt -75.14 -34.94 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 -177.128 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -63.37 -49.5 73.59 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 114.892 -1.049 . . . . 0.0 111.374 176.081 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -73.57 -30.7 63.19 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-O 119.613 -0.232 . . . . 0.0 111.307 -177.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.453 ' O ' ' HG2' ' A' ' 106' ' ' GLU . 68.3 mtm -65.47 -61.97 1.8 Allowed 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 175.165 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 41.3 mt -58.58 -48.49 85.44 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 O-C-N 123.932 0.77 . . . . 0.0 111.419 -176.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.83 -37.55 88.01 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -175.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 15.3 t -80.88 -23.47 39.0 Favored 'General case' 0 N--CA 1.484 1.275 0 CA-C-N 117.763 0.256 . . . . 0.0 111.643 -172.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' A' ' 102' ' ' MET . 11.6 pt-20 -86.79 -41.69 13.89 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 122.549 0.34 . . . . 0.0 111.058 176.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -73.26 -35.62 66.23 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.025 0.53 . . . . 0.0 110.905 -177.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 76.3 mm-40 . . . . . 0 CA--C 1.55 0.965 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 175.217 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.2 mtt . . . . . 0 N--CA 1.482 1.13 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 55.2 p -72.57 94.99 1.76 Allowed 'General case' 0 CA--C 1.546 0.8 0 CA-C-O 121.481 0.658 . . . . 0.0 109.701 177.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.639 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 18.1 pttt -73.57 -177.38 2.66 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-N 114.793 -1.094 . . . . 0.0 111.684 -178.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.462 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.4 tmtp? -142.2 141.0 32.52 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-O 121.029 0.442 . . . . 0.0 109.834 -173.555 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.474 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 8.9 tt -128.4 139.58 52.3 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 176.199 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.427 HD12 HD13 ' A' ' 50' ' ' LEU . 18.3 pt -131.08 169.48 21.58 Favored 'Isoleucine or valine' 0 C--O 1.244 0.77 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 172.187 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.619 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -155.22 167.74 29.35 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.22 176.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.402 ' HA ' ' O ' ' A' ' 39' ' ' GLU . 3.8 tt -138.53 115.23 10.65 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 178.127 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.53 ' HA ' ' O ' ' A' ' 64' ' ' SER . 65.1 m -105.33 112.53 25.67 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.567 0.747 . . . . 0.0 109.045 176.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.444 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -126.51 128.26 46.62 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 122.718 0.407 . . . . 0.0 111.641 -176.387 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.75 ' SG ' HD13 ' A' ' 85' ' ' LEU . 20.9 m -125.82 151.15 70.65 Favored Pre-proline 0 N--CA 1.476 0.83 0 C-N-CA 124.24 1.016 . . . . 0.0 109.989 175.516 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -82.15 -0.54 10.32 Favored 'Trans proline' 0 C--N 1.374 1.897 0 C-N-CA 122.757 2.304 . . . . 0.0 112.099 173.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 46.6 ttm -99.4 -62.36 1.25 Allowed 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.307 1.043 . . . . 0.0 110.458 -173.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 179.52 -178.22 48.57 Favored Glycine 0 C--N 1.347 1.168 0 CA-C-N 115.96 -0.564 . . . . 0.0 113.336 -176.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 74.6 mt -82.32 -17.13 46.84 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 -174.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.6 -45.99 91.92 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-N 118.69 0.677 . . . . 0.0 110.998 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 8.0 t-160 -68.88 -36.6 78.28 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.406 -179.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.459 ' HA ' HD11 ' A' ' 85' ' ' LEU . 36.2 p -68.81 -30.31 68.85 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.566 179.643 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.496 ' HA ' ' HB3' ' A' ' 22' ' ' ALA . 19.8 m-85 -77.48 -22.35 51.43 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.467 0.707 . . . . 0.0 111.681 177.048 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 77.6 mtp -66.49 -44.33 82.93 Favored 'General case' 0 N--CA 1.486 1.336 0 CA-C-O 121.322 0.582 . . . . 0.0 109.471 171.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.73 -37.49 70.58 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 114.687 -1.142 . . . . 0.0 111.101 176.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.496 ' HB3' ' HA ' ' A' ' 19' ' ' PHE . . . -70.32 -34.01 72.19 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.437 0.695 . . . . 0.0 110.85 -179.318 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 28.1 tt0 -61.85 -55.37 30.5 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.342 0.657 . . . . 0.0 109.328 173.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.68 -44.37 86.42 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 114.372 -1.286 . . . . 0.0 112.447 -170.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.437 HD11 ' OG ' ' A' ' 64' ' ' SER . 96.2 mt -70.04 -34.77 73.66 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 122.745 0.418 . . . . 0.0 111.323 178.299 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.482 ' O ' HG23 ' A' ' 30' ' ' VAL . 36.8 tt0 -60.49 -55.45 33.3 Favored 'General case' 0 C--N 1.354 0.796 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 178.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 32.7 mm-40 -54.14 -50.2 67.47 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 124.579 1.174 . . . . 0.0 110.886 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.4 -45.1 92.43 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.162 0.985 . . . . 0.0 112.201 -176.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.58 -24.81 61.15 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 178.423 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 26' ' ' GLU . 40.6 t -70.43 -43.04 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 175.582 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -62.63 -34.04 76.24 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 114.588 -1.187 . . . . 0.0 111.064 178.193 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.68 -42.28 95.47 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.478 0.711 . . . . 0.0 111.65 177.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 135.09 -43.96 1.21 Allowed Glycine 0 C--N 1.348 1.207 0 CA-C-N 116.861 -0.154 . . . . 0.0 113.206 174.307 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.639 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -71.6 177.88 3.85 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 -177.266 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.462 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 30.2 tt0 -78.66 154.66 30.0 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 115.083 -0.962 . . . . 0.0 109.505 178.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.474 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 7.1 p -134.94 136.61 51.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 123.226 0.61 . . . . 0.0 110.138 176.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 45.9 tptt -143.69 113.83 7.32 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 175.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.619 HG12 ' HB3' ' A' ' 7' ' ' ALA . 41.5 mt -116.01 109.85 29.6 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 C-N-CA 122.654 0.382 . . . . 0.0 111.844 -174.232 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.402 ' O ' ' HA ' ' A' ' 8' ' ' LEU . 32.7 tt0 -76.08 135.63 39.88 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 172.067 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.401 HG22 ' HB2' ' A' ' 9' ' ' CYS . 12.2 p -118.93 119.04 33.16 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 123.657 0.783 . . . . 0.0 109.65 -177.24 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.471 HE22 ' HB2' ' A' ' 70' ' ' GLU . 40.4 mt-30 -109.65 137.68 47.11 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 123.796 0.838 . . . . 0.0 109.969 179.153 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -164.45 176.31 40.36 Favored Glycine 0 C--O 1.243 0.664 0 N-CA-C 112.136 -0.386 . . . . 0.0 112.136 179.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.72 -19.79 66.03 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.292 0.637 . . . . 0.0 112.034 -179.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -74.56 -40.32 61.73 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.159 0.584 . . . . 0.0 110.876 173.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 156.06 -158.02 28.28 Favored Glycine 0 C--N 1.343 0.97 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.004 -176.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.42 HD12 HH22 ' A' ' 49' ' ' ARG . 74.6 mt -124.12 137.98 55.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 C-N-CA 123.316 0.647 . . . . 0.0 109.769 177.364 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -132.98 152.42 51.95 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.178 0.991 . . . . 0.0 109.636 -178.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.1 t30 63.58 36.82 10.74 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 124.24 1.016 . . . . 0.0 110.238 175.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.42 HH22 HD12 ' A' ' 46' ' ' ILE . 20.2 tpp180 -45.26 122.51 3.47 Favored 'General case' 0 C--N 1.362 1.117 0 C-N-CA 126.088 1.755 . . . . 0.0 112.762 -175.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.427 HD13 HD12 ' A' ' 6' ' ' ILE . 41.1 mt -76.2 147.17 38.59 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.264 172.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 17.1 p -104.86 171.88 7.08 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 175.204 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.7 -29.33 70.58 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 122.664 0.386 . . . . 0.0 111.231 175.065 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -64.94 -46.93 79.55 Favored 'General case' 0 C--N 1.354 0.781 0 O-C-N 123.759 0.662 . . . . 0.0 110.243 176.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -56.25 -46.09 79.78 Favored 'General case' 0 N--CA 1.484 1.267 0 O-C-N 123.928 0.768 . . . . 0.0 111.403 179.02 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.607 HG22 ' HG3' ' A' ' 78' ' ' ARG . 28.6 mt -74.19 -31.49 29.46 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 O-C-N 123.925 0.765 . . . . 0.0 111.121 -174.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.25 -50.02 30.5 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.164 0.585 . . . . 0.0 111.093 178.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -79.95 -9.56 59.69 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.4 0.68 . . . . 0.0 111.652 -176.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.82 103.25 0.42 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.297 0.639 . . . . 0.0 110.538 176.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 30.2 m -61.85 -36.08 80.16 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.656 170.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.497 HG23 HG21 ' A' ' 99' ' ' ILE . 79.8 mt -132.36 141.44 45.26 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.292 179.308 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.422 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 21.9 mt -132.12 140.78 47.07 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 123.856 0.862 . . . . 0.0 108.887 171.634 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.2 mp -126.03 116.65 46.51 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.329 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 173.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . 0.426 ' HE1' ' HA ' ' A' ' 72' ' ' ASN . 5.2 m170 -92.32 86.21 5.64 Favored 'General case' 0 N--CA 1.486 1.334 0 CA-C-O 121.739 0.78 . . . . 0.0 109.834 173.339 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.53 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 22.7 m -82.43 78.91 9.01 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 114.381 -1.282 . . . . 0.0 109.956 178.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.447 HG11 ' HG3' ' A' ' 69' ' ' PRO . 34.2 m -125.35 157.14 34.61 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 CA-C-O 121.858 0.837 . . . . 0.0 111.721 -170.074 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -107.77 -23.3 12.14 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 114.17 -1.377 . . . . 0.0 109.483 178.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 15.8 m -136.86 179.64 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 125.051 1.341 . . . . 0.0 108.757 178.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 86.8 m -69.98 116.02 39.82 Favored Pre-proline 0 CA--C 1.549 0.938 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 172.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.592 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 58.1 Cg_endo -73.31 146.8 40.82 Favored 'Trans proline' 0 C--N 1.373 1.857 0 C-N-CA 122.406 2.07 . . . . 0.0 110.859 175.833 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.471 ' HB2' HE22 ' A' ' 41' ' ' GLN . 14.2 mm-40 -67.36 -23.76 65.63 Favored 'General case' 0 N--CA 1.482 1.175 0 CA-C-O 121.219 0.533 . . . . 0.0 111.338 -175.478 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -101.6 10.06 40.57 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.152 -176.36 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.592 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 8.4 t30 -56.45 -34.83 67.23 Favored 'General case' 0 N--CA 1.495 1.814 0 C-N-CA 123.499 0.72 . . . . 0.0 112.021 179.592 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -57.96 -22.24 48.18 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 125.264 1.425 . . . . 0.0 113.314 179.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 43.1 mtp180 -86.03 -28.51 24.09 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.409 1.083 . . . . 0.0 112.537 -176.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.411 ' HE2' HD13 ' A' ' 50' ' ' LEU . 58.0 m-85 -99.98 -17.77 17.37 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.702 0.801 . . . . 0.0 111.969 -173.249 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -59.08 -29.49 67.38 Favored 'General case' 0 CA--C 1.559 1.292 0 C-N-CA 124.098 0.959 . . . . 0.0 113.282 -168.017 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 14.2 t -85.16 0.41 51.81 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.522 0.729 . . . . 0.0 112.142 -178.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.607 ' HG3' HG22 ' A' ' 55' ' ' ILE . 36.8 mmt180 -114.67 168.53 9.8 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.0 0.92 . . . . 0.0 110.081 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -75.65 86.45 2.7 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-O 121.785 0.802 . . . . 0.0 110.28 -178.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.422 ' HA ' ' HB ' ' A' ' 61' ' ' ILE . 60.2 t -101.56 125.94 55.53 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 CA-C-N 114.619 -1.173 . . . . 0.0 110.109 179.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -98.74 89.53 4.38 Favored 'General case' 0 C--O 1.24 0.592 0 N-CA-C 107.4 -1.333 . . . . 0.0 107.4 174.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -78.86 125.33 29.23 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.051 -177.206 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.454 HD12 ' HB3' ' A' ' 87' ' ' ASP . 46.4 pt -128.62 -174.06 1.1 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.856 0 C-N-CA 124.491 1.116 . . . . 0.0 109.379 177.388 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 23.3 p -84.36 149.3 26.13 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 109.908 -0.405 . . . . 0.0 109.908 166.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.75 HD13 ' SG ' ' A' ' 11' ' ' CYS . 7.6 tt -61.65 -31.03 71.12 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.865 179.209 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -61.51 -42.98 99.61 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 123.403 0.681 . . . . 0.0 110.938 176.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.454 ' HB3' HD12 ' A' ' 83' ' ' ILE . 9.2 t70 -62.8 -31.88 72.96 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.569 0.748 . . . . 0.0 110.913 -179.157 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.54 -14.5 63.05 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.836 0.854 . . . . 0.0 112.906 179.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 47.5 mt -96.76 -56.6 5.07 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 123.662 0.785 . . . . 0.0 109.536 178.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -77.82 -30.37 51.08 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 -173.301 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -118.35 15.25 13.9 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.443 0.697 . . . . 0.0 110.55 -175.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.489 ' HA ' HD12 ' A' ' 95' ' ' ILE . . . -41.97 -57.91 2.26 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 124.49 1.116 . . . . 0.0 113.467 -173.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.82 -41.19 97.48 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.944 179.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -58.93 -44.08 96.34 Favored Glycine 0 C--N 1.35 1.345 0 O-C-N 124.343 1.027 . . . . 0.0 112.339 -179.439 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.489 HD12 ' HA ' ' A' ' 92' ' ' ALA . 22.3 mt -59.42 -58.53 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 C-N-CA 124.144 0.978 . . . . 0.0 110.272 -179.517 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.7 mp -54.37 -51.14 51.72 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 O-C-N 124.175 0.922 . . . . 0.0 110.832 -176.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.48 -29.82 69.36 Favored 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -175.431 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -68.34 -36.55 79.42 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 177.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.497 HG21 HG23 ' A' ' 60' ' ' ILE . 38.3 mt -76.91 -36.45 25.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 -177.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -57.38 -52.58 64.8 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 114.502 -1.226 . . . . 0.0 111.063 177.291 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -71.05 -32.15 68.78 Favored 'General case' 0 CA--C 1.546 0.805 0 O-C-N 123.671 0.607 . . . . 0.0 111.838 -176.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 70.7 mtm -66.06 -53.83 33.46 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 122.837 0.455 . . . . 0.0 110.954 177.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 40.7 mt -67.7 -33.38 61.5 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.837 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.714 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -72.21 -25.36 61.63 Favored 'General case' 0 C--O 1.212 -0.917 0 CA-C-O 119.666 -0.207 . . . . 0.0 111.066 177.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 21.0 t -78.04 -38.76 43.85 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 118.01 0.368 . . . . 0.0 110.88 -178.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -72.32 -37.56 68.89 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 122.354 0.262 . . . . 0.0 111.159 178.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -84.08 -31.15 25.48 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 122.932 0.493 . . . . 0.0 111.355 -177.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 65.9 mm-40 . . . . . 0 C--O 1.25 1.111 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.124 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.6 ttt . . . . . 0 N--CA 1.483 1.215 0 N-CA-C 110.431 -0.211 . . . . 0.0 110.431 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.8 p -65.75 98.67 0.41 Allowed 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 123.233 0.613 . . . . 0.0 111.509 -176.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.561 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 14.6 pttt -91.67 178.49 5.91 Favored 'General case' 0 C--O 1.256 1.395 0 C-N-CA 123.828 0.851 . . . . 0.0 111.192 178.186 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.567 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 3.7 tmtp? -149.64 141.49 23.73 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.126 -172.428 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.476 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.6 tt -128.48 139.05 52.53 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 176.154 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.417 HD12 HD13 ' A' ' 50' ' ' LEU . 16.0 pt -130.14 165.46 30.24 Favored 'Isoleucine or valine' 0 C--O 1.241 0.625 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 168.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.571 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -152.16 169.11 23.24 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 176.304 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.1 tt -140.97 109.69 6.02 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 -178.413 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.565 ' HA ' ' O ' ' A' ' 64' ' ' SER . 66.8 m -101.05 107.61 19.1 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.938 0.895 . . . . 0.0 109.463 176.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -125.9 115.31 19.74 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 122.852 0.461 . . . . 0.0 110.096 -177.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.573 ' SG ' ' HB3' ' A' ' 13' ' ' MET . 25.7 t -123.04 139.06 30.77 Favored Pre-proline 0 N--CA 1.476 0.846 0 C-N-CA 123.034 0.533 . . . . 0.0 110.664 -175.567 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -74.39 -15.9 22.12 Favored 'Trans proline' 0 C--N 1.374 1.911 0 C-N-CA 123.151 2.568 . . . . 0.0 112.848 170.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.573 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 44.2 ttm -69.05 -57.13 5.85 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.557 0.743 . . . . 0.0 110.282 177.779 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 164.85 171.47 31.13 Favored Glycine 0 C--O 1.245 0.812 0 CA-C-N 114.886 -1.052 . . . . 0.0 111.813 -177.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 81.0 mt -67.5 -20.01 65.4 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.246 0.619 . . . . 0.0 111.941 178.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -57.06 -45.35 83.32 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-O 121.047 0.451 . . . . 0.0 110.996 175.361 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 7.7 t-160 -73.01 -36.06 66.93 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.432 -178.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.433 ' HA ' HD11 ' A' ' 85' ' ' LEU . 37.4 p -64.41 -37.79 88.77 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.563 179.505 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.404 ' HA ' ' HB3' ' A' ' 22' ' ' ALA . 21.4 m-85 -75.18 -23.42 57.72 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.416 0.687 . . . . 0.0 111.926 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 83.8 mtp -61.32 -48.45 81.3 Favored 'General case' 0 N--CA 1.484 1.262 0 CA-C-O 121.173 0.511 . . . . 0.0 110.064 169.088 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.89 -38.91 73.05 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.951 178.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.404 ' HB3' ' HA ' ' A' ' 19' ' ' PHE . . . -68.48 -39.83 81.18 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.934 0.893 . . . . 0.0 111.225 -176.606 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.452 ' O ' ' HG3' ' A' ' 27' ' ' GLU . 16.2 tt0 -65.37 -50.35 65.89 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 123.482 0.489 . . . . 0.0 110.241 176.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.87 -48.98 79.35 Favored 'General case' 0 CA--C 1.551 1.013 0 O-C-N 123.829 0.705 . . . . 0.0 112.213 -174.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 73.4 mt -64.84 -37.07 86.4 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 122.97 0.508 . . . . 0.0 111.587 177.221 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.482 ' O ' HG23 ' A' ' 30' ' ' VAL . 41.3 tt0 -59.88 -55.23 36.79 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 123.35 0.406 . . . . 0.0 110.25 -179.039 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.534 ' O ' ' HG3' ' A' ' 31' ' ' GLU . 44.6 mt-10 -52.84 -53.11 53.49 Favored 'General case' 0 N--CA 1.475 0.825 0 O-C-N 124.616 1.198 . . . . 0.0 111.159 -179.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -62.01 -37.48 85.02 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.721 -176.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.56 -24.11 49.91 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.164 0.585 . . . . 0.0 112.503 179.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 26' ' ' GLU . 40.6 t -64.14 -43.87 97.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 172.748 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.534 ' HG3' ' O ' ' A' ' 27' ' ' GLU . 25.9 mt-10 -80.13 -20.78 44.16 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 113.506 -1.679 . . . . 0.0 111.643 -176.086 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.65 -16.54 62.27 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.373 0.669 . . . . 0.0 111.221 174.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 116.11 -19.01 13.79 Favored Glycine 0 C--N 1.354 1.579 0 N-CA-C 114.53 0.572 . . . . 0.0 114.53 167.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.561 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -106.02 -179.58 3.98 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 113.323 0.861 . . . . 0.0 113.323 -173.481 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.567 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 10.8 tp10 -75.77 150.27 37.81 Favored 'General case' 0 C--N 1.355 0.812 0 CA-C-N 114.479 -1.237 . . . . 0.0 109.021 175.419 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.476 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 7.1 p -137.4 132.94 46.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 122.921 0.489 . . . . 0.0 110.238 177.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 48.2 tptt -142.11 112.82 7.3 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 179.132 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.571 HG12 ' HB3' ' A' ' 7' ' ' ALA . 45.5 mt -118.6 111.08 32.3 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 -173.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -75.55 139.68 42.27 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.829 0.851 . . . . 0.0 109.74 174.007 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.408 HG22 ' HB2' ' A' ' 9' ' ' CYS . 17.0 p -123.1 111.68 16.83 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.881 0.872 . . . . 0.0 109.463 -178.293 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.471 HE22 ' HB2' ' A' ' 70' ' ' GLU . 41.9 mt-30 -105.74 146.38 29.87 Favored 'General case' 0 C--O 1.243 0.744 0 CA-C-O 121.174 0.511 . . . . 0.0 111.376 -177.428 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -169.78 169.24 41.97 Favored Glycine 0 C--N 1.342 0.866 0 CA-C-N 114.917 -1.038 . . . . 0.0 111.752 175.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.94 -24.76 67.85 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.556 0.743 . . . . 0.0 111.741 -179.573 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -72.42 -39.93 67.5 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.201 0.6 . . . . 0.0 110.603 174.659 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 163.93 -173.73 40.0 Favored Glycine 0 C--N 1.344 1.027 0 CA-C-N 116.214 -0.448 . . . . 0.0 113.333 -179.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 78.2 mt -122.63 134.82 64.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.215 1.006 . . . . 0.0 108.836 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -128.89 152.76 48.18 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.931 0.892 . . . . 0.0 109.628 -179.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 10.3 t30 60.21 40.45 18.03 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 124.364 1.066 . . . . 0.0 109.977 176.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 17.4 tpp180 -47.58 124.54 7.18 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 125.854 1.662 . . . . 0.0 113.118 -175.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.417 HD13 HD12 ' A' ' 6' ' ' ILE . 55.0 mt -77.81 132.91 38.26 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.318 1.047 . . . . 0.0 110.6 173.3 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 43.0 p -96.68 169.77 9.65 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.721 177.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.09 -34.89 70.66 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 122.904 0.482 . . . . 0.0 111.204 175.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 19.9 tt0 -65.23 -46.74 79.38 Favored 'General case' 0 C--N 1.352 0.716 0 O-C-N 123.717 0.636 . . . . 0.0 110.463 178.117 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -53.66 -44.79 69.94 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 123.362 0.665 . . . . 0.0 111.71 179.267 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 45.8 mt -71.74 -32.73 46.11 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.94 0 O-C-N 124.302 1.002 . . . . 0.0 110.935 -177.47 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.35 -41.55 69.62 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.467 0.707 . . . . 0.0 111.42 178.02 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -72.3 -32.38 66.52 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.99 0.916 . . . . 0.0 111.003 179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.73 102.56 0.07 Allowed 'General case' 0 N--CA 1.471 0.622 0 O-C-N 124.568 1.168 . . . . 0.0 112.587 -173.056 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 26.9 m -61.88 -38.59 88.87 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 124.049 0.94 . . . . 0.0 109.429 168.043 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.452 HG23 HG21 ' A' ' 99' ' ' ILE . 70.6 mt -128.44 139.78 50.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.092 -178.44 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.407 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 25.9 mt -131.21 133.49 62.38 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.286 0 C-N-CA 123.821 0.848 . . . . 0.0 108.919 171.401 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.1 mp -121.9 112.5 35.18 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.339 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 174.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . 0.511 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 9.4 m170 -86.48 86.04 7.33 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-O 121.678 0.751 . . . . 0.0 109.15 173.42 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.565 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 15.0 m -81.25 78.98 7.99 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 114.074 -1.421 . . . . 0.0 109.222 177.452 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 35.3 m -127.5 157.98 39.04 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-O 121.688 0.756 . . . . 0.0 111.537 -169.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -117.11 -10.38 10.87 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.524 1.13 . . . . 0.0 109.418 175.164 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 4.0 m -141.84 162.3 20.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 125.699 1.6 . . . . 0.0 108.498 173.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 47.0 m -61.83 114.93 12.76 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 123.286 0.634 . . . . 0.0 110.162 175.62 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.547 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 69.1 Cg_endo -70.53 151.54 64.75 Favored 'Trans proline' 0 C--N 1.377 2.055 0 C-N-CA 122.241 1.961 . . . . 0.0 110.87 178.083 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.471 ' HB2' HE22 ' A' ' 41' ' ' GLN . 11.6 mm-40 -67.57 -45.49 75.45 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-O 121.216 0.531 . . . . 0.0 111.107 -172.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -89.64 14.4 11.74 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.746 0.818 . . . . 0.0 112.305 -169.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.547 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 5.2 p30 -55.47 -27.35 47.77 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 124.83 1.252 . . . . 0.0 112.817 -176.313 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -56.89 -33.6 67.06 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.958 1.303 . . . . 0.0 113.03 -177.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -72.58 -38.15 67.97 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.929 0.892 . . . . 0.0 110.812 -175.515 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -77.09 -12.78 59.99 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 114.447 -1.251 . . . . 0.0 111.456 -174.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -54.48 -33.28 59.44 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 124.663 1.185 . . . . 0.0 112.352 178.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 73.5 p -73.83 -19.42 60.74 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 -177.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 40.6 mmt180 -115.46 170.25 8.55 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.756 0.822 . . . . 0.0 111.803 -170.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -76.9 93.94 3.84 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.412 0.685 . . . . 0.0 110.177 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.407 ' HA ' ' HB ' ' A' ' 61' ' ' ILE . 48.3 t -99.0 139.76 20.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.25 177.818 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -116.5 91.14 3.5 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 179.382 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.511 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 49.1 mt-10 -81.14 123.93 28.82 Favored 'General case' 0 C--N 1.35 0.623 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.756 -175.569 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.633 HD12 ' HB3' ' A' ' 87' ' ' ASP . 45.5 pt -131.33 179.57 4.22 Favored 'Isoleucine or valine' 0 C--O 1.248 1.02 0 C-N-CA 125.112 1.365 . . . . 0.0 108.764 178.227 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 3.2 m -80.34 151.59 29.4 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 109.138 -0.689 . . . . 0.0 109.138 167.06 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.545 HD13 ' HB2' ' A' ' 11' ' ' CYS . 7.8 tt -62.86 -29.95 71.13 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.18 0.592 . . . . 0.0 111.591 -178.019 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.536 ' HG2' ' HE2' ' A' ' 90' ' ' LYS . 34.5 tt0 -64.83 -37.01 86.18 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.095 0.558 . . . . 0.0 111.397 179.133 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.633 ' HB3' HD12 ' A' ' 83' ' ' ILE . 5.3 t70 -61.88 -34.06 75.32 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.881 0.872 . . . . 0.0 110.366 -179.411 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -72.23 -11.63 60.81 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.883 0.873 . . . . 0.0 113.017 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 84.2 mt -96.43 -53.0 8.59 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 123.641 0.776 . . . . 0.0 109.723 178.27 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.536 ' HE2' ' HG2' ' A' ' 86' ' ' GLN . 0.2 OUTLIER -72.97 -42.46 63.31 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.456 0.702 . . . . 0.0 111.834 -176.453 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -117.81 26.67 9.52 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.343 1.057 . . . . 0.0 110.098 -167.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.49 -58.89 3.68 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.667 0.787 . . . . 0.0 112.956 -174.393 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -64.66 -33.92 77.08 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.103 177.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.44 ' O ' ' HG2' ' A' ' 98' ' ' GLU . . . -60.5 -52.24 53.8 Favored Glycine 0 C--N 1.354 1.579 0 O-C-N 124.474 1.109 . . . . 0.0 112.269 -178.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 22.1 mt -55.73 -53.8 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 124.653 1.181 . . . . 0.0 109.933 -179.143 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 88.8 mt -57.05 -51.34 70.24 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.954 0 CA-C-N 114.47 -1.241 . . . . 0.0 111.638 -177.074 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.03 -30.44 69.66 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -178.355 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' A' ' 94' ' ' GLY . 31.2 mm-40 -63.15 -41.35 99.26 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.4 0.68 . . . . 0.0 109.751 177.107 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.452 HG21 HG23 ' A' ' 60' ' ' ILE . 58.5 mt -76.23 -35.25 27.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 -177.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -60.77 -48.14 83.14 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.024 0.93 . . . . 0.0 111.516 178.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -70.25 -36.85 74.75 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.952 -179.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 62.3 mtm -69.4 -52.01 31.02 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.905 0.482 . . . . 0.0 111.645 -178.033 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 20.0 mt -59.89 -49.08 85.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 O-C-N 123.677 0.611 . . . . 0.0 110.43 178.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.34 -28.21 69.85 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -178.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 32.8 t -81.4 -35.57 30.58 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 122.789 0.435 . . . . 0.0 111.551 -178.056 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -81.7 -30.27 32.64 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 122.368 0.267 . . . . 0.0 111.48 -178.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -76.45 -46.53 26.56 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 122.474 0.309 . . . . 0.0 110.457 178.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 86.9 mm-40 . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.877 -0.583 . . . . 0.0 110.316 179.605 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.0 tmm? . . . . . 0 N--CA 1.482 1.145 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 44.0 p -73.49 84.8 1.52 Allowed 'General case' 0 CA--C 1.548 0.889 0 CA-C-O 121.357 0.599 . . . . 0.0 111.184 -177.365 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 48.7 pttt -86.16 159.6 19.46 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.642 0.777 . . . . 0.0 110.249 177.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.574 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.7 tmtp? -145.34 132.85 20.81 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 -169.261 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.521 HD11 HG13 ' A' ' 96' ' ' ILE . 10.4 tt -121.23 135.16 55.18 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 107.705 -1.22 . . . . 0.0 107.705 176.145 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.57 HD12 HD13 ' A' ' 50' ' ' LEU . 15.9 pt -127.92 161.27 36.33 Favored 'Isoleucine or valine' 0 C--O 1.242 0.705 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 174.75 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.598 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -152.62 167.54 28.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.12 178.654 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.544 HD21 ' HG3' ' A' ' 41' ' ' GLN . 2.5 tt -140.73 114.97 9.26 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 -178.344 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.546 ' HA ' ' O ' ' A' ' 64' ' ' SER . 56.2 m -107.08 113.14 26.42 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.817 0.847 . . . . 0.0 108.973 176.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -128.87 123.89 33.84 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 122.596 0.358 . . . . 0.0 111.225 -177.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.76 ' SG ' HD13 ' A' ' 85' ' ' LEU . 1.2 m -133.55 149.77 73.09 Favored Pre-proline 0 N--CA 1.479 0.996 0 C-N-CA 124.022 0.929 . . . . 0.0 110.362 177.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -79.52 -11.86 14.12 Favored 'Trans proline' 0 C--N 1.375 1.928 0 C-N-CA 122.596 2.197 . . . . 0.0 112.013 176.657 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 21.8 mmt -73.33 -50.61 21.16 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.309 1.043 . . . . 0.0 110.348 -176.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 158.66 -175.18 35.75 Favored Glycine 0 C--N 1.346 1.105 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.107 -179.287 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 74.3 mt -78.6 -16.47 57.34 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.111 0.564 . . . . 0.0 112.357 -176.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -57.69 -51.52 69.21 Favored 'General case' 0 C--O 1.25 1.088 0 CA-C-O 121.29 0.567 . . . . 0.0 111.309 177.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.438 ' ND1' HD22 ' A' ' 85' ' ' LEU . 4.3 t-80 -67.06 -38.54 85.97 Favored 'General case' 0 C--O 1.248 1.017 0 CA-C-N 114.866 -1.061 . . . . 0.0 110.213 -176.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 44.8 p -67.98 -35.68 78.76 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.968 -178.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -70.59 -26.77 63.67 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 122.839 0.455 . . . . 0.0 111.789 178.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 38.1 mtm -68.56 -43.06 77.41 Favored 'General case' 0 N--CA 1.484 1.233 0 CA-C-N 117.717 0.235 . . . . 0.0 110.603 174.009 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.91 -41.94 95.16 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.768 174.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.73 -43.8 98.14 Favored 'General case' 0 C--O 1.216 -0.705 0 CA-C-N 115.201 -0.909 . . . . 0.0 110.743 179.005 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.438 ' O ' ' HG3' ' A' ' 27' ' ' GLU . 9.0 tp-100 -62.71 -44.47 96.14 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.245 0.618 . . . . 0.0 110.816 -178.316 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.535 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -68.02 -49.18 63.1 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.65 -175.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 98.6 mt -64.24 -31.21 72.32 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.241 0.616 . . . . 0.0 111.694 177.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.507 ' O ' HG23 ' A' ' 30' ' ' VAL . 30.7 tt0 -63.09 -56.41 17.14 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.632 0.773 . . . . 0.0 110.17 179.113 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.438 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 49.7 mt-10 -55.05 -46.73 75.37 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 124.187 0.929 . . . . 0.0 110.657 -179.525 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.24 -51.01 71.54 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.322 1.049 . . . . 0.0 111.625 -178.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.14 -22.73 65.77 Favored 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 113.788 1.032 . . . . 0.0 113.788 178.053 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.507 HG23 ' O ' ' A' ' 26' ' ' GLU . 52.1 t -76.56 -43.66 34.87 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 178.748 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -68.45 -26.73 65.65 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 114.831 -1.077 . . . . 0.0 110.354 176.465 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.401 ' HB1' ' HE1' ' A' ' 34' ' ' TYR . . . -76.52 -26.48 55.26 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.211 1.004 . . . . 0.0 111.636 176.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 102.75 15.03 25.63 Favored Glycine 0 C--N 1.349 1.277 0 N-CA-C 114.654 0.622 . . . . 0.0 114.654 168.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.401 ' HE1' ' HB1' ' A' ' 32' ' ' ALA . 1.7 m-85 -95.54 162.54 13.59 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-N 117.844 0.822 . . . . 0.0 109.549 176.028 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.574 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 43.4 tt0 -74.0 126.19 29.94 Favored 'General case' 0 C--O 1.222 -0.373 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 160.732 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.48 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 12.5 p -115.11 132.66 63.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-N 118.772 0.715 . . . . 0.0 111.093 -172.68 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 49.3 tptt -142.33 117.55 10.12 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 179.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.598 HG12 ' HB3' ' A' ' 7' ' ' ALA . 55.9 mt -121.1 112.02 33.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -174.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.467 ' HG3' ' HA ' ' A' ' 49' ' ' ARG . 41.9 tt0 -71.09 138.91 50.13 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.249 1.02 . . . . 0.0 109.176 172.882 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 7.0 p -128.52 122.1 30.34 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 123.895 0.878 . . . . 0.0 108.911 -177.764 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.544 ' HG3' HD21 ' A' ' 8' ' ' LEU . 2.5 mt-30 -122.04 151.75 40.51 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.622 0.725 . . . . 0.0 111.675 -176.218 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -161.31 173.1 37.68 Favored Glycine 0 C--O 1.241 0.554 0 CA-C-N 114.086 -1.415 . . . . 0.0 110.239 172.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.02 -16.45 63.72 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 122.919 0.487 . . . . 0.0 110.993 176.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -75.7 -34.82 60.43 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 123.821 0.848 . . . . 0.0 110.674 172.067 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 154.26 -176.99 31.91 Favored Glycine 0 C--N 1.348 1.198 0 CA-C-N 116.348 -0.387 . . . . 0.0 113.163 178.292 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.492 HG23 ' HG2' ' A' ' 41' ' ' GLN . 44.1 mt -108.73 156.15 9.44 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 124.434 1.094 . . . . 0.0 109.677 -178.187 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -151.2 149.61 29.63 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.821 0.848 . . . . 0.0 109.514 178.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.6 t30 60.4 34.68 20.6 Favored 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 124.135 0.974 . . . . 0.0 110.623 173.079 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.467 ' HA ' ' HG3' ' A' ' 39' ' ' GLU . 23.8 ttp180 -63.2 138.64 58.61 Favored 'General case' 0 C--N 1.351 0.652 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 -168.256 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.57 HD13 HD12 ' A' ' 6' ' ' ILE . 57.8 mt -80.4 121.55 25.86 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 113.747 -1.57 . . . . 0.0 111.504 -177.833 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 43.8 p -87.62 166.92 14.35 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 114.675 -1.148 . . . . 0.0 110.229 -177.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -53.13 -34.03 54.95 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.636 0.774 . . . . 0.0 111.898 179.056 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -68.28 -48.19 65.67 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 123.906 0.754 . . . . 0.0 111.271 178.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -58.85 -41.88 88.04 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.398 0.679 . . . . 0.0 111.236 -178.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.5 HG22 ' HG3' ' A' ' 78' ' ' ARG . 41.1 mt -76.09 -35.39 28.63 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.299 -173.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.82 -43.81 62.23 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.23 0.612 . . . . 0.0 111.181 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -85.44 -1.31 56.9 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.436 0.694 . . . . 0.0 111.985 -177.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.98 110.2 4.33 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.034 0.534 . . . . 0.0 111.202 178.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 16.4 m -61.55 -36.0 79.35 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 124.299 1.04 . . . . 0.0 110.082 167.012 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.535 HG23 HG21 ' A' ' 99' ' ' ILE . 55.6 mt -135.26 143.13 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 C-N-CA 123.885 0.874 . . . . 0.0 110.416 -179.381 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 23.0 mt -135.17 123.49 39.67 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 123.776 0.83 . . . . 0.0 109.165 173.608 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.2 mp -111.65 140.61 30.31 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.332 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 173.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . 0.541 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 6.9 m170 -114.36 84.89 2.13 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 168.473 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.546 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 15.9 m -81.39 81.98 7.36 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 114.821 -1.081 . . . . 0.0 109.483 176.002 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 30.2 m -125.33 162.72 27.49 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-O 121.782 0.801 . . . . 0.0 112.114 -171.724 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -114.98 -28.35 7.05 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 114.029 -1.441 . . . . 0.0 108.776 173.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 22.8 m -137.11 168.6 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 125.371 1.469 . . . . 0.0 108.955 178.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 62.1 m -66.42 119.28 61.24 Favored Pre-proline 0 CA--C 1.551 1.013 0 C-N-CA 123.191 0.597 . . . . 0.0 111.02 179.615 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.5 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 57.9 Cg_endo -72.68 146.3 43.1 Favored 'Trans proline' 0 C--N 1.371 1.718 0 C-N-CA 122.406 2.07 . . . . 0.0 111.12 170.285 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.451 ' H ' ' NE2' ' A' ' 41' ' ' GLN . 28.1 mm-40 -64.77 -31.98 73.46 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 123.12 0.568 . . . . 0.0 111.826 -175.102 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -102.81 25.6 9.06 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.461 0.704 . . . . 0.0 111.731 -177.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.5 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 5.8 p30 -60.89 -27.65 68.31 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.088 0.555 . . . . 0.0 110.726 174.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -59.94 -27.28 66.66 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 125.19 1.396 . . . . 0.0 112.985 177.344 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 81.6 mtt180 -68.59 -21.01 64.54 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.285 0.634 . . . . 0.0 111.85 178.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.468 ' HB3' HG21 ' A' ' 80' ' ' VAL . 32.3 m-85 -111.31 7.26 20.96 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.371 1.069 . . . . 0.0 111.236 -174.593 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -53.56 -47.61 69.89 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.761 1.224 . . . . 0.0 113.279 -172.392 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 94.4 p -101.55 4.2 40.81 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.277 0.631 . . . . 0.0 112.348 -174.005 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.5 ' HG3' HG22 ' A' ' 55' ' ' ILE . 29.8 mmt180 -101.65 162.67 12.73 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 122.685 0.394 . . . . 0.0 111.062 -174.216 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -76.7 91.37 3.45 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.357 0.663 . . . . 0.0 110.644 -177.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.468 HG21 ' HB3' ' A' ' 75' ' ' PHE . 31.3 t -109.78 148.96 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 123.815 0.846 . . . . 0.0 110.724 -175.873 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -121.24 89.85 3.21 Favored 'General case' 0 C--N 1.348 0.509 0 C-N-CA 124.448 1.099 . . . . 0.0 108.706 -178.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.541 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 41.9 mt-10 -79.07 122.49 26.28 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.372 -175.082 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.44 HG13 ' HA ' ' A' ' 64' ' ' SER . 46.1 pt -135.69 -176.55 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.85 0 C-N-CA 124.962 1.305 . . . . 0.0 108.954 178.254 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 23.8 p -81.4 152.48 27.42 Favored 'General case' 0 C--O 1.239 0.542 0 CA-C-O 120.878 0.37 . . . . 0.0 110.211 170.244 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.76 HD13 ' SG ' ' A' ' 11' ' ' CYS . 6.3 tt -63.86 -29.82 70.97 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.064 175.716 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -63.9 -44.75 92.05 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.85 176.039 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -60.63 -32.12 71.29 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 122.921 0.488 . . . . 0.0 110.973 -177.615 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.11 -35.87 81.66 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.05 0.94 . . . . 0.0 112.748 178.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 59.5 mt -76.41 -38.11 31.96 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 O-C-N 123.648 0.593 . . . . 0.0 110.621 -176.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.21 -56.94 3.11 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 122.894 0.478 . . . . 0.0 112.069 -177.675 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -98.21 29.78 3.4 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.11 0.964 . . . . 0.0 110.651 -169.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.535 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -43.74 -63.08 0.91 Allowed 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.35 1.06 . . . . 0.0 113.316 -176.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.96 -34.04 75.39 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.357 -179.53 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.444 ' O ' ' HG2' ' A' ' 98' ' ' GLU . . . -63.83 -47.48 85.77 Favored Glycine 0 C--N 1.353 1.52 0 O-C-N 124.127 0.892 . . . . 0.0 112.613 -179.321 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 19.1 mt -61.7 -53.54 46.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 123.947 0.899 . . . . 0.0 110.461 -177.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.521 HG13 HD11 ' A' ' 5' ' ' LEU . 1.9 mp -55.78 -51.04 64.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 O-C-N 124.015 0.822 . . . . 0.0 110.439 -178.615 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.72 -28.29 67.53 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 123.565 0.54 . . . . 0.0 111.781 -176.074 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 94' ' ' GLY . 63.6 mm-40 -62.0 -37.17 83.83 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.304 0.642 . . . . 0.0 109.857 174.34 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.535 HG21 HG23 ' A' ' 60' ' ' ILE . 33.7 mt -79.75 -37.84 18.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.622 -178.413 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.475 ' HG3' ' O ' ' A' ' 96' ' ' ILE . 32.2 mt-10 -60.17 -41.44 92.84 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.276 0.631 . . . . 0.0 110.974 178.191 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -74.55 -31.95 62.27 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 123.406 0.441 . . . . 0.0 110.988 -178.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 67.7 mtm -66.1 -37.95 87.02 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 122.562 0.345 . . . . 0.0 111.07 172.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.432 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 45.1 mt -69.89 -40.63 79.05 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.855 0 C-N-CA 123.161 0.584 . . . . 0.0 109.555 175.439 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.12 -18.61 64.68 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.503 0.721 . . . . 0.0 111.212 177.159 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 33.3 t -86.61 -41.48 14.23 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.421 0.688 . . . . 0.0 110.849 179.052 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.432 ' HG2' ' HA ' ' A' ' 103' ' ' ILE . 18.6 pt-20 -77.26 -28.4 53.54 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 122.828 0.451 . . . . 0.0 111.504 -176.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 79.1 mm-40 -87.99 -36.83 16.82 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 122.923 0.489 . . . . 0.0 111.044 -179.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 85.0 mm-40 . . . . . 0 N--CA 1.478 0.951 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 176.436 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.6 mtt . . . . . 0 N--CA 1.48 1.07 0 N-CA-C 110.484 -0.191 . . . . 0.0 110.484 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.8 t -64.08 99.6 0.27 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.789 0.836 . . . . 0.0 111.131 -177.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.583 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 17.1 pttt -106.08 176.73 5.07 Favored 'General case' 0 C--O 1.251 1.178 0 C-N-CA 123.514 0.726 . . . . 0.0 111.271 177.343 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.574 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.0 tmtp? -147.53 146.01 29.3 Favored 'General case' 0 CA--C 1.55 0.944 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.257 -172.104 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.426 ' N ' ' HD3' ' A' ' 4' ' ' LYS . 8.5 tt -132.8 135.74 45.86 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.608 1.163 . . . . 0.0 108.116 176.116 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 20.4 pt -125.51 162.8 27.77 Favored 'Isoleucine or valine' 0 C--O 1.242 0.682 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 170.134 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.579 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -150.81 170.54 19.01 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 122.986 0.514 . . . . 0.0 110.028 177.184 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.7 tt -143.91 121.92 12.1 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 107.489 -1.301 . . . . 0.0 107.489 -178.114 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.554 ' HA ' ' O ' ' A' ' 64' ' ' SER . 64.0 m -114.8 113.62 24.48 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.874 0.87 . . . . 0.0 108.984 178.274 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.417 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -126.88 117.83 23.38 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 -174.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.772 ' SG ' HD13 ' A' ' 85' ' ' LEU . 71.5 m -118.33 144.59 35.39 Favored Pre-proline 0 N--CA 1.481 1.095 0 C-N-CA 124.687 1.195 . . . . 0.0 110.039 176.5 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -80.81 -8.99 13.32 Favored 'Trans proline' 0 C--N 1.368 1.597 0 C-N-CA 122.658 2.239 . . . . 0.0 112.671 172.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 53.5 tpp -78.71 -66.7 0.83 Allowed 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.559 0.743 . . . . 0.0 109.873 176.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 179.92 -172.84 44.47 Favored Glycine 0 C--N 1.342 0.885 0 CA-C-N 115.569 -0.741 . . . . 0.0 112.24 -176.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 89.5 mt -82.39 -13.64 56.51 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.231 0.826 . . . . 0.0 113.231 -174.399 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.08 -49.92 75.24 Favored 'General case' 0 CA--C 1.556 1.207 0 CA-C-O 121.098 0.475 . . . . 0.0 112.163 -179.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.464 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 10.0 t-160 -67.88 -39.44 83.69 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.103 -178.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 30.9 p -65.56 -32.41 73.99 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.053 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 14.7 m-30 -73.76 -30.43 62.78 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.484 0.714 . . . . 0.0 112.109 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 67.8 mtm -70.18 -36.48 74.68 Favored 'General case' 0 N--CA 1.487 1.423 0 CA-C-O 120.674 0.274 . . . . 0.0 110.452 173.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.26 -38.13 75.07 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.754 173.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.84 -42.5 81.34 Favored 'General case' 0 C--O 1.214 -0.768 0 C-N-CA 123.735 0.814 . . . . 0.0 110.575 -179.157 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.468 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 20.2 tp60 -64.79 -44.49 89.8 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 122.949 0.499 . . . . 0.0 109.875 177.672 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.625 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -62.45 -51.79 66.1 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.836 -176.295 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 98.5 mt -67.48 -29.98 69.57 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.581 0.752 . . . . 0.0 111.511 178.402 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.504 ' HA ' HG21 ' A' ' 36' ' ' VAL . 32.1 tt0 -60.36 -58.54 8.07 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 123.713 0.633 . . . . 0.0 109.432 176.377 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 23' ' ' GLN . 12.1 mm-40 -51.31 -50.35 59.53 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 124.746 1.279 . . . . 0.0 110.736 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.82 -49.73 72.47 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.596 1.159 . . . . 0.0 112.153 -179.359 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.53 -29.83 70.52 Favored 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 176.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.5 HG23 ' O ' ' A' ' 26' ' ' GLU . 53.2 t -72.45 -36.65 55.17 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -179.54 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 14.1 mm-40 -71.37 -31.43 67.3 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.466 1.106 . . . . 0.0 110.801 177.549 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.77 -23.23 60.79 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.749 0.819 . . . . 0.0 111.616 175.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.13 23.21 27.86 Favored Glycine 0 C--N 1.348 1.2 0 N-CA-C 114.953 0.741 . . . . 0.0 114.953 166.003 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.583 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -118.29 178.03 4.59 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.294 0.638 . . . . 0.0 110.889 169.821 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.574 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 43.0 tt0 -74.51 147.47 41.83 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.432 178.124 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.504 HG21 ' HA ' ' A' ' 26' ' ' GLU . 15.0 p -127.12 139.33 52.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 122.756 0.422 . . . . 0.0 110.176 178.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.2 tptt -145.96 110.04 4.94 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 173.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.579 HG12 ' HB3' ' A' ' 7' ' ' ALA . 47.3 mt -115.07 111.33 35.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 C-N-CA 122.734 0.413 . . . . 0.0 111.338 -176.68 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.46 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 32.7 tt0 -73.51 145.66 45.44 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.448 0.699 . . . . 0.0 109.195 169.415 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.431 HG22 ' HB2' ' A' ' 9' ' ' CYS . 13.3 p -129.69 113.96 15.41 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 123.699 0.799 . . . . 0.0 108.877 -179.839 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.49 HE22 ' HB2' ' A' ' 70' ' ' GLU . 45.2 mt-30 -105.21 143.64 33.11 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.264 0.626 . . . . 0.0 110.223 179.441 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.409 ' HA2' ' O ' ' A' ' 11' ' ' CYS . . . -162.17 163.05 34.7 Favored Glycine 0 C--N 1.336 0.544 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.928 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.51 -23.61 67.47 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.186 0.595 . . . . 0.0 110.924 173.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -73.52 -35.06 65.53 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 124.431 1.092 . . . . 0.0 111.278 175.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 160.4 -174.46 37.12 Favored Glycine 0 C--N 1.347 1.174 0 CA-C-N 116.135 -0.484 . . . . 0.0 112.332 -178.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 76.7 mt -123.36 134.9 64.95 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 123.439 0.696 . . . . 0.0 109.153 174.471 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -127.77 149.99 50.01 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.313 1.045 . . . . 0.0 109.675 -178.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 6.8 t30 61.7 40.13 13.5 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 124.504 1.122 . . . . 0.0 110.58 173.332 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 16.1 tpp180 -47.81 122.59 5.11 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 125.576 1.55 . . . . 0.0 112.603 -176.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.46 ' HG ' ' HB2' ' A' ' 39' ' ' GLU . 42.4 mt -69.39 133.6 47.99 Favored 'General case' 0 C--O 1.241 0.657 0 C-N-CA 124.419 1.088 . . . . 0.0 111.032 174.712 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 44.8 p -91.7 163.37 14.11 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 115.113 -0.948 . . . . 0.0 109.085 175.006 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.33 -26.46 66.59 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 122.527 0.331 . . . . 0.0 110.895 173.501 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.462 HE21 ' HG3' ' A' ' 57' ' ' GLU . 23.2 tp60 -70.0 -43.34 71.59 Favored 'General case' 0 C--N 1.355 0.834 0 C-N-CA 123.788 0.835 . . . . 0.0 110.634 177.039 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 45.0 m-20 -58.18 -43.21 87.39 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 122.807 0.443 . . . . 0.0 110.677 176.24 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.401 HG22 ' HG3' ' A' ' 78' ' ' ARG . 22.9 mt -70.24 -27.76 33.2 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 O-C-N 123.986 0.804 . . . . 0.0 110.614 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.47 -40.51 42.85 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.916 0.886 . . . . 0.0 111.817 179.541 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.462 ' HG3' HE21 ' A' ' 53' ' ' GLN . 46.6 mt-10 -74.4 -32.0 62.54 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.903 0.881 . . . . 0.0 111.117 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -52.75 99.37 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.658 0 O-C-N 124.747 1.279 . . . . 0.0 113.099 -171.177 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 26.1 m -62.42 -34.5 76.87 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 123.551 0.741 . . . . 0.0 109.163 167.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.488 HG23 HG21 ' A' ' 99' ' ' ILE . 76.7 mt -132.33 140.54 47.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.397 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.408 ' HB ' ' HA ' ' A' ' 80' ' ' VAL . 21.8 mt -130.38 139.06 52.3 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 172.072 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -126.81 128.95 71.38 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 173.631 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 13.5 m170 -103.54 86.97 2.73 Favored 'General case' 0 N--CA 1.489 1.49 0 CA-C-N 118.853 0.751 . . . . 0.0 109.486 169.457 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.554 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 19.6 m -82.86 82.4 8.17 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 124.653 1.181 . . . . 0.0 109.631 175.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 26.9 m -127.8 163.88 30.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-O 121.643 0.735 . . . . 0.0 111.719 -169.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -117.73 -14.9 10.15 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 114.322 -1.308 . . . . 0.0 109.594 174.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 15.2 m -132.07 177.99 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 125.283 1.433 . . . . 0.0 109.359 178.356 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 81.1 m -72.76 114.89 34.5 Favored Pre-proline 0 CA--C 1.545 0.767 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 167.235 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.607 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 33.3 Cg_endo -68.94 146.65 65.99 Favored 'Trans proline' 0 C--N 1.374 1.908 0 C-N-CA 121.788 1.659 . . . . 0.0 110.574 174.747 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.49 ' HB2' HE22 ' A' ' 41' ' ' GLN . 20.1 mm-40 -65.13 -33.7 76.65 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-O 121.387 0.613 . . . . 0.0 111.142 -172.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -96.85 9.8 40.81 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.778 -174.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.607 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 8.5 t30 -55.28 -34.98 64.57 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 124.112 0.965 . . . . 0.0 112.016 179.016 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -59.55 -22.91 62.37 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 124.993 1.317 . . . . 0.0 113.444 177.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 29.3 mtp180 -87.13 -18.71 29.82 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.877 0.871 . . . . 0.0 111.103 -178.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.442 ' HB3' HG21 ' A' ' 80' ' ' VAL . 70.6 m-85 -102.56 7.71 39.99 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 124.191 0.996 . . . . 0.0 110.745 178.31 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.8 tp10 -57.48 -51.01 71.17 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 124.696 1.198 . . . . 0.0 112.453 -172.371 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 56.6 p -86.94 -10.55 52.99 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.226 0.61 . . . . 0.0 112.145 -177.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.401 ' HG3' HG22 ' A' ' 55' ' ' ILE . 26.6 mmt180 -89.72 157.3 18.03 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.59 0.756 . . . . 0.0 110.998 -177.109 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -78.28 95.73 5.09 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.491 0.716 . . . . 0.0 110.946 -174.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.442 HG21 ' HB3' ' A' ' 75' ' ' PHE . 44.6 t -110.85 140.91 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 123.398 0.679 . . . . 0.0 110.784 -177.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -109.53 91.3 3.59 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 124.511 1.124 . . . . 0.0 108.95 176.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -76.78 133.0 39.55 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.128 -177.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.407 HG13 ' HA ' ' A' ' 64' ' ' SER . 31.5 pt -145.06 -173.25 0.46 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.838 0 C-N-CA 125.371 1.468 . . . . 0.0 108.438 176.168 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 35.5 p -86.78 153.54 21.6 Favored 'General case' 0 C--O 1.24 0.591 0 CA-C-O 121.211 0.529 . . . . 0.0 110.274 169.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.772 HD13 ' SG ' ' A' ' 11' ' ' CYS . 6.0 tt -66.27 -29.75 70.04 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.702 176.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -59.31 -45.93 89.97 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 123.884 0.874 . . . . 0.0 110.957 172.23 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -62.35 -33.35 74.55 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 123.894 0.746 . . . . 0.0 110.981 -179.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.463 ' HB2' ' HB3' ' A' ' 64' ' ' SER . . . -63.54 -31.51 72.7 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.79 0.836 . . . . 0.0 112.557 179.594 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 74.1 mt -79.21 -57.05 5.72 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.218 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.72 -47.43 53.95 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 115.865 -0.607 . . . . 0.0 112.167 -173.68 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -105.16 22.91 14.51 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.156 0.983 . . . . 0.0 110.962 -170.483 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.625 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -39.42 -61.98 0.73 Allowed 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 124.796 1.238 . . . . 0.0 113.985 -174.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.65 -30.82 69.61 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 114.564 -1.198 . . . . 0.0 111.345 -178.242 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -63.54 -45.24 95.2 Favored Glycine 0 C--N 1.35 1.342 0 O-C-N 123.942 0.776 . . . . 0.0 111.939 179.251 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 13.5 mt -60.79 -56.05 20.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.338 1.055 . . . . 0.0 110.471 -179.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.7 mp -56.23 -49.76 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 O-C-N 123.781 0.675 . . . . 0.0 111.011 -178.374 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.62 -27.69 66.25 Favored 'General case' 0 N--CA 1.485 1.318 0 O-C-N 123.294 0.371 . . . . 0.0 111.342 -176.77 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -62.33 -42.03 99.05 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.418 0.687 . . . . 0.0 109.856 175.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.488 HG21 HG23 ' A' ' 60' ' ' ILE . 25.9 mt -76.83 -36.46 26.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 -176.01 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -61.77 -44.14 97.47 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-N 114.539 -1.209 . . . . 0.0 111.794 176.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -76.4 -29.52 57.13 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 123.123 0.264 . . . . 0.0 110.904 -176.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 69.0 mtm -69.0 -54.12 16.92 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 122.749 0.42 . . . . 0.0 110.313 176.051 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 62.5 mt -60.36 -45.92 95.8 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 123.165 0.586 . . . . 0.0 110.263 178.529 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.495 ' O ' ' HG2' ' A' ' 108' ' ' GLN . . . -56.08 -48.5 75.97 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 122.869 0.467 . . . . 0.0 110.811 179.375 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 22.9 t -63.73 -43.01 97.8 Favored 'General case' 0 N--CA 1.48 1.038 0 O-C-N 123.785 0.678 . . . . 0.0 111.614 -171.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -74.54 -23.84 58.86 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.887 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -87.51 -19.05 28.48 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.655 0.382 . . . . 0.0 111.093 175.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.495 ' HG2' ' O ' ' A' ' 104' ' ' ALA . 86.0 mm-40 . . . . . 0 C--O 1.253 1.264 0 C-N-CA 123.369 0.668 . . . . 0.0 109.236 173.678 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.3 mpp? . . . . . 0 N--CA 1.485 1.314 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.0 t -102.41 179.07 4.41 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.331 0.653 . . . . 0.0 109.596 173.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.556 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 5.8 pttt -138.18 -168.12 2.3 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.961 0.905 . . . . 0.0 110.178 -168.782 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.575 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.6 tmtp? -145.14 144.08 30.7 Favored 'General case' 0 CA--C 1.556 1.208 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 -178.319 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.46 ' N ' ' HD3' ' A' ' 4' ' ' LYS . 9.1 tt -130.04 136.56 49.51 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.03 1.332 . . . . 0.0 107.583 174.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.469 HG13 HG23 ' A' ' 61' ' ' ILE . 21.4 pt -126.76 159.67 36.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 170.658 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.604 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -149.23 166.33 29.21 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 123.001 0.52 . . . . 0.0 110.107 177.052 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.584 HD21 ' HG3' ' A' ' 41' ' ' GLN . 3.1 tt -139.3 112.16 7.91 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 -178.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.565 ' HA ' ' O ' ' A' ' 64' ' ' SER . 62.9 m -99.94 114.31 27.48 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.9 0.88 . . . . 0.0 109.39 175.151 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.439 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -131.04 122.82 27.44 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 122.768 0.427 . . . . 0.0 111.208 -179.165 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.759 ' SG ' HD13 ' A' ' 85' ' ' LEU . 1.2 m -134.88 148.15 65.84 Favored Pre-proline 0 N--CA 1.478 0.945 0 C-N-CA 123.844 0.858 . . . . 0.0 110.619 178.495 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -79.57 -12.49 13.8 Favored 'Trans proline' 0 C--N 1.373 1.856 0 C-N-CA 122.74 2.294 . . . . 0.0 111.243 173.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 45.7 mtt -65.51 -42.59 91.88 Favored 'General case' 0 C--N 1.352 0.68 0 C-N-CA 125.086 1.354 . . . . 0.0 109.746 177.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 141.94 -177.94 21.04 Favored Glycine 0 C--N 1.348 1.233 0 CA-C-N 115.483 -0.781 . . . . 0.0 111.962 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 29.9 mt -73.36 -25.04 60.43 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -177.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.66 -41.99 91.84 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-O 121.091 0.472 . . . . 0.0 111.049 179.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.532 ' ND1' HD22 ' A' ' 85' ' ' LEU . 12.9 t-80 -67.77 -42.64 81.41 Favored 'General case' 0 C--O 1.251 1.133 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.282 179.305 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.424 ' HA ' HD11 ' A' ' 85' ' ' LEU . 43.5 p -66.5 -30.4 70.72 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 115.085 -0.961 . . . . 0.0 111.214 -179.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 18.8 m-30 -71.12 -32.66 69.28 Favored 'General case' 0 C--N 1.351 0.639 0 C-N-CA 123.317 0.647 . . . . 0.0 110.967 179.027 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 47.6 mtm -65.65 -39.3 91.25 Favored 'General case' 0 N--CA 1.486 1.335 0 CA-C-O 120.74 0.305 . . . . 0.0 110.713 176.126 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.22 -37.65 72.02 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.417 174.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.54 -38.55 91.4 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.717 0.807 . . . . 0.0 110.816 179.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 7.6 tp-100 -68.98 -45.65 70.08 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.027 0.531 . . . . 0.0 110.173 179.042 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.488 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -59.93 -57.21 13.86 Favored 'General case' 0 C--O 1.242 0.675 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.298 -177.785 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.429 HD11 ' OG ' ' A' ' 64' ' ' SER . 94.7 mt -64.2 -32.0 73.41 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.005 0.522 . . . . 0.0 111.852 -178.58 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.536 ' HA ' HG21 ' A' ' 36' ' ' VAL . 32.4 tt0 -61.64 -56.39 20.35 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 110.121 -0.326 . . . . 0.0 110.121 -179.283 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.476 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 44.5 mm-40 -54.02 -49.07 69.73 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 124.584 1.177 . . . . 0.0 111.502 179.229 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.42 ' HB3' HD12 ' A' ' 96' ' ' ILE . . . -65.48 -36.19 83.14 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.438 0.695 . . . . 0.0 112.099 -176.603 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.93 -24.13 58.45 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.06 0.544 . . . . 0.0 111.896 177.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 26' ' ' GLU . 54.5 t -68.68 -41.34 82.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 174.34 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.476 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 10.0 mm-40 -70.33 -25.9 63.51 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 114.027 -1.442 . . . . 0.0 111.185 179.363 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -82.77 -2.17 53.68 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 123.474 0.71 . . . . 0.0 112.407 178.229 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 87.84 17.72 57.57 Favored Glycine 0 C--N 1.35 1.346 0 N-CA-C 115.675 1.03 . . . . 0.0 115.675 164.034 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.556 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -130.16 175.37 8.97 Favored 'General case' 0 N--CA 1.484 1.263 0 CA-C-N 117.908 0.854 . . . . 0.0 112.639 175.579 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.575 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 37.0 tt0 -72.21 149.29 44.75 Favored 'General case' 0 C--N 1.353 0.737 0 CA-C-N 114.675 -1.148 . . . . 0.0 108.95 175.435 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.536 HG21 ' HA ' ' A' ' 26' ' ' GLU . 8.1 p -133.16 135.52 56.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 122.65 0.38 . . . . 0.0 110.2 -179.553 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 49.6 tptt -142.4 113.9 7.86 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 175.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.604 HG12 ' HB3' ' A' ' 7' ' ' ALA . 43.1 mt -116.78 110.35 31.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 122.838 0.455 . . . . 0.0 111.699 -176.325 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -74.0 144.97 44.94 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.421 0.688 . . . . 0.0 109.192 172.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 10.6 p -128.9 113.89 15.8 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.772 0.829 . . . . 0.0 109.46 -177.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.584 ' HG3' HD21 ' A' ' 8' ' ' LEU . 8.1 mt-30 -109.82 141.42 42.52 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 177.611 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -165.35 -177.22 37.58 Favored Glycine 0 C--O 1.241 0.593 0 N-CA-C 111.836 -0.506 . . . . 0.0 111.836 179.607 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.02 -31.9 70.38 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.366 0.666 . . . . 0.0 111.271 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -66.33 -40.38 89.85 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.447 0.699 . . . . 0.0 110.951 177.291 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 150.27 -158.6 27.75 Favored Glycine 0 C--N 1.344 1.023 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.989 -176.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 66.1 mt -116.14 137.48 49.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 C-N-CA 123.578 0.751 . . . . 0.0 109.556 179.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -136.83 151.11 48.77 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.111 0.964 . . . . 0.0 109.308 -176.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 17.2 t30 60.61 36.27 19.77 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 124.105 0.962 . . . . 0.0 110.242 177.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 14.5 tpp180 -43.59 125.63 4.1 Favored 'General case' 0 C--N 1.362 1.109 0 C-N-CA 126.292 1.837 . . . . 0.0 113.269 -174.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 50.1 mt -77.61 128.46 34.16 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.724 171.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 45.2 p -96.15 165.51 12.19 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.313 -0.858 . . . . 0.0 108.843 176.057 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.95 -29.94 67.51 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 122.697 0.399 . . . . 0.0 111.463 178.081 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.465 HE21 ' HG3' ' A' ' 57' ' ' GLU . 26.5 tp60 -62.65 -41.47 99.06 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.839 0.856 . . . . 0.0 111.508 176.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.4 ' HB3' HG21 ' A' ' 6' ' ' ILE . 56.5 m-20 -63.81 -45.09 91.23 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 122.98 0.512 . . . . 0.0 110.545 176.835 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 10.5 mt -69.11 -28.54 39.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 O-C-N 123.836 0.71 . . . . 0.0 110.847 -178.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.68 -44.97 61.12 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.721 0.808 . . . . 0.0 111.216 -179.114 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.465 ' HG3' HE21 ' A' ' 53' ' ' GLN . 40.9 mt-10 -84.24 -11.19 56.89 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.303 0.641 . . . . 0.0 111.643 -179.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.44 100.67 0.19 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.107 0.563 . . . . 0.0 111.83 -177.554 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 32.5 m -61.9 -40.94 97.17 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.218 168.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.529 HG23 HG21 ' A' ' 99' ' ' ILE . 68.4 mt -128.47 140.19 49.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.239 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.469 HG23 HG13 ' A' ' 6' ' ' ILE . 20.4 mt -131.21 133.8 62.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 171.75 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.4 mp -120.7 136.05 58.96 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 173.374 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . 0.484 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 8.5 m170 -107.76 86.37 2.29 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 167.544 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.565 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 33.9 m -79.22 79.91 5.62 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 114.529 -1.214 . . . . 0.0 109.208 175.598 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 36.0 m -127.54 161.09 35.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 121.553 0.692 . . . . 0.0 112.034 -169.642 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -118.34 -17.19 9.53 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.33 1.452 . . . . 0.0 108.751 174.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 11.8 m -133.93 160.1 42.07 Favored 'Isoleucine or valine' 0 C--N 1.35 0.621 0 C-N-CA 125.399 1.48 . . . . 0.0 109.096 175.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 41.6 m -69.78 109.98 5.69 Favored Pre-proline 0 CA--C 1.554 1.115 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 174.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -67.13 149.36 82.02 Favored 'Trans proline' 0 C--N 1.379 2.14 0 C-N-CA 122.381 2.054 . . . . 0.0 111.455 -177.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.402 ' H ' ' NE2' ' A' ' 41' ' ' GLN . 6.7 mm-40 -61.64 -31.64 71.75 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.223 0.609 . . . . 0.0 111.938 -171.561 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -104.14 21.24 16.85 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.482 0.713 . . . . 0.0 111.707 -175.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -60.66 -28.92 68.95 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.15 0.58 . . . . 0.0 111.841 -176.497 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -58.14 -32.59 68.32 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.164 0.985 . . . . 0.0 113.264 -179.103 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 74.4 mtt-85 -61.24 -38.53 87.01 Favored 'General case' 0 N--CA 1.483 1.224 0 CA-C-O 121.944 0.878 . . . . 0.0 110.52 177.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.445 ' HB3' HG21 ' A' ' 80' ' ' VAL . 41.0 m-85 -94.97 -19.83 19.89 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 113.794 -1.548 . . . . 0.0 111.001 -172.419 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -62.18 -30.08 70.81 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.171 0.988 . . . . 0.0 111.322 -176.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 22.6 t -81.53 -7.22 59.56 Favored 'General case' 0 CA--C 1.554 1.109 0 C-N-CA 123.824 0.849 . . . . 0.0 111.675 178.311 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 14.5 mmt85 -116.95 169.74 9.16 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.292 1.037 . . . . 0.0 110.24 -171.196 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -78.53 96.44 5.44 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.257 0.623 . . . . 0.0 110.801 -178.19 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.445 HG21 ' HB3' ' A' ' 75' ' ' PHE . 43.0 t -119.22 142.13 35.89 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 123.837 0.855 . . . . 0.0 110.674 -177.07 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 -108.8 94.01 4.82 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 177.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.484 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 38.8 mt-10 -83.06 114.17 21.11 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 115.267 -0.878 . . . . 0.0 110.956 -173.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.452 HG13 ' HA ' ' A' ' 64' ' ' SER . 45.6 pt -125.14 -173.84 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 124.74 1.216 . . . . 0.0 109.792 -179.017 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 20.3 p -83.55 149.14 26.78 Favored 'General case' 0 C--N 1.345 0.38 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.17 168.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.759 HD13 ' SG ' ' A' ' 11' ' ' CYS . 7.2 tt -63.68 -32.49 73.99 Favored 'General case' 0 N--CA 1.486 1.352 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.247 178.391 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.439 ' HG2' ' HE3' ' A' ' 90' ' ' LYS . 29.8 tt0 -61.22 -43.35 99.01 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.932 175.576 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -60.55 -31.31 70.42 Favored 'General case' 0 C--N 1.359 1.017 0 O-C-N 123.857 0.723 . . . . 0.0 110.825 179.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.49 -40.79 89.47 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.494 0.718 . . . . 0.0 111.908 177.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 63.0 mt -69.65 -42.01 80.33 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.899 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.57 -176.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.439 ' HE3' ' HG2' ' A' ' 86' ' ' GLN . 18.2 ptpt -87.56 -46.69 9.34 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 122.823 0.449 . . . . 0.0 112.191 -176.085 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -108.48 27.17 9.64 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 124.012 0.925 . . . . 0.0 110.946 -167.194 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.488 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -43.23 -57.96 2.73 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 124.383 1.073 . . . . 0.0 113.066 -177.448 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.37 -42.93 99.8 Favored 'General case' 0 C--N 1.344 0.357 0 CA-C-N 114.696 -1.138 . . . . 0.0 110.878 178.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -59.11 -47.6 89.99 Favored Glycine 0 C--N 1.352 1.462 0 O-C-N 124.269 0.98 . . . . 0.0 113.153 -176.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 14.4 mt -62.84 -55.75 21.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 123.946 0.898 . . . . 0.0 109.647 -177.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.42 HD12 ' HB3' ' A' ' 28' ' ' ALA . 69.2 mt -58.92 -46.62 91.25 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 CA-C-N 114.139 -1.391 . . . . 0.0 111.357 -175.165 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.54 -31.49 69.74 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 122.63 0.372 . . . . 0.0 110.645 -178.481 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -58.48 -44.02 89.18 Favored 'General case' 0 C--N 1.366 1.303 0 C-N-CA 123.369 0.668 . . . . 0.0 109.542 173.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.529 HG21 HG23 ' A' ' 60' ' ' ILE . 34.2 mt -76.41 -30.64 19.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.558 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 -174.598 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -62.5 -47.27 84.7 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.252 1.021 . . . . 0.0 111.772 175.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -74.35 -36.49 63.62 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 123.454 0.471 . . . . 0.0 110.624 -177.168 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 6.4 mtp -66.58 -52.83 41.12 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.179 0.991 . . . . 0.0 111.136 178.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.452 HD12 HG12 ' A' ' 60' ' ' ILE . 31.0 mt -66.33 -35.35 74.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.898 177.432 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.533 ' O ' ' HG2' ' A' ' 108' ' ' GLN . . . -58.61 -45.03 90.03 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 118.072 0.396 . . . . 0.0 110.377 174.662 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 22.7 t -67.56 -35.12 78.42 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.54 0.736 . . . . 0.0 111.312 -172.275 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.432 ' HG2' ' HA ' ' A' ' 103' ' ' ILE . 9.5 pt-20 -79.1 -28.45 43.01 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 116.763 -0.199 . . . . 0.0 111.307 177.171 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.433 ' HG2' ' O ' ' A' ' 103' ' ' ILE . 13.7 mm-40 -79.34 -11.35 59.93 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 122.541 0.336 . . . . 0.0 110.957 176.477 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.533 ' HG2' ' O ' ' A' ' 104' ' ' ALA . 80.4 mm-40 . . . . . 0 C--O 1.258 1.518 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 170.227 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.5 ttm . . . . . 0 N--CA 1.486 1.343 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 38.4 m -76.66 94.24 3.75 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 122.825 0.45 . . . . 0.0 110.199 178.133 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.404 ' HG2' ' H ' ' A' ' 3' ' ' LYS . 40.6 pttt -74.34 167.16 22.2 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.53 179.726 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.553 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.6 tmtp? -144.06 131.82 21.34 Favored 'General case' 0 N--CA 1.486 1.338 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 -172.095 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.464 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 10.4 tt -126.09 138.47 53.7 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 178.498 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 20.4 pt -128.68 164.16 31.49 Favored 'Isoleucine or valine' 0 C--O 1.241 0.644 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 171.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.576 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -152.02 168.35 25.49 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.037 178.129 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.8 tt -141.15 114.93 9.03 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 107.058 -1.46 . . . . 0.0 107.058 -177.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.545 ' HA ' ' O ' ' A' ' 64' ' ' SER . 61.4 m -106.72 113.06 26.34 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 176.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.411 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -127.41 127.49 44.23 Favored 'General case' 0 N--CA 1.497 1.922 0 C-N-CA 122.482 0.313 . . . . 0.0 111.836 -175.696 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.817 ' SG ' HD13 ' A' ' 85' ' ' LEU . 50.1 m -125.21 144.78 48.47 Favored Pre-proline 0 N--CA 1.478 0.935 0 C-N-CA 124.48 1.112 . . . . 0.0 110.609 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -75.82 -14.65 19.35 Favored 'Trans proline' 0 C--N 1.37 1.695 0 C-N-CA 122.379 2.053 . . . . 0.0 112.244 173.055 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 54.8 tpp -83.46 -71.76 0.49 Allowed 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.277 0.631 . . . . 0.0 110.531 178.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -171.43 -175.37 39.77 Favored Glycine 0 C--N 1.347 1.178 0 C-N-CA 121.807 -0.235 . . . . 0.0 113.351 -176.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 60.7 mt -82.37 -17.68 44.74 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -173.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.0 -43.6 91.51 Favored 'General case' 0 N--CA 1.487 1.418 0 CA-C-N 119.074 0.852 . . . . 0.0 111.253 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.439 ' ND1' ' SG ' ' A' ' 11' ' ' CYS . 18.2 t-160 -66.43 -43.04 86.75 Favored 'General case' 0 C--O 1.246 0.882 0 CA-C-N 115.015 -0.993 . . . . 0.0 110.199 178.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 31.8 p -66.42 -30.34 70.68 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 115.072 -0.967 . . . . 0.0 111.13 -178.22 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 21.1 m-30 -73.55 -32.11 64.01 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.328 0.651 . . . . 0.0 111.631 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 64.4 mtm -66.41 -38.98 88.68 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-O 120.788 0.328 . . . . 0.0 110.508 173.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.0 -40.58 82.99 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.89 174.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.36 -31.07 68.18 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.831 0.853 . . . . 0.0 110.963 -178.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 24.1 tp60 -67.8 -49.16 63.83 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.298 0.639 . . . . 0.0 109.404 177.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.548 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -66.3 -50.23 64.37 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-N 114.992 -1.004 . . . . 0.0 111.675 -174.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.418 HD11 ' OG ' ' A' ' 64' ' ' SER . 93.1 mt -64.46 -33.0 74.87 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.129 0.572 . . . . 0.0 111.643 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.45 ' O ' HG23 ' A' ' 30' ' ' VAL . 39.1 tt0 -58.3 -58.9 6.43 Favored 'General case' 0 C--N 1.353 0.747 0 O-C-N 123.838 0.711 . . . . 0.0 109.946 175.734 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -54.16 -47.37 72.03 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 124.602 1.189 . . . . 0.0 110.847 -177.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.13 -49.15 78.98 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.372 1.069 . . . . 0.0 111.991 -177.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.42 -21.4 61.99 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 113.329 0.862 . . . . 0.0 113.329 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.45 HG23 ' O ' ' A' ' 26' ' ' GLU . 54.1 t -77.6 -43.65 29.73 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.332 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 177.698 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -64.69 -32.44 74.12 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 114.902 -1.044 . . . . 0.0 110.36 174.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.24 -38.85 82.27 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.352 1.061 . . . . 0.0 111.344 175.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 109.32 22.17 6.93 Favored Glycine 0 C--N 1.342 0.908 0 CA-C-N 115.289 -0.869 . . . . 0.0 114.092 173.163 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.435 ' OH ' ' HG2' ' A' ' 100' ' ' GLU . 1.8 m-85 -95.63 162.95 13.4 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 117.974 0.887 . . . . 0.0 109.84 171.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.553 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 40.5 tt0 -75.98 122.82 24.76 Favored 'General case' 0 C--O 1.222 -0.361 0 N-CA-C 106.581 -1.637 . . . . 0.0 106.581 158.499 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.464 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 13.6 p -110.68 136.27 47.21 Favored 'Isoleucine or valine' 0 C--O 1.241 0.617 0 CA-C-N 118.173 0.442 . . . . 0.0 110.195 -173.16 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.1 tptt -143.77 113.84 7.3 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 178.003 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.576 HG12 ' HB3' ' A' ' 7' ' ' ALA . 38.1 mt -117.78 111.7 35.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 122.727 0.411 . . . . 0.0 111.488 -175.433 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -75.53 140.48 42.78 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.648 0.779 . . . . 0.0 109.193 169.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.401 HG22 ' HB2' ' A' ' 9' ' ' CYS . 19.8 p -123.38 121.94 37.05 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 123.642 0.777 . . . . 0.0 108.945 -179.494 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.515 HE22 ' HB2' ' A' ' 70' ' ' GLU . 41.1 mt-30 -116.18 151.96 34.66 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.396 0.679 . . . . 0.0 110.365 -178.565 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 179.74 178.33 48.39 Favored Glycine 0 C--N 1.336 0.547 0 CA-C-N 116.106 -0.497 . . . . 0.0 112.897 177.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.47 -25.87 68.46 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.53 0.732 . . . . 0.0 111.067 176.373 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -70.89 -36.08 72.59 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.821 0.848 . . . . 0.0 110.838 175.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 150.21 -162.47 29.24 Favored Glycine 0 C--N 1.349 1.26 0 CA-C-N 116.109 -0.496 . . . . 0.0 112.604 179.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 68.4 mt -120.87 136.86 56.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 124.009 0.924 . . . . 0.0 109.299 174.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -134.94 148.33 50.01 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.075 0.95 . . . . 0.0 109.244 -177.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 9.5 t30 61.92 42.75 9.9 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.501 1.12 . . . . 0.0 110.526 175.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -45.69 128.73 8.75 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 125.794 1.638 . . . . 0.0 113.686 -175.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 44.1 mt -80.47 136.86 36.4 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.583 1.153 . . . . 0.0 110.778 172.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 64.7 p -100.75 172.38 7.11 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.805 0.842 . . . . 0.0 110.375 179.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -58.75 -35.11 72.21 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.017 0.527 . . . . 0.0 111.201 174.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -58.94 -51.73 68.81 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.841 0.857 . . . . 0.0 111.112 175.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.437 ' O ' ' HB2' ' A' ' 58' ' ' ALA . 75.8 m-20 -59.9 -41.54 91.88 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.237 -175.499 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.441 HG22 ' HG3' ' A' ' 78' ' ' ARG . 50.6 mt -73.58 -42.96 55.52 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.243 0 C-N-CA 123.409 0.683 . . . . 0.0 111.676 -177.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -71.4 -39.4 71.18 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.215 0.606 . . . . 0.0 111.88 -173.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -93.02 -1.56 56.5 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.18 0.592 . . . . 0.0 111.549 -177.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.437 ' HB2' ' O ' ' A' ' 54' ' ' ASP . . . -64.45 110.11 2.17 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.056 0.542 . . . . 0.0 111.486 177.587 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 26.4 m -60.75 -37.77 82.91 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.083 0.953 . . . . 0.0 109.76 168.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.414 HD12 HD12 ' A' ' 5' ' ' LEU . 59.3 mt -134.47 144.65 34.46 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 C-N-CA 123.323 0.649 . . . . 0.0 110.857 177.208 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 21.6 mt -131.37 131.42 63.14 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 C-N-CA 124.07 0.948 . . . . 0.0 109.043 169.168 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -120.1 123.44 70.72 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 174.531 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . 0.534 ' HB2' ' HG3' ' A' ' 82' ' ' GLU . 18.1 m170 -97.62 84.06 3.33 Favored 'General case' 0 N--CA 1.488 1.457 0 CA-C-N 119.153 0.888 . . . . 0.0 109.736 170.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.545 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 28.4 m -79.25 82.83 5.36 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 114.649 -1.159 . . . . 0.0 109.535 175.15 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 32.1 m -127.43 158.1 38.87 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-O 121.379 0.609 . . . . 0.0 111.892 -170.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -103.86 -29.33 11.05 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.351 1.061 . . . . 0.0 109.037 174.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 13.6 m -131.62 169.11 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 125.066 1.346 . . . . 0.0 108.697 176.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 31.9 m -61.34 119.7 48.62 Favored Pre-proline 0 CA--C 1.551 1.014 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 174.469 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -68.23 151.53 76.65 Favored 'Trans proline' 0 C--N 1.373 1.829 0 C-N-CA 122.342 2.028 . . . . 0.0 110.643 173.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.515 ' HB2' HE22 ' A' ' 41' ' ' GLN . 10.2 mm-40 -63.46 -42.87 98.63 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-O 121.734 0.778 . . . . 0.0 109.84 -176.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -91.01 21.97 3.94 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 114.809 -1.087 . . . . 0.0 112.402 -173.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.413 ' HA ' ' HE1' ' A' ' 63' ' ' HIS . 7.1 p30 -56.01 -33.22 64.67 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.037 0.935 . . . . 0.0 112.613 -177.166 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.96 -18.32 50.7 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.944 0.898 . . . . 0.0 112.64 -174.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 3.7 mtp85 -67.01 -28.99 68.7 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-O 121.419 0.628 . . . . 0.0 110.705 176.422 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 47.1 m-85 -97.99 -5.51 33.95 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.235 1.014 . . . . 0.0 111.488 -174.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -60.12 -33.68 72.47 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.937 0.895 . . . . 0.0 111.898 -175.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 34.5 p -70.96 -13.37 61.99 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.82 0.848 . . . . 0.0 112.621 179.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.441 ' HG3' HG22 ' A' ' 55' ' ' ILE . 31.5 mmt180 -117.61 177.99 4.55 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 124.074 0.95 . . . . 0.0 111.185 -174.392 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -89.16 100.95 13.63 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.918 0.887 . . . . 0.0 110.402 -177.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 38.4 t -106.97 149.78 10.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.054 -179.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -125.09 90.75 3.29 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 124.133 0.973 . . . . 0.0 108.46 178.082 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.534 ' HG3' ' HB2' ' A' ' 63' ' ' HIS . 1.8 mp0 -78.0 131.88 37.57 Favored 'General case' 0 C--N 1.355 0.847 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.651 -178.131 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.522 HD12 ' HB3' ' A' ' 87' ' ' ASP . 37.3 pt -141.45 -172.5 0.59 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.765 0 C-N-CA 125.58 1.552 . . . . 0.0 107.786 179.315 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 32.0 p -83.03 152.54 25.35 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 121.129 0.49 . . . . 0.0 110.077 168.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.817 HD13 ' SG ' ' A' ' 11' ' ' CYS . 6.7 tt -65.91 -29.37 69.78 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.192 177.281 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.435 ' O ' ' HG2' ' A' ' 90' ' ' LYS . 29.7 tt0 -64.79 -39.45 93.62 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.049 0.54 . . . . 0.0 110.581 174.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.522 ' HB3' HD12 ' A' ' 83' ' ' ILE . 7.5 t70 -59.47 -32.85 70.63 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 124.106 0.962 . . . . 0.0 110.797 178.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.413 ' HB2' ' HB3' ' A' ' 64' ' ' SER . . . -66.03 -39.36 90.14 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.417 0.687 . . . . 0.0 112.106 177.194 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 75.3 mt -70.7 -43.07 77.73 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.84 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.724 -177.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.435 ' HG2' ' O ' ' A' ' 86' ' ' GLN . 0.2 OUTLIER -91.68 -44.21 9.15 Favored 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -173.169 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -106.52 22.8 15.24 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.845 0.858 . . . . 0.0 110.829 -169.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.548 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -42.3 -60.93 1.31 Allowed 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 124.071 0.948 . . . . 0.0 112.991 -175.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.63 -38.32 84.38 Favored 'General case' 0 C--N 1.348 0.506 0 CA-C-N 115.201 -0.909 . . . . 0.0 111.005 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -61.84 -50.2 68.29 Favored Glycine 0 C--N 1.353 1.482 0 O-C-N 124.415 1.072 . . . . 0.0 112.803 -177.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 17.2 mt -54.4 -58.01 4.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 124.228 1.011 . . . . 0.0 110.415 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.468 ' O ' ' HG3' ' A' ' 100' ' ' GLU . 2.1 mp -57.36 -54.68 27.61 Favored 'Isoleucine or valine' 0 C--N 1.36 1.028 0 O-C-N 124.391 1.057 . . . . 0.0 110.81 -175.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.28 -29.86 70.72 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -175.203 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -67.41 -39.0 85.49 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.402 0.681 . . . . 0.0 110.355 177.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 28.1 mt -75.71 -35.96 32.38 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 -179.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.468 ' HG3' ' O ' ' A' ' 96' ' ' ILE . 28.4 mt-10 -60.31 -46.3 90.38 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.867 178.327 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -72.31 -31.02 65.33 Favored 'General case' 0 N--CA 1.48 1.03 0 O-C-N 123.594 0.559 . . . . 0.0 111.299 -177.039 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 71.0 mtm -64.4 -48.17 76.42 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-O 120.786 0.327 . . . . 0.0 110.584 173.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 63.9 mt -63.5 -46.17 95.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.038 176.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.24 -20.28 64.8 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.22 0.608 . . . . 0.0 111.627 -177.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 38.2 t -76.73 -41.33 45.49 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 122.65 0.38 . . . . 0.0 110.2 177.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -81.83 -21.59 37.53 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 122.925 0.49 . . . . 0.0 112.267 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 22.9 mm-40 -81.67 -47.66 12.7 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.311 0.644 . . . . 0.0 110.013 176.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 71.6 mm-40 . . . . . 0 C--O 1.251 1.16 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.988 -174.92 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.48 1.057 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.6 m -66.04 119.32 11.17 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 123.77 0.828 . . . . 0.0 111.482 -174.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 41.9 pttt -98.34 178.73 4.95 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.213 1.005 . . . . 0.0 111.298 -176.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.598 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.1 tmtp? -147.52 135.13 20.93 Favored 'General case' 0 CA--C 1.557 1.212 0 CA-C-O 121.291 0.567 . . . . 0.0 109.625 -173.647 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.453 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 10.1 tt -128.56 138.72 52.37 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.551 1.14 . . . . 0.0 108.339 178.007 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.511 HD12 HD13 ' A' ' 50' ' ' LEU . 20.2 pt -128.78 167.8 23.33 Favored 'Isoleucine or valine' 0 C--O 1.241 0.641 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 172.163 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.633 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -154.55 169.14 24.53 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.156 177.317 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.404 ' HA ' ' O ' ' A' ' 39' ' ' GLU . 4.6 tt -140.23 116.45 10.55 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 177.649 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.533 ' HA ' ' O ' ' A' ' 64' ' ' SER . 77.9 m -106.18 115.08 29.6 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 177.347 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.421 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -129.65 116.77 19.33 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 122.819 0.448 . . . . 0.0 111.542 -175.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.702 ' SG ' HD13 ' A' ' 85' ' ' LEU . 1.7 m -124.84 143.14 42.89 Favored Pre-proline 0 N--CA 1.479 1.017 0 C-N-CA 124.495 1.118 . . . . 0.0 109.471 175.479 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -77.2 -7.08 16.99 Favored 'Trans proline' 0 C--N 1.375 1.947 0 C-N-CA 122.561 2.174 . . . . 0.0 112.486 -178.479 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 58.3 mtt -79.78 -49.19 12.37 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.353 1.061 . . . . 0.0 110.038 -178.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 162.03 -168.63 37.15 Favored Glycine 0 C--N 1.343 0.93 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.679 -178.038 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 60.4 mt -82.96 -17.72 42.53 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 113.364 0.876 . . . . 0.0 113.364 -176.395 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.28 -45.09 95.93 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-O 121.482 0.658 . . . . 0.0 111.205 -178.654 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -65.55 -40.87 93.33 Favored 'General case' 0 C--O 1.247 0.939 0 CA-C-N 114.646 -1.161 . . . . 0.0 110.214 -179.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 52.6 p -72.18 -31.79 66.25 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 114.402 -1.272 . . . . 0.0 111.027 -176.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 15.6 m-30 -68.92 -31.95 71.22 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.127 0.571 . . . . 0.0 111.043 178.197 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 54.5 mtm -67.76 -40.92 84.03 Favored 'General case' 0 N--CA 1.486 1.341 0 O-C-N 123.378 0.424 . . . . 0.0 110.883 174.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.97 -37.84 84.98 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.933 174.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.51 -38.98 81.41 Favored 'General case' 0 C--O 1.217 -0.653 0 C-N-CA 123.923 0.889 . . . . 0.0 110.797 179.257 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -63.69 -43.35 96.9 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.685 0.794 . . . . 0.0 110.158 179.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.662 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -61.05 -58.32 8.89 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 114.727 -1.124 . . . . 0.0 111.601 179.531 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 95.8 mt -66.92 -30.9 71.17 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.143 0.577 . . . . 0.0 112.164 -176.293 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.507 ' O ' HG23 ' A' ' 30' ' ' VAL . 36.7 tt0 -62.01 -61.29 2.59 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.062 0.545 . . . . 0.0 109.751 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.548 ' O ' ' HG3' ' A' ' 31' ' ' GLU . 16.5 mm-40 -51.01 -51.94 47.91 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 124.71 1.256 . . . . 0.0 111.661 179.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -62.85 -40.18 96.65 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.775 0.83 . . . . 0.0 112.572 -174.841 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.17 -27.91 61.05 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 122.895 0.478 . . . . 0.0 112.202 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.507 HG23 ' O ' ' A' ' 26' ' ' GLU . 77.7 t -64.1 -44.69 97.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 175.563 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.548 ' HG3' ' O ' ' A' ' 27' ' ' GLU . 18.9 mt-10 -70.23 -32.37 70.21 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 114.755 -1.111 . . . . 0.0 110.4 -179.555 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -72.78 -17.89 61.54 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.688 0.795 . . . . 0.0 111.636 176.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.81 22.17 11.34 Favored Glycine 0 C--N 1.346 1.114 0 N-CA-C 115.157 0.823 . . . . 0.0 115.157 165.018 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.438 ' CE2' HD12 ' A' ' 60' ' ' ILE . 0.0 OUTLIER -104.04 173.09 6.45 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-N 118.189 0.995 . . . . 0.0 110.522 172.159 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.598 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 43.2 tt0 -83.2 123.65 29.77 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 106.83 -1.544 . . . . 0.0 106.83 157.745 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.453 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 9.5 p -109.12 135.78 46.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 122.931 0.492 . . . . 0.0 110.247 -174.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 47.9 tptt -145.46 116.21 7.72 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 179.124 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.633 HG12 ' HB3' ' A' ' 7' ' ' ALA . 42.5 mt -120.19 110.92 30.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 122.896 0.478 . . . . 0.0 111.846 -172.587 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.404 ' O ' ' HA ' ' A' ' 8' ' ' LEU . 39.6 tt0 -79.38 118.89 21.69 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.401 0.68 . . . . 0.0 109.819 175.619 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 34.8 p -96.78 133.11 41.77 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.035 177.315 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.454 ' HG2' HG12 ' A' ' 46' ' ' ILE . 42.6 mt-30 -126.88 141.3 51.85 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.098 0.959 . . . . 0.0 109.537 178.307 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -173.33 177.97 45.49 Favored Glycine 0 C--N 1.335 0.524 0 CA-C-N 116.769 -0.196 . . . . 0.0 113.031 179.525 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.18 -25.94 67.37 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.899 0.88 . . . . 0.0 111.885 178.04 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -75.18 -33.54 61.47 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.74 0.816 . . . . 0.0 111.298 178.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 156.39 -160.52 30.25 Favored Glycine 0 C--N 1.348 1.207 0 O-C-N 123.371 0.42 . . . . 0.0 112.481 179.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.458 HG21 ' NH1' ' A' ' 49' ' ' ARG . 73.1 mt -127.12 135.27 64.04 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.244 0 C-N-CA 123.82 0.848 . . . . 0.0 108.885 172.178 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -136.95 155.0 50.29 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.205 0.602 . . . . 0.0 110.474 -175.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 20.4 t30 60.93 36.76 18.7 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.704 1.202 . . . . 0.0 110.15 177.144 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.458 ' NH1' HG21 ' A' ' 46' ' ' ILE . 19.1 tpp180 -48.66 123.23 6.5 Favored 'General case' 0 C--N 1.361 1.106 0 C-N-CA 125.157 1.383 . . . . 0.0 112.103 -174.747 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.511 HD13 HD12 ' A' ' 6' ' ' ILE . 39.8 mt -70.32 140.37 52.23 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 114.786 -1.097 . . . . 0.0 110.544 173.316 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.455 ' O ' HG13 ' A' ' 55' ' ' ILE . 52.9 p -94.84 161.04 14.33 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 172.557 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.11 -25.21 66.82 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 122.449 0.3 . . . . 0.0 110.813 174.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.406 HE21 ' HG3' ' A' ' 57' ' ' GLU . 25.3 tp60 -65.88 -45.61 81.42 Favored 'General case' 0 C--N 1.354 0.791 0 O-C-N 124.035 0.834 . . . . 0.0 110.485 173.481 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 -57.86 -44.55 86.65 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.181 0.592 . . . . 0.0 110.943 176.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.575 HD11 HH21 ' A' ' 74' ' ' ARG . 12.5 mt -71.91 -29.78 34.65 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 O-C-N 124.106 0.879 . . . . 0.0 110.738 -176.049 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.78 -46.24 46.78 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.345 0.658 . . . . 0.0 110.828 177.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.406 ' HG3' HE21 ' A' ' 53' ' ' GLN . 50.8 mt-10 -67.26 -27.67 67.4 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.855 0.862 . . . . 0.0 111.553 178.186 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -56.19 99.04 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.514 0 O-C-N 124.476 1.11 . . . . 0.0 112.255 -175.074 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 29.1 m -60.99 -37.94 84.26 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 114.553 -1.203 . . . . 0.0 109.237 168.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.438 HD12 ' CE2' ' A' ' 34' ' ' TYR . 83.9 mt -134.22 140.18 46.61 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 C-N-CA 123.854 0.862 . . . . 0.0 110.262 179.805 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.43 HG23 HG13 ' A' ' 6' ' ' ILE . 24.9 mt -129.02 137.18 57.86 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 175.512 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.8 mp -128.4 113.09 28.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 CA-C-N 118.567 0.621 . . . . 0.0 110.104 175.362 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 6.1 m170 -88.24 86.08 7.02 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 121.388 0.614 . . . . 0.0 109.781 173.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.533 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 19.0 m -78.71 79.48 5.13 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 114.67 -1.15 . . . . 0.0 109.52 175.824 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.416 ' O ' ' HA ' ' A' ' 84' ' ' THR . 35.9 m -124.98 157.07 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 CA-C-O 121.869 0.842 . . . . 0.0 111.858 -170.265 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -112.59 -16.42 12.84 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 114.318 -1.31 . . . . 0.0 109.053 173.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 19.2 m -130.4 168.55 23.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 125.604 1.561 . . . . 0.0 109.234 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 64.9 m -78.61 112.95 30.53 Favored Pre-proline 0 CA--C 1.546 0.824 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 170.327 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.433 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 37.6 Cg_endo -63.76 150.26 88.86 Favored 'Trans proline' 0 C--N 1.376 2.009 0 C-N-CA 122.757 2.305 . . . . 0.0 112.367 -177.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -67.11 -23.98 65.88 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.176 0.59 . . . . 0.0 110.858 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -102.58 15.6 28.79 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.268 -0.878 . . . . 0.0 112.202 -177.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.433 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 25.6 t30 -53.35 -38.7 63.51 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.742 0.817 . . . . 0.0 111.777 179.482 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.55 -30.29 71.2 Favored 'General case' 0 N--CA 1.482 1.156 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 -176.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.575 HH21 HD11 ' A' ' 55' ' ' ILE . 43.5 mtp180 -62.55 -39.36 93.38 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-O 121.385 0.612 . . . . 0.0 111.842 174.555 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -97.37 -8.46 29.49 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.392 -175.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -64.63 -33.32 75.67 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.257 1.023 . . . . 0.0 111.115 -177.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 64.2 p -75.15 -17.13 60.46 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.656 0.782 . . . . 0.0 111.847 177.079 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.448 ' HG3' HG22 ' A' ' 55' ' ' ILE . 25.2 mmt180 -104.03 160.17 15.06 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.092 0.957 . . . . 0.0 111.091 -170.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -77.01 101.41 6.01 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.137 0.575 . . . . 0.0 110.145 174.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 80.9 t -111.9 138.7 39.65 Favored 'Isoleucine or valine' 0 C--O 1.238 0.493 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.395 -179.405 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -98.98 89.46 4.29 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 172.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -82.3 128.09 33.87 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.221 -176.363 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.529 HD12 ' HB3' ' A' ' 87' ' ' ASP . 47.2 pt -133.13 -171.78 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 C-N-CA 124.674 1.19 . . . . 0.0 108.953 178.773 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.416 ' HA ' ' O ' ' A' ' 65' ' ' VAL . 18.0 p -86.55 151.43 23.48 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 122.638 0.375 . . . . 0.0 110.262 168.554 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.702 HD13 ' SG ' ' A' ' 11' ' ' CYS . 6.4 tt -63.59 -30.76 71.83 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.59 178.617 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.466 ' HG2' ' HE2' ' A' ' 90' ' ' LYS . 9.4 tt0 -63.44 -41.61 98.67 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.49 175.531 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.529 ' HB3' HD12 ' A' ' 83' ' ' ILE . 8.8 t70 -61.53 -31.43 71.45 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.713 0.805 . . . . 0.0 111.097 -178.874 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.2 -45.43 88.34 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.262 0.625 . . . . 0.0 111.259 175.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 74.1 mt -67.05 -43.09 89.12 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.959 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.936 -176.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.466 ' HE2' ' HG2' ' A' ' 86' ' ' GLN . 0.2 OUTLIER -86.55 -38.25 17.36 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -174.981 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -119.62 30.89 6.83 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 122.943 0.497 . . . . 0.0 110.856 -166.277 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.662 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -45.68 -61.22 1.8 Allowed 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 123.817 0.847 . . . . 0.0 113.015 -176.352 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -58.03 -46.36 85.45 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.464 175.199 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.44 ' O ' ' HG2' ' A' ' 98' ' ' GLU . . . -54.97 -45.27 81.83 Favored Glycine 0 C--N 1.356 1.639 0 O-C-N 124.662 1.226 . . . . 0.0 113.931 -174.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 14.1 mt -62.61 -57.42 12.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 123.813 0.845 . . . . 0.0 109.378 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 96.5 mt -59.95 -44.85 95.43 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 CA-C-N 114.031 -1.44 . . . . 0.0 111.415 -172.759 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.69 -31.56 71.61 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.058 0.543 . . . . 0.0 111.936 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' A' ' 94' ' ' GLY . 51.4 mm-40 -63.85 -36.78 85.03 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 123.471 0.482 . . . . 0.0 110.2 176.138 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 16.0 mt -81.07 -32.39 12.42 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 -178.552 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -57.63 -50.89 71.65 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.448 1.099 . . . . 0.0 111.151 173.466 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -72.71 -35.09 67.52 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 123.647 0.592 . . . . 0.0 111.028 -176.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 64.4 mtm -63.47 -46.0 88.2 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 122.544 0.338 . . . . 0.0 110.43 177.549 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.426 ' HA ' ' HG2' ' A' ' 106' ' ' GLU . 19.7 mt -67.17 -40.85 86.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 O-C-N 123.631 0.582 . . . . 0.0 110.199 177.048 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.91 -24.72 67.61 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 122.933 0.493 . . . . 0.0 111.785 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 22.3 t -91.11 -33.43 15.46 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.087 0.555 . . . . 0.0 110.784 -176.111 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 0.426 ' HG2' ' HA ' ' A' ' 103' ' ' ILE . 13.2 pt-20 -81.42 -28.78 34.11 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 122.775 0.43 . . . . 0.0 110.876 -179.489 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 87.0 mm-40 -79.76 -36.46 37.17 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.031 0.533 . . . . 0.0 110.157 175.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 65.7 mm-40 . . . . . 0 CA--C 1.552 1.045 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 178.42 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.6 ttt . . . . . 0 N--CA 1.483 1.196 0 CA-C-O 120.686 0.279 . . . . 0.0 110.254 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.4 p -78.06 90.81 4.23 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 121.629 0.728 . . . . 0.0 109.535 178.188 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -89.72 -177.9 5.38 Favored 'General case' 0 C--O 1.252 1.209 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.423 -175.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.55 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.1 tmtp? -145.51 137.29 25.34 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 -178.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.413 ' N ' ' HD3' ' A' ' 4' ' ' LYS . 9.4 tt -122.88 135.2 54.43 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.651 1.18 . . . . 0.0 108.064 175.139 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.473 HG21 ' HB3' ' A' ' 54' ' ' ASP . 18.9 pt -125.92 160.96 32.08 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 170.283 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.615 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -149.68 164.47 35.13 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.934 176.681 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.5 tt -138.0 110.35 7.42 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 107.439 -1.319 . . . . 0.0 107.439 -177.335 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.525 ' HA ' ' O ' ' A' ' 64' ' ' SER . 60.2 m -99.18 107.5 19.86 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.065 0.946 . . . . 0.0 109.568 176.227 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -121.78 124.43 44.18 Favored 'General case' 0 N--CA 1.492 1.657 0 C-N-CA 122.566 0.346 . . . . 0.0 111.455 -177.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.792 ' SG ' HD13 ' A' ' 85' ' ' LEU . 36.9 m -127.76 146.27 58.17 Favored Pre-proline 0 N--CA 1.48 1.033 0 C-N-CA 123.847 0.859 . . . . 0.0 111.172 177.222 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -86.92 -13.78 4.49 Favored 'Trans proline' 0 C--N 1.369 1.629 0 C-N-CA 122.971 2.447 . . . . 0.0 111.984 168.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 23.0 mmt -79.54 -58.41 3.21 Favored 'General case' 0 C--N 1.355 0.813 0 C-N-CA 124.11 0.964 . . . . 0.0 110.298 -175.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -179.12 162.35 29.17 Favored Glycine 0 C--N 1.347 1.194 0 CA-C-N 115.564 -0.744 . . . . 0.0 112.77 -178.228 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 37.2 mt -70.81 -18.35 62.74 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 123.81 0.844 . . . . 0.0 111.714 178.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.42 -43.89 79.83 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-O 121.036 0.446 . . . . 0.0 110.903 174.375 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.461 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 3.9 t-160 -67.87 -41.7 82.45 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.234 -178.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.407 ' HA ' HD11 ' A' ' 85' ' ' LEU . 42.7 p -67.1 -36.33 81.72 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.429 -177.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.3 m-30 -72.45 -35.02 68.17 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.091 0.556 . . . . 0.0 111.394 -177.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 60.3 mtm -67.96 -35.82 79.03 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-O 120.592 0.234 . . . . 0.0 110.601 176.265 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -69.82 -41.56 74.82 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.386 0.674 . . . . 0.0 111.198 173.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.35 -39.76 89.38 Favored 'General case' 0 C--O 1.218 -0.571 0 C-N-CA 123.81 0.844 . . . . 0.0 110.899 -177.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.3 tp60 -70.55 -41.49 72.41 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 123.624 0.578 . . . . 0.0 109.903 -179.369 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.554 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -62.89 -52.24 63.84 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.434 -178.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 82.9 mt -65.1 -33.42 75.98 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.319 0.647 . . . . 0.0 111.501 178.283 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.474 ' O ' HG23 ' A' ' 30' ' ' VAL . 40.1 tt0 -60.42 -58.39 8.72 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 123.973 0.796 . . . . 0.0 110.587 179.55 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.536 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 29.8 mm-40 -53.65 -48.38 69.45 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 124.387 1.055 . . . . 0.0 111.119 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -57.68 -46.6 84.06 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 124.043 0.839 . . . . 0.0 111.789 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.56 -28.56 67.06 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 123.721 0.808 . . . . 0.0 113.08 178.051 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 26' ' ' GLU . 42.9 t -70.2 -40.15 77.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.83 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.536 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 8.0 mm-40 -70.85 -24.59 62.55 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 114.635 -1.166 . . . . 0.0 111.297 178.816 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -77.77 -7.33 56.41 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.36 0.664 . . . . 0.0 111.964 177.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 83.69 24.69 49.0 Favored Glycine 0 C--N 1.351 1.389 0 N-CA-C 114.668 0.627 . . . . 0.0 114.668 165.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -128.96 178.76 6.16 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-N 117.328 0.564 . . . . 0.0 111.311 173.107 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.55 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 41.2 tt0 -78.5 140.36 38.59 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.325 178.746 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.43 HG21 ' HA ' ' A' ' 26' ' ' GLU . 13.9 p -120.33 143.63 31.61 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 122.88 0.472 . . . . 0.0 110.204 178.648 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 49.3 tptt -149.3 115.86 5.87 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 173.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.615 HG12 ' HB3' ' A' ' 7' ' ' ALA . 51.0 mt -121.03 114.57 43.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -176.832 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.431 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 34.7 tt0 -75.71 143.22 42.21 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.089 0.956 . . . . 0.0 109.167 171.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.492 HG22 ' HB2' ' A' ' 9' ' ' CYS . 1.9 p -127.93 103.54 7.31 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.087 0.555 . . . . 0.0 110.2 -179.132 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -94.56 137.56 33.53 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 122.852 0.461 . . . . 0.0 110.373 -179.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -156.2 169.13 33.69 Favored Glycine 0 C--N 1.337 0.592 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.467 176.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.03 -29.36 69.67 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.545 0.738 . . . . 0.0 111.614 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -71.91 -39.35 69.58 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.036 0.935 . . . . 0.0 110.535 177.092 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 161.28 -177.55 37.57 Favored Glycine 0 C--N 1.345 1.066 0 CA-C-N 115.949 -0.569 . . . . 0.0 112.643 -178.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 73.6 mt -111.52 122.44 65.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 123.783 0.833 . . . . 0.0 110.08 179.175 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.441 ' HB3' ' OG1' ' A' ' 40' ' ' THR . 6.5 tp-100 -105.47 147.01 28.77 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.476 1.11 . . . . 0.0 110.688 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 17.8 t30 79.06 -51.92 0.44 Allowed 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 126.734 2.014 . . . . 0.0 111.582 172.455 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 21.6 tpp180 63.57 121.63 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.686 1.594 . . . . 0.0 113.549 173.088 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.431 ' HG ' ' HB2' ' A' ' 39' ' ' GLU . 45.1 mt -82.25 127.96 33.71 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.458 172.396 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.401 ' O ' HG13 ' A' ' 55' ' ' ILE . 43.8 p -90.2 160.74 16.06 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.039 176.475 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.24 -27.03 66.88 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 122.848 0.459 . . . . 0.0 111.481 177.088 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -69.29 -40.15 77.89 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.73 0.812 . . . . 0.0 111.113 175.16 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.473 ' HB3' HG21 ' A' ' 6' ' ' ILE . 53.7 m-20 -58.32 -47.75 82.72 Favored 'General case' 0 N--CA 1.483 1.212 0 O-C-N 123.35 0.406 . . . . 0.0 110.249 174.421 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.522 HG22 ' HG3' ' A' ' 78' ' ' ARG . 24.8 mt -68.47 -29.64 44.76 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.069 0 O-C-N 124.618 1.199 . . . . 0.0 111.024 -177.684 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.445 ' HA ' HH21 ' A' ' 78' ' ' ARG . . . -71.68 -49.05 43.2 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.68 0.792 . . . . 0.0 111.552 179.458 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -84.82 -12.54 53.37 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.421 0.688 . . . . 0.0 112.157 -175.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.9 99.0 0.11 Allowed 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.546 0.739 . . . . 0.0 111.834 -178.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 25.2 m -61.59 -34.86 76.35 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 124.268 1.027 . . . . 0.0 109.797 170.682 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.561 HG23 HG21 ' A' ' 99' ' ' ILE . 81.5 mt -130.45 138.14 54.51 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 C-N-CA 124.416 1.087 . . . . 0.0 109.61 179.55 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.401 HG23 HG13 ' A' ' 6' ' ' ILE . 34.8 mt -133.06 132.27 58.81 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.358 0 C-N-CA 123.721 0.809 . . . . 0.0 108.821 174.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -121.14 117.01 51.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 174.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 9.9 m170 -90.84 84.52 5.83 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-N 118.879 0.763 . . . . 0.0 108.972 170.01 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.525 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 20.7 p -83.22 81.83 8.53 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 114.674 -1.148 . . . . 0.0 108.763 176.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 34.8 m -128.57 158.31 40.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 CA-C-O 121.699 0.762 . . . . 0.0 111.957 -168.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -111.71 -11.9 13.93 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.013 1.325 . . . . 0.0 109.363 172.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 11.5 m -135.47 151.73 30.59 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 125.397 1.479 . . . . 0.0 108.909 178.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 25.6 m -65.3 110.79 4.77 Favored Pre-proline 0 CA--C 1.55 0.976 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 173.087 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -62.66 153.3 72.91 Favored 'Trans proline' 0 C--N 1.379 2.137 0 C-N-CA 122.342 2.028 . . . . 0.0 112.912 -174.005 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -76.58 -25.4 53.93 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.444 0.698 . . . . 0.0 111.001 -177.236 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -96.02 10.43 37.48 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.813 0.845 . . . . 0.0 111.252 179.127 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.5 -32.95 69.29 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 124.074 0.95 . . . . 0.0 111.354 -174.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.421 ' HA ' ' HB2' ' A' ' 76' ' ' GLU . 0.4 OUTLIER -65.66 -24.87 67.12 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.154 0.581 . . . . 0.0 112.359 178.777 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 77.3 mtt180 -70.5 -23.37 62.65 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.254 0.622 . . . . 0.0 111.646 173.194 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.416 ' HB3' HG21 ' A' ' 80' ' ' VAL . 56.8 m-85 -105.37 2.43 28.77 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.148 0.979 . . . . 0.0 111.301 -179.501 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.421 ' HB2' ' HA ' ' A' ' 73' ' ' GLU . 29.2 tt0 -61.61 -50.39 72.77 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.876 0.87 . . . . 0.0 111.909 -172.446 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 69.7 p -82.71 0.26 44.22 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.054 0.541 . . . . 0.0 111.841 -178.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.522 ' HG3' HG22 ' A' ' 55' ' ' ILE . 15.8 mmt180 -102.4 149.32 24.48 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.634 0.774 . . . . 0.0 110.71 176.343 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -79.37 92.28 5.17 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.712 0.805 . . . . 0.0 110.624 -178.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.416 HG21 ' HB3' ' A' ' 75' ' ' PHE . 45.1 t -98.49 144.79 10.98 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.788 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.096 -179.728 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 -102.45 92.2 4.58 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.82 1.248 . . . . 0.0 107.858 174.61 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -83.16 121.62 27.31 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.579 0.752 . . . . 0.0 110.708 -175.306 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.498 HG13 ' HA ' ' A' ' 64' ' ' SER . 43.9 pt -130.55 -177.59 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 124.675 1.19 . . . . 0.0 109.25 177.391 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 18.5 p -83.79 149.28 26.53 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 167.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.792 HD13 ' SG ' ' A' ' 11' ' ' CYS . 7.7 tt -63.09 -29.22 70.63 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.358 0.663 . . . . 0.0 111.816 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.555 ' HG2' ' HE3' ' A' ' 90' ' ' LYS . 29.4 tt0 -60.22 -41.78 93.79 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.445 0.698 . . . . 0.0 110.755 175.072 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.459 ' HB3' HD12 ' A' ' 83' ' ' ILE . 24.1 t70 -63.18 -32.46 73.86 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.674 0.79 . . . . 0.0 110.728 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.403 ' HB2' ' HB2' ' A' ' 64' ' ' SER . . . -63.74 -29.9 71.06 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.749 0.82 . . . . 0.0 112.697 179.132 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 65.8 mt -83.54 -54.0 10.08 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 C-N-CA 123.603 0.761 . . . . 0.0 110.062 -178.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.555 ' HE3' ' HG2' ' A' ' 86' ' ' GLN . 18.5 ptpt -72.8 -45.4 58.68 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.117 0.567 . . . . 0.0 112.33 -175.256 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -108.61 24.07 13.6 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.185 0.994 . . . . 0.0 110.594 -169.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.554 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -41.73 -62.2 0.94 Allowed 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.286 1.034 . . . . 0.0 113.672 -175.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -63.35 -36.29 83.2 Favored 'General case' 0 C--N 1.34 0.179 0 CA-C-N 114.922 -1.036 . . . . 0.0 110.806 179.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -61.07 -48.06 88.0 Favored Glycine 0 C--N 1.354 1.546 0 O-C-N 124.703 1.252 . . . . 0.0 112.526 -178.3 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 35.9 mt -56.99 -57.89 8.03 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 C-N-CA 124.597 1.159 . . . . 0.0 110.31 -179.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.9 mp -56.31 -51.65 61.15 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.912 0 O-C-N 124.257 0.973 . . . . 0.0 111.296 -177.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.31 -31.16 72.15 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 -176.758 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -67.19 -36.96 82.84 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 122.877 0.471 . . . . 0.0 110.217 177.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.561 HG21 HG23 ' A' ' 60' ' ' ILE . 56.4 mt -76.47 -37.49 30.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -177.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -57.55 -52.66 64.51 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 114.191 -1.368 . . . . 0.0 111.257 176.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -69.96 -33.51 72.19 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 123.632 0.582 . . . . 0.0 111.534 -177.794 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 67.7 mtm -65.0 -56.9 10.44 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 122.386 0.274 . . . . 0.0 110.817 178.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 48.2 mt -64.35 -39.72 86.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 O-C-N 123.677 0.61 . . . . 0.0 111.037 -179.231 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.43 ' HA ' ' HG2' ' A' ' 107' ' ' GLN . . . -67.55 -37.4 82.64 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.659 0.384 . . . . 0.0 111.433 179.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 33.9 t -68.48 -39.1 81.49 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 122.351 0.26 . . . . 0.0 110.848 -175.365 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -79.98 -29.67 39.57 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 116.106 -0.497 . . . . 0.0 112.173 -178.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.43 ' HG2' ' HA ' ' A' ' 104' ' ' ALA . 3.0 pt20 -85.08 -28.78 25.39 Favored 'General case' 0 N--CA 1.487 1.418 0 CA-C-N 117.991 0.359 . . . . 0.0 111.203 -178.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 . . . . . 0 C--O 1.249 1.034 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 179.037 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mpt? . . . . . 0 N--CA 1.479 1.009 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.9 t -84.28 126.35 33.1 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 171.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.8 pttm -73.36 161.98 29.85 Favored 'General case' 0 C--O 1.242 0.693 0 C-N-CA 123.187 0.595 . . . . 0.0 110.617 178.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.604 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.4 tmtp? -144.37 140.24 28.94 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 -169.736 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.515 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 9.9 tt -132.26 136.68 47.13 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 178.431 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.511 HD12 HD13 ' A' ' 50' ' ' LEU . 15.8 pt -128.15 161.14 37.1 Favored 'Isoleucine or valine' 0 C--O 1.244 0.769 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 173.715 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.592 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -147.21 168.16 22.39 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.99 177.854 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.0 tt -142.07 113.62 7.8 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 -178.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.52 ' HA ' ' O ' ' A' ' 64' ' ' SER . 56.0 m -103.28 111.42 23.81 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.696 0.798 . . . . 0.0 108.851 177.16 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.451 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -123.31 127.29 48.33 Favored 'General case' 0 N--CA 1.497 1.919 0 C-N-CA 122.521 0.328 . . . . 0.0 111.44 -177.663 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.798 ' SG ' HD13 ' A' ' 85' ' ' LEU . 56.0 m -130.79 145.45 57.74 Favored Pre-proline 0 N--CA 1.481 1.087 0 C-N-CA 123.866 0.866 . . . . 0.0 111.768 -178.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -79.37 -28.16 3.82 Favored 'Trans proline' 0 C--N 1.375 1.929 0 C-N-CA 122.866 2.377 . . . . 0.0 111.466 167.513 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 12.2 tpt -69.74 -50.77 40.27 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.012 0.925 . . . . 0.0 110.744 179.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 155.68 -176.79 33.11 Favored Glycine 0 C--N 1.345 1.053 0 N-CA-C 114.178 0.431 . . . . 0.0 114.178 175.605 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 71.0 mt -73.62 -20.18 60.66 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.974 0.909 . . . . 0.0 113.393 -172.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -58.82 -42.66 89.74 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-N 118.574 0.625 . . . . 0.0 110.619 176.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.479 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 7.2 t-160 -67.1 -43.27 82.93 Favored 'General case' 0 C--O 1.246 0.919 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.866 178.28 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 34.7 p -65.8 -31.26 72.13 Favored 'General case' 0 C--N 1.353 0.76 0 CA-C-N 115.509 -0.769 . . . . 0.0 111.558 -177.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -74.15 -33.42 63.5 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 119.028 -0.51 . . . . 0.0 111.192 -178.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 64.6 mtm -65.05 -35.82 82.37 Favored 'General case' 0 N--CA 1.492 1.66 0 CA-C-O 120.961 0.41 . . . . 0.0 110.87 173.275 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.48 -48.67 54.66 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.999 177.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.68 -36.13 82.82 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 124.32 1.048 . . . . 0.0 110.946 -177.301 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -71.04 -41.11 71.24 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 -176.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -72.97 -38.95 66.5 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.919 -178.166 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 76.5 mt -71.68 -33.41 68.81 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.079 0.552 . . . . 0.0 110.784 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.447 ' O ' HG23 ' A' ' 30' ' ' VAL . 37.4 tt0 -61.29 -55.86 27.11 Favored 'General case' 0 C--N 1.35 0.599 0 O-C-N 124.019 0.824 . . . . 0.0 109.209 177.721 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.434 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 44.8 mt-10 -56.22 -48.25 76.82 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 124.36 1.037 . . . . 0.0 110.717 -178.414 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.47 -47.46 79.15 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.119 0.968 . . . . 0.0 111.548 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.03 -22.18 62.18 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.186 0.994 . . . . 0.0 113.537 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 26' ' ' GLU . 37.6 t -79.93 -41.55 21.55 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 -179.425 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 6.9 mm-40 -72.21 -21.72 61.37 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 114.465 -1.243 . . . . 0.0 110.102 175.422 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.437 ' HB1' ' HE1' ' A' ' 34' ' ' TYR . . . -75.61 -31.25 59.83 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 114.726 -1.125 . . . . 0.0 111.436 173.679 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 98.77 22.79 12.93 Favored Glycine 0 C--N 1.344 1.019 0 CA-C-N 115.833 -0.621 . . . . 0.0 114.095 171.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.437 ' HE1' ' HB1' ' A' ' 32' ' ' ALA . 2.5 m-85 -99.75 163.51 12.44 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 171.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.604 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 35.1 tt0 -74.33 130.42 39.65 Favored 'General case' 0 C--O 1.217 -0.646 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 159.636 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.515 ' HA ' ' O ' ' A' ' 5' ' ' LEU . 9.3 p -119.28 134.46 62.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 CA-C-N 119.133 0.879 . . . . 0.0 110.9 -173.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 45.2 tptt -141.0 120.45 13.16 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.592 HG12 ' HB3' ' A' ' 7' ' ' ALA . 43.1 mt -122.28 122.94 67.64 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 C-N-CA 122.712 0.405 . . . . 0.0 112.08 -175.325 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 76.9 tt0 -88.53 116.0 26.46 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.493 1.117 . . . . 0.0 109.904 175.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.511 HG22 ' HB2' ' A' ' 9' ' ' CYS . 24.3 p -100.85 104.96 16.2 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 122.521 0.328 . . . . 0.0 110.366 177.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.451 ' O ' ' HA ' ' A' ' 10' ' ' ALA . 13.9 mt-30 -96.66 144.0 27.1 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.237 0.615 . . . . 0.0 109.45 175.802 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -167.98 177.47 42.19 Favored Glycine 0 C--N 1.335 0.49 0 C-N-CA 121.716 -0.278 . . . . 0.0 112.568 179.419 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.79 -29.27 69.34 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.535 0.734 . . . . 0.0 111.958 179.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -67.53 -42.32 82.93 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.407 0.683 . . . . 0.0 110.205 174.037 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 153.77 -173.01 32.51 Favored Glycine 0 C--N 1.341 0.811 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.93 -176.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 72.6 mt -101.59 135.57 37.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 176.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.416 ' HB3' ' OG1' ' A' ' 40' ' ' THR . 9.1 tp-100 -132.16 144.78 50.91 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.386 0.674 . . . . 0.0 110.383 -172.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 42.2 t30 74.39 -64.87 0.37 Allowed 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 126.43 1.892 . . . . 0.0 108.855 -177.618 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 22.6 ttt-85 63.73 129.19 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 127.048 2.139 . . . . 0.0 113.947 172.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.511 HD13 HD12 ' A' ' 6' ' ' ILE . 26.9 mt -77.76 148.63 34.74 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 113.837 -1.529 . . . . 0.0 110.272 175.884 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 58.5 p -113.72 170.14 8.47 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.505 176.347 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -57.19 -33.41 67.46 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.382 0.673 . . . . 0.0 111.222 -179.211 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -61.17 -54.95 37.95 Favored 'General case' 0 C--N 1.35 0.608 0 O-C-N 124.256 0.972 . . . . 0.0 109.667 175.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 53.1 m-20 -54.56 -41.82 70.26 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 123.966 0.906 . . . . 0.0 112.239 -176.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.673 HD11 HH21 ' A' ' 74' ' ' ARG . 40.4 mt -71.11 -33.47 51.39 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 O-C-N 123.874 0.734 . . . . 0.0 110.604 -176.39 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.23 -39.63 65.34 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.475 0.71 . . . . 0.0 111.299 176.203 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -69.25 -32.28 71.37 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.881 0.872 . . . . 0.0 110.95 179.425 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -56.57 101.88 0.07 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.884 1.274 . . . . 0.0 113.216 -172.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 27.4 m -61.11 -39.59 90.55 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.759 0.824 . . . . 0.0 109.12 165.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.52 HG23 HG21 ' A' ' 99' ' ' ILE . 53.0 mt -127.22 144.37 37.51 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 C-N-CA 123.746 0.818 . . . . 0.0 110.581 179.149 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 28.1 mt -134.42 120.28 32.75 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 C-N-CA 124.014 0.926 . . . . 0.0 108.839 172.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.6 mp -109.46 119.77 59.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 175.167 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . 0.438 ' HB2' ' HG3' ' A' ' 82' ' ' GLU . 12.6 m170 -92.44 83.92 5.05 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-O 121.747 0.784 . . . . 0.0 108.944 168.61 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.52 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 24.8 p -80.45 83.58 6.24 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 114.236 -1.347 . . . . 0.0 109.072 175.551 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 33.7 m -128.29 156.58 40.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 CA-C-O 121.872 0.844 . . . . 0.0 112.29 -169.126 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -109.3 -21.44 12.54 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 113.633 -1.622 . . . . 0.0 109.002 173.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 6.2 m -137.13 148.48 26.29 Favored 'Isoleucine or valine' 0 C--N 1.35 0.613 0 C-N-CA 125.519 1.528 . . . . 0.0 108.015 175.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 67.6 m -59.27 116.18 15.1 Favored Pre-proline 0 CA--C 1.548 0.899 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 176.075 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.407 ' HG2' ' HB3' ' A' ' 72' ' ' ASN . 39.9 Cg_endo -64.29 151.46 85.32 Favored 'Trans proline' 0 C--N 1.381 2.241 0 C-N-CA 122.86 2.373 . . . . 0.0 111.475 -176.514 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -64.62 -36.72 85.15 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-O 121.619 0.723 . . . . 0.0 110.408 -178.34 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.509 ' HB3' ' HD3' ' A' ' 74' ' ' ARG . 2.2 m-20 -91.49 13.21 18.33 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.486 1.115 . . . . 0.0 111.919 -173.764 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.407 ' HB3' ' HG2' ' A' ' 69' ' ' PRO . 4.8 p30 -56.15 -30.3 61.98 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 124.372 1.069 . . . . 0.0 112.154 -177.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -61.08 -33.61 73.62 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.67 1.188 . . . . 0.0 112.457 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.673 HH21 HD11 ' A' ' 55' ' ' ILE . 27.3 mtp180 -65.11 -29.34 70.2 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.436 1.094 . . . . 0.0 112.007 177.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -100.24 -11.74 20.12 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 114.913 -1.04 . . . . 0.0 111.84 -175.213 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -56.86 -35.27 68.68 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.373 1.069 . . . . 0.0 111.92 -177.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 34.7 t -73.53 -19.01 61.02 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.852 0.861 . . . . 0.0 112.507 -178.608 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.59 ' HG3' HG22 ' A' ' 55' ' ' ILE . 32.3 mmt180 -111.44 173.59 6.27 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.531 0.733 . . . . 0.0 111.781 -171.209 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -84.33 97.68 9.59 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.758 0.823 . . . . 0.0 110.387 -177.289 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 39.3 t -105.87 153.14 7.39 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 CA-C-N 114.966 -1.016 . . . . 0.0 110.255 -179.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 66.3 m-85 -124.36 91.39 3.44 Favored 'General case' 0 C--O 1.243 0.72 0 C-N-CA 124.815 1.246 . . . . 0.0 107.895 179.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.438 ' HG3' ' HB2' ' A' ' 63' ' ' HIS . 2.2 mp0 -77.08 126.86 31.65 Favored 'General case' 0 C--N 1.353 0.746 0 C-N-CA 122.916 0.486 . . . . 0.0 110.714 -177.613 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.454 HG13 ' HA ' ' A' ' 64' ' ' SER . 43.4 pt -136.46 -178.58 2.43 Favored 'Isoleucine or valine' 0 C--O 1.246 0.911 0 C-N-CA 125.327 1.451 . . . . 0.0 108.317 177.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 23.5 p -83.39 147.44 27.89 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.102 0.477 . . . . 0.0 109.825 169.118 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.798 HD13 ' SG ' ' A' ' 11' ' ' CYS . 8.1 tt -65.85 -28.29 68.86 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.929 179.404 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.434 ' O ' ' HG2' ' A' ' 90' ' ' LYS . 28.6 tt0 -62.6 -44.96 95.01 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.555 0.742 . . . . 0.0 110.428 174.107 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -60.82 -30.95 70.4 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.758 0.823 . . . . 0.0 110.609 179.253 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.7 -21.57 63.48 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.956 0.902 . . . . 0.0 113.318 178.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 65.5 mt -89.27 -41.82 14.1 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 C-N-CA 123.622 0.769 . . . . 0.0 110.36 -179.163 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.434 ' HG2' ' O ' ' A' ' 86' ' ' GLN . 16.2 ptpt -92.68 -47.44 7.09 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.016 0.526 . . . . 0.0 112.172 -174.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -99.48 18.55 17.58 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 123.746 0.818 . . . . 0.0 111.477 -173.296 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.498 ' HA ' HD12 ' A' ' 95' ' ' ILE . . . -45.66 -57.98 3.8 Favored 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 124.158 0.983 . . . . 0.0 113.527 -171.522 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.48 -38.77 81.68 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.39 0.676 . . . . 0.0 111.014 179.041 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -61.77 -46.48 94.09 Favored Glycine 0 C--N 1.352 1.454 0 O-C-N 124.462 1.101 . . . . 0.0 112.696 -179.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.498 HD12 ' HA ' ' A' ' 92' ' ' ALA . 16.8 mt -57.72 -57.95 8.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 124.137 0.975 . . . . 0.0 110.22 -179.752 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.476 ' O ' ' HG3' ' A' ' 100' ' ' GLU . 2.2 mp -57.52 -51.98 62.9 Favored 'Isoleucine or valine' 0 C--N 1.357 0.926 0 O-C-N 124.131 0.894 . . . . 0.0 110.647 -176.51 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -32.14 71.98 Favored 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -175.412 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -65.01 -37.52 87.93 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 123.806 0.691 . . . . 0.0 110.137 176.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.52 HG21 HG23 ' A' ' 60' ' ' ILE . 25.8 mt -79.93 -31.94 13.79 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.834 -178.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.476 ' HG3' ' O ' ' A' ' 96' ' ' ILE . 36.2 mt-10 -59.71 -50.59 73.26 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.396 0.678 . . . . 0.0 110.621 177.319 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -68.99 -36.99 78.47 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 123.835 0.71 . . . . 0.0 111.083 -177.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 71.4 mtm -60.43 -54.04 50.34 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 122.421 0.289 . . . . 0.0 110.323 176.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.5 HD12 HG12 ' A' ' 60' ' ' ILE . 39.7 mt -67.3 -35.71 74.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 123.288 0.635 . . . . 0.0 111.523 -178.358 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.73 -36.72 83.12 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.041 0.537 . . . . 0.0 110.47 178.85 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 70.0 m -79.49 -27.08 41.5 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 122.918 0.487 . . . . 0.0 111.383 -174.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -85.79 -33.44 21.38 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 122.377 0.271 . . . . 0.0 111.639 177.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.494 ' HG3' HE21 ' A' ' 108' ' ' GLN . 4.4 pt20 -80.47 -30.16 37.44 Favored 'General case' 0 N--CA 1.487 1.416 0 CA-C-N 118.086 0.403 . . . . 0.0 111.186 -179.273 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.494 HE21 ' HG3' ' A' ' 107' ' ' GLN . 23.5 mm-40 . . . . . 0 C--O 1.248 1.015 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 175.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.0 mtt . . . . . 0 N--CA 1.484 1.239 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.6 t -76.67 94.88 3.86 Favored 'General case' 0 C--N 1.348 0.522 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 171.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.405 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 3.3 pttt -102.3 178.92 4.46 Favored 'General case' 0 C--O 1.251 1.139 0 C-N-CA 123.985 0.914 . . . . 0.0 110.348 179.777 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.551 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.2 tmtp? -143.69 140.38 30.01 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.615 -0.721 . . . . 0.0 109.163 -175.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.479 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 8.8 tt -126.25 137.19 53.5 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 176.718 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.442 HD12 HD13 ' A' ' 50' ' ' LEU . 16.4 pt -128.88 161.75 37.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 172.447 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.609 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -147.63 168.06 22.99 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.111 0.481 . . . . 0.0 109.86 176.427 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.6 tt -138.65 114.34 9.86 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.515 ' HA ' ' O ' ' A' ' 64' ' ' SER . 80.5 m -106.4 107.65 18.77 Favored 'General case' 0 C--O 1.218 -0.583 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 177.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.424 ' HA ' ' O ' ' A' ' 41' ' ' GLN . . . -125.97 122.95 37.39 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.025 0.53 . . . . 0.0 110.939 -177.346 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.821 ' SG ' HD13 ' A' ' 85' ' ' LEU . 2.9 m -140.42 146.78 46.8 Favored Pre-proline 0 N--CA 1.477 0.901 0 C-N-CA 123.682 0.793 . . . . 0.0 111.113 178.194 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -85.49 0.78 8.5 Favored 'Trans proline' 0 C--N 1.377 2.069 0 C-N-CA 123.596 2.864 . . . . 0.0 112.19 -179.469 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 27.0 mmt -88.38 -26.01 22.41 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.24 1.016 . . . . 0.0 110.644 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 135.93 177.04 14.69 Favored Glycine 0 C--N 1.344 0.992 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.809 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 47.0 mt -75.53 -13.88 60.38 Favored 'General case' 0 C--N 1.352 0.678 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -179.563 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.23 -46.49 89.57 Favored 'General case' 0 C--O 1.249 1.053 0 CA-C-O 121.168 0.509 . . . . 0.0 110.877 177.2 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.44 ' HD1' ' HG ' ' A' ' 11' ' ' CYS . 12.3 t-160 -65.38 -43.53 90.45 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.742 179.591 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.404 ' HA ' HD11 ' A' ' 85' ' ' LEU . 31.2 p -65.71 -36.0 82.36 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.471 -176.681 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.0 m-30 -70.41 -32.56 70.23 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.381 0.672 . . . . 0.0 111.342 -179.05 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . 0.406 ' HB2' ' HE3' ' A' ' 20' ' ' MET . 65.2 mtm -67.15 -37.96 84.69 Favored 'General case' 0 N--CA 1.484 1.275 0 CA-C-O 120.888 0.375 . . . . 0.0 110.762 175.333 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.38 -39.32 81.77 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.989 173.58 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.06 -40.57 91.02 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.668 0.787 . . . . 0.0 110.662 -178.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -61.4 -51.36 69.06 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.604 0.762 . . . . 0.0 109.616 177.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.405 ' HB1' ' HB2' ' A' ' 92' ' ' ALA . . . -64.52 -48.44 75.09 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 114.765 -1.107 . . . . 0.0 112.502 -174.314 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 91.4 mt -66.12 -33.0 74.79 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.421 0.689 . . . . 0.0 111.69 179.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.502 ' HA ' HG21 ' A' ' 36' ' ' VAL . 32.4 tt0 -64.03 -52.21 60.52 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 123.584 0.552 . . . . 0.0 110.02 178.816 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -54.42 -48.63 71.42 Favored 'General case' 0 N--CA 1.481 1.079 0 O-C-N 124.213 0.945 . . . . 0.0 110.572 179.322 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -59.9 -47.37 86.03 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.603 1.161 . . . . 0.0 111.955 -178.035 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.42 -28.29 67.78 Favored 'General case' 0 N--CA 1.476 0.866 0 CA-C-N 115.068 -0.969 . . . . 0.0 112.842 178.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 26' ' ' GLU . 41.1 t -72.0 -38.11 62.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 178.296 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -67.88 -25.21 65.4 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.578 1.151 . . . . 0.0 111.317 176.394 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -80.88 -9.39 59.83 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 123.847 0.859 . . . . 0.0 112.075 177.298 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.62 2.81 67.09 Favored Glycine 0 C--N 1.347 1.167 0 N-CA-C 115.442 0.937 . . . . 0.0 115.442 166.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.405 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.1 OUTLIER -113.92 178.66 4.2 Favored 'General case' 0 N--CA 1.49 1.527 0 CA-C-N 117.746 0.773 . . . . 0.0 111.751 179.849 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.551 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 38.9 tt0 -76.47 153.73 35.33 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 123.926 0.766 . . . . 0.0 109.366 178.154 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.502 HG21 ' HA ' ' A' ' 26' ' ' GLU . 7.2 p -136.49 138.83 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 123.073 0.549 . . . . 0.0 110.284 178.493 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 43.7 tptt -146.8 122.1 10.25 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 175.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.609 HG12 ' HB3' ' A' ' 7' ' ' ALA . 45.7 mt -122.69 113.0 36.46 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 123.098 0.559 . . . . 0.0 111.788 -173.433 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 68.8 tt0 -81.25 107.46 14.06 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.669 0.788 . . . . 0.0 109.667 174.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.48 HG22 ' HB2' ' A' ' 9' ' ' CYS . 22.3 p -88.72 109.31 20.04 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.233 0.613 . . . . 0.0 110.15 175.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.517 HE22 ' HB2' ' A' ' 70' ' ' GLU . 42.0 mt-30 -103.6 155.42 18.56 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.685 0.755 . . . . 0.0 111.542 178.182 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 178.52 167.95 37.08 Favored Glycine 0 C--O 1.24 0.474 0 CA-C-N 114.529 -1.214 . . . . 0.0 110.406 172.285 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.12 -19.49 65.63 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-N 116.944 0.372 . . . . 0.0 110.2 173.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -64.63 -40.74 96.01 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 124.548 1.139 . . . . 0.0 110.856 171.178 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 162.47 -176.68 38.8 Favored Glycine 0 C--N 1.344 1.003 0 CA-C-N 115.43 -0.805 . . . . 0.0 112.176 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.532 HD13 ' NH2' ' A' ' 49' ' ' ARG . 85.0 mt -129.25 134.24 64.22 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 C-N-CA 123.972 0.909 . . . . 0.0 108.789 176.123 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 9.7 tp-100 -140.8 149.65 42.31 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.013 0.925 . . . . 0.0 110.398 -172.141 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.455 ' HB3' ' O ' ' A' ' 38' ' ' ILE . 33.8 t30 57.22 34.42 24.77 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 125.275 1.43 . . . . 0.0 110.392 177.377 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.532 ' NH2' HD13 ' A' ' 46' ' ' ILE . 20.4 ttm180 -57.39 131.51 50.31 Favored 'General case' 0 C--N 1.351 0.664 0 C-N-CA 124.695 1.198 . . . . 0.0 112.737 -171.209 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.594 ' HB2' HH22 ' A' ' 74' ' ' ARG . 27.8 mt -72.95 149.04 43.7 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 113.871 -1.513 . . . . 0.0 110.961 177.246 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.431 ' O ' HG13 ' A' ' 55' ' ' ILE . 42.7 p -103.38 174.3 5.93 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.287 173.409 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.72 -31.42 71.58 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 122.716 0.406 . . . . 0.0 110.631 173.44 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -66.23 -42.36 88.79 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.883 0.873 . . . . 0.0 110.686 178.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -57.19 -48.92 77.55 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.423 0.689 . . . . 0.0 111.035 175.881 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.677 HD11 HH21 ' A' ' 74' ' ' ARG . 23.1 mt -69.21 -36.39 72.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 O-C-N 124.143 0.902 . . . . 0.0 111.24 -175.292 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.75 -46.16 69.58 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.831 0.853 . . . . 0.0 111.451 -178.156 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -84.96 -10.73 56.75 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.248 0.619 . . . . 0.0 111.557 -178.061 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.95 106.93 1.12 Allowed 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.339 0.656 . . . . 0.0 110.761 178.165 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 13.7 m -63.35 -36.0 82.26 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.27 1.028 . . . . 0.0 109.831 169.495 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.513 HG23 HG21 ' A' ' 99' ' ' ILE . 75.8 mt -132.07 140.83 46.98 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 124.193 0.997 . . . . 0.0 110.082 -177.716 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 32.4 mt -135.96 125.43 39.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 C-N-CA 123.746 0.818 . . . . 0.0 108.964 174.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.3 mp -112.28 127.96 69.18 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 175.394 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . 0.405 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 5.7 m170 -99.82 86.15 3.24 Favored 'General case' 0 N--CA 1.486 1.353 0 CA-C-O 121.773 0.797 . . . . 0.0 109.111 169.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.515 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 19.7 m -81.09 81.63 7.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 114.254 -1.339 . . . . 0.0 109.173 175.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 34.9 m -128.5 159.68 39.74 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.413 0 CA-C-O 121.741 0.782 . . . . 0.0 111.608 -171.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -110.43 -25.4 10.08 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 114.494 -1.23 . . . . 0.0 108.994 172.411 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 14.6 m -135.96 164.39 32.18 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 C-N-CA 125.523 1.529 . . . . 0.0 108.868 -178.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 96.2 m -68.53 114.1 19.89 Favored Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 122.999 0.52 . . . . 0.0 110.272 -179.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.561 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 46.1 Cg_endo -68.45 152.97 74.87 Favored 'Trans proline' 0 C--N 1.382 2.323 0 C-N-CA 122.445 2.097 . . . . 0.0 112.489 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.517 ' HB2' HE22 ' A' ' 41' ' ' GLN . 40.1 mm-40 -67.29 -29.31 68.88 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.368 0.667 . . . . 0.0 111.637 -175.581 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.487 ' HB3' ' HD3' ' A' ' 74' ' ' ARG . 2.1 m-20 -104.32 18.69 21.64 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.607 -175.251 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.561 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 41.7 t30 -57.62 -35.46 70.5 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.166 0.986 . . . . 0.0 112.341 -177.654 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.53 -31.37 72.51 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 123.385 0.674 . . . . 0.0 112.632 -179.745 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.677 HH21 HD11 ' A' ' 55' ' ' ILE . 35.5 mtp180 -59.26 -33.79 71.47 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.87 0.868 . . . . 0.0 112.416 175.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -98.95 -16.49 18.74 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 115.083 -0.962 . . . . 0.0 111.448 -175.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -54.97 -33.43 62.44 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 124.14 0.976 . . . . 0.0 112.39 -176.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 40.4 p -78.75 -6.39 55.76 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.793 0.837 . . . . 0.0 112.909 -177.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.57 ' HG3' HG22 ' A' ' 55' ' ' ILE . 25.2 mmt180 -120.24 171.13 8.72 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.909 0.884 . . . . 0.0 111.343 -172.58 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -78.37 92.69 4.59 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.361 0.665 . . . . 0.0 110.014 -177.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 43.6 t -109.05 139.48 31.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 123.169 0.588 . . . . 0.0 110.946 -177.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -108.11 91.01 3.47 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.981 1.312 . . . . 0.0 107.92 -179.299 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.405 ' HG2' ' HB2' ' A' ' 63' ' ' HIS . 44.7 mt-10 -78.41 128.89 34.27 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.526 -177.016 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.423 HG13 ' HA ' ' A' ' 64' ' ' SER . 40.9 pt -141.87 -174.85 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 C-N-CA 125.433 1.493 . . . . 0.0 108.819 -179.408 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 25.5 p -83.34 148.83 27.11 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.033 0.444 . . . . 0.0 109.956 167.523 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.821 HD13 ' SG ' ' A' ' 11' ' ' CYS . 7.8 tt -63.68 -29.91 71.08 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.285 177.098 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.523 ' HG2' ' HE3' ' A' ' 90' ' ' LYS . 27.6 tt0 -70.15 -36.27 74.63 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.954 178.323 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -60.64 -33.23 72.48 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.703 0.801 . . . . 0.0 110.367 173.491 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.1 -20.63 64.94 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.827 0.851 . . . . 0.0 113.274 178.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 68.4 mt -87.32 -55.26 6.69 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 123.189 0.595 . . . . 0.0 109.654 178.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.523 ' HE3' ' HG2' ' A' ' 86' ' ' GLN . 18.0 ptpt -77.78 -43.84 29.42 Favored 'General case' 0 N--CA 1.482 1.174 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.626 -173.552 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -105.51 20.46 18.86 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.032 0.933 . . . . 0.0 110.522 -173.454 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.405 ' HB2' ' HB1' ' A' ' 24' ' ' ALA . . . -44.03 -58.99 2.51 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 124.007 0.923 . . . . 0.0 113.052 -175.342 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.07 -41.15 91.77 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.032 -0.986 . . . . 0.0 110.785 178.317 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -58.21 -46.02 93.34 Favored Glycine 0 C--N 1.352 1.459 0 O-C-N 124.493 1.121 . . . . 0.0 112.539 -179.189 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 26.8 mt -59.74 -57.42 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 124.516 1.127 . . . . 0.0 109.625 -178.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.8 mp -55.31 -50.97 60.87 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.99 0 O-C-N 124.302 1.002 . . . . 0.0 111.027 -177.225 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.95 -29.27 68.28 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 122.897 0.479 . . . . 0.0 112.097 -175.774 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -68.74 -33.72 74.39 Favored 'General case' 0 N--CA 1.479 1.017 0 O-C-N 123.493 0.496 . . . . 0.0 110.16 176.589 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.513 HG21 HG23 ' A' ' 60' ' ' ILE . 66.4 mt -75.82 -41.2 39.81 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 -179.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -58.03 -45.09 87.53 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 114.194 -1.366 . . . . 0.0 111.965 177.403 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -74.45 -30.29 61.82 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 123.208 0.317 . . . . 0.0 111.232 -178.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 69.9 mtm -66.99 -49.93 63.83 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 122.368 0.267 . . . . 0.0 110.404 175.335 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 50.4 mt -62.5 -36.74 76.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 123.364 0.666 . . . . 0.0 110.233 176.182 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.402 ' HA ' ' HG2' ' A' ' 107' ' ' GLN . . . -65.52 -38.95 91.15 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.118 0.567 . . . . 0.0 110.867 176.62 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 26.5 t -68.61 -33.52 74.19 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.43 0.692 . . . . 0.0 111.312 -174.441 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -85.67 -29.3 24.1 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-N 116.096 -0.502 . . . . 0.0 112.255 179.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.402 ' HG2' ' HA ' ' A' ' 104' ' ' ALA . 4.3 pt20 -86.7 -30.02 22.0 Favored 'General case' 0 N--CA 1.492 1.67 0 CA-C-N 118.333 0.515 . . . . 0.0 111.593 -174.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 . . . . . 0 N--CA 1.48 1.056 0 C-N-CA 123.422 0.689 . . . . 0.0 110.8 179.825 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.0 mtt . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.253 0.073 . . . . 0.0 111.083 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.7 t -81.48 106.36 13.37 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.11 0.564 . . . . 0.0 110.203 -178.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.656 ' HG3' ' HB3' ' A' ' 34' ' ' TYR . 15.0 pttt -79.86 -169.25 1.91 Allowed 'General case' 0 N--CA 1.481 1.117 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.195 169.315 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.538 ' HG2' ' HB3' ' A' ' 35' ' ' GLU . 4.4 tmtp? -145.22 143.25 30.17 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-O 121.377 0.608 . . . . 0.0 110.501 -174.3 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.432 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 8.4 tt -131.47 138.56 49.07 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.542 1.137 . . . . 0.0 108.075 174.491 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.467 HG13 HG23 ' A' ' 61' ' ' ILE . 17.4 pt -129.01 163.91 32.78 Favored 'Isoleucine or valine' 0 C--O 1.24 0.588 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 170.41 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.603 ' HB3' HG12 ' A' ' 38' ' ' ILE . . . -152.39 168.47 25.35 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 120.95 0.405 . . . . 0.0 110.074 178.683 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.7 tt -141.12 120.8 13.37 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 107.513 -1.291 . . . . 0.0 107.513 -177.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.553 ' HA ' ' O ' ' A' ' 64' ' ' SER . 60.0 m -110.73 113.78 26.65 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.664 0.786 . . . . 0.0 108.913 175.285 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.409 ' HB3' HG12 ' A' ' 65' ' ' VAL . . . -125.64 112.61 16.35 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 122.78 0.432 . . . . 0.0 110.925 -175.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.546 ' SG ' ' HB2' ' A' ' 13' ' ' MET . 44.0 t -121.27 136.61 25.92 Favored Pre-proline 0 N--CA 1.47 0.537 0 C-N-CA 123.928 0.891 . . . . 0.0 110.183 -179.589 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -69.58 -23.26 31.8 Favored 'Trans proline' 0 C--N 1.37 1.682 0 C-N-CA 122.781 2.321 . . . . 0.0 112.477 175.26 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.546 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 0.3 OUTLIER -71.65 -43.15 66.58 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.596 0.758 . . . . 0.0 111.209 -178.097 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 156.8 -172.06 34.39 Favored Glycine 0 C--N 1.345 1.055 0 CA-C-N 116.381 -0.372 . . . . 0.0 113.265 179.343 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 65.4 mt -82.6 -18.94 39.44 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 -175.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.85 -42.33 99.71 Favored 'General case' 0 N--CA 1.485 1.295 0 CA-C-N 118.818 0.736 . . . . 0.0 111.234 -177.832 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.456 ' CD2' HD22 ' A' ' 85' ' ' LEU . 16.4 t60 -65.76 -42.22 91.15 Favored 'General case' 0 C--O 1.247 0.966 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.124 177.417 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.453 HG22 HD11 ' A' ' 85' ' ' LEU . 35.3 p -67.38 -32.61 73.65 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.238 -178.517 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -74.47 -31.37 62.2 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.357 0.663 . . . . 0.0 111.738 -178.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 56.3 mtm -64.8 -41.27 95.94 Favored 'General case' 0 N--CA 1.485 1.316 0 CA-C-O 120.921 0.391 . . . . 0.0 110.234 172.681 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.35 -38.4 84.76 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.324 174.541 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.84 -32.79 72.73 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.401 0.68 . . . . 0.0 111.059 -179.334 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.417 HE21 ' HG3' ' A' ' 27' ' ' GLU . 25.2 tp60 -74.22 -42.77 59.22 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 122.944 0.498 . . . . 0.0 109.832 177.728 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.37 -51.01 61.5 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.489 -176.469 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.417 HD11 ' OG ' ' A' ' 64' ' ' SER . 94.3 mt -63.55 -34.26 77.41 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.502 0.721 . . . . 0.0 111.374 177.799 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.573 ' HA ' HG21 ' A' ' 36' ' ' VAL . 31.0 tt0 -56.38 -56.83 16.21 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 123.916 0.76 . . . . 0.0 110.455 174.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.471 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 44.8 mt-10 -52.79 -48.81 66.62 Favored 'General case' 0 N--CA 1.478 0.966 0 O-C-N 124.535 1.147 . . . . 0.0 111.238 -179.785 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.94 -49.14 78.96 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.303 1.041 . . . . 0.0 112.199 -177.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.26 -26.3 67.28 Favored 'General case' 0 CA--C 1.546 0.81 0 CA-C-N 115.372 -0.831 . . . . 0.0 112.863 178.519 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 26' ' ' GLU . 55.4 t -72.31 -38.3 61.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 178.21 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.471 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 8.4 mm-40 -71.54 -22.64 61.74 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 114.836 -1.074 . . . . 0.0 111.051 178.313 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -82.43 -20.19 37.5 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.318 0.647 . . . . 0.0 111.105 174.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 113.48 -37.56 3.55 Favored Glycine 0 C--N 1.348 1.225 0 N-CA-C 113.951 0.34 . . . . 0.0 113.951 167.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.656 ' HB3' ' HG3' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -76.0 174.39 10.05 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 -175.07 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.538 ' HB3' ' HG2' ' A' ' 4' ' ' LYS . 12.4 tp10 -72.56 151.65 42.29 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 113.935 -1.484 . . . . 0.0 109.507 178.515 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.573 HG21 ' HA ' ' A' ' 26' ' ' GLU . 9.6 p -136.05 128.71 46.26 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 C-N-CA 123.045 0.538 . . . . 0.0 110.753 -179.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 48.5 tptt -138.03 114.97 10.78 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.654 0.782 . . . . 0.0 109.071 176.276 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.603 HG12 ' HB3' ' A' ' 7' ' ' ALA . 43.2 mt -118.69 111.01 31.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -174.098 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -72.9 148.11 44.67 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 171.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.8 p -133.69 122.21 23.07 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.863 0.865 . . . . 0.0 109.182 -177.577 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -114.52 134.27 55.15 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -162.25 179.74 37.38 Favored Glycine 0 C--N 1.341 0.807 0 N-CA-C 112.699 -0.16 . . . . 0.0 112.699 -176.459 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.35 -24.19 67.21 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.943 0.897 . . . . 0.0 112.123 179.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -75.61 -36.3 60.3 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.598 0.759 . . . . 0.0 110.548 176.511 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 147.36 -156.52 27.02 Favored Glycine 0 C--N 1.346 1.099 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.417 -177.589 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.413 HD12 HH22 ' A' ' 49' ' ' ARG . 77.5 mt -113.12 141.5 28.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 174.198 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -135.54 150.25 49.68 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.258 1.023 . . . . 0.0 109.145 179.17 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 8.8 t30 64.3 39.29 7.37 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.533 1.133 . . . . 0.0 110.085 174.366 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.413 HH22 HD12 ' A' ' 46' ' ' ILE . 22.8 tpp180 -42.03 125.69 3.04 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 125.961 1.704 . . . . 0.0 113.31 -178.176 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 42.7 mt -82.48 126.95 32.82 Favored 'General case' 0 C--O 1.242 0.663 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.221 174.074 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.418 ' O ' HG13 ' A' ' 55' ' ' ILE . 60.2 p -96.64 164.35 12.63 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.932 -178.062 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.87 -29.92 63.37 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.462 0.705 . . . . 0.0 111.247 177.299 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.413 ' O ' ' HG3' ' A' ' 57' ' ' GLU . 47.7 tt0 -57.54 -61.14 2.72 Favored 'General case' 0 C--N 1.354 0.763 0 C-N-CA 123.783 0.833 . . . . 0.0 110.104 170.807 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.454 ' HB3' HG21 ' A' ' 6' ' ' ILE . 38.9 m-20 -52.02 -44.11 64.03 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 124.134 0.973 . . . . 0.0 112.343 -176.555 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.527 HG22 ' HG3' ' A' ' 78' ' ' ARG . 29.4 mt -67.4 -38.11 80.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 O-C-N 124.285 0.991 . . . . 0.0 111.742 -175.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -79.88 -28.69 39.9 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.218 179.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' A' ' 53' ' ' GLN . 53.0 mt-10 -71.07 -35.97 72.09 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.534 0.734 . . . . 0.0 110.274 173.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -58.53 108.01 0.58 Allowed 'General case' 0 C--N 1.348 0.521 0 CA-C-N 114.643 -1.162 . . . . 0.0 111.997 -171.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 37.3 m -62.68 -40.43 97.06 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 115.046 -0.979 . . . . 0.0 109.041 165.01 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 80.4 mt -129.27 140.26 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.317 -178.194 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.467 HG23 HG13 ' A' ' 6' ' ' ILE . 20.2 mt -130.31 135.0 61.63 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 171.595 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 4.5 mp -119.42 133.98 64.47 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 173.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . 0.441 ' HB2' ' HG3' ' A' ' 82' ' ' GLU . 13.2 m170 -107.46 84.35 1.95 Allowed 'General case' 0 N--CA 1.484 1.232 0 CA-C-O 121.481 0.658 . . . . 0.0 109.648 170.421 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.553 ' O ' ' HA ' ' A' ' 9' ' ' CYS . 20.4 m -78.54 80.59 4.92 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 124.659 1.184 . . . . 0.0 110.344 177.014 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.409 HG12 ' HB3' ' A' ' 10' ' ' ALA . 34.7 m -125.37 160.0 31.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 CA-C-O 121.665 0.745 . . . . 0.0 112.175 -169.567 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -110.59 -23.13 11.27 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-N 114.589 -1.187 . . . . 0.0 109.071 173.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 17.0 m -130.86 165.87 30.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.634 0 C-N-CA 125.545 1.538 . . . . 0.0 108.638 178.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 88.8 m -62.29 117.17 27.75 Favored Pre-proline 0 CA--C 1.547 0.848 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 175.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.606 ' HG2' ' HB2' ' A' ' 72' ' ' ASN . 38.5 Cg_endo -63.92 142.91 83.89 Favored 'Trans proline' 0 C--N 1.376 2.002 0 C-N-CA 122.06 1.84 . . . . 0.0 111.544 177.907 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -68.61 -37.49 79.82 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.45 0.7 . . . . 0.0 110.715 -174.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -97.6 25.06 6.07 Favored 'General case' 0 C--O 1.219 -0.503 0 CA-C-N 115.21 -0.905 . . . . 0.0 110.683 -177.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.606 ' HB2' ' HG2' ' A' ' 69' ' ' PRO . 38.6 t30 -55.11 -37.35 66.77 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.148 0.579 . . . . 0.0 111.407 177.285 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.65 -22.1 66.89 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.613 0.765 . . . . 0.0 112.778 -179.181 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 6.6 mmp_? -66.71 -33.09 74.86 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.146 0.578 . . . . 0.0 111.455 174.097 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -107.62 -29.48 9.14 Favored 'General case' 0 N--CA 1.485 1.298 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -168.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -54.94 -27.43 43.4 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 -165.403 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 20.9 t -84.8 7.19 21.6 Favored 'General case' 0 CA--C 1.56 1.352 0 C-N-CA 123.638 0.775 . . . . 0.0 112.204 -179.412 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.527 ' HG3' HG22 ' A' ' 55' ' ' ILE . 34.9 mmt180 -121.28 -177.03 3.42 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 124.595 1.158 . . . . 0.0 110.036 179.511 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -79.5 86.79 5.14 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.062 0.545 . . . . 0.0 110.893 178.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 22.5 t -108.68 146.64 14.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 123.75 0.82 . . . . 0.0 109.877 179.184 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -125.73 96.04 4.64 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.819 0.848 . . . . 0.0 109.737 177.589 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.441 ' HG3' ' HB2' ' A' ' 63' ' ' HIS . 1.8 mp0 -72.3 129.1 37.62 Favored 'General case' 0 C--N 1.352 0.696 0 CA-C-O 121.233 0.54 . . . . 0.0 110.404 178.261 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.485 HG13 ' HA ' ' A' ' 64' ' ' SER . 45.8 pt -138.45 -176.48 1.35 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.83 0 C-N-CA 125.231 1.412 . . . . 0.0 108.386 177.271 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 13.1 p -83.63 147.44 27.71 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 122.63 0.372 . . . . 0.0 110.158 170.42 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.518 HD13 ' HB2' ' A' ' 11' ' ' CYS . 4.8 tt -63.26 -30.23 71.41 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.341 0.656 . . . . 0.0 111.153 178.074 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -61.38 -43.76 98.32 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.39 0.676 . . . . 0.0 110.946 173.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.425 ' HB3' HD12 ' A' ' 83' ' ' ILE . 9.6 t70 -59.77 -32.99 71.11 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.628 0.771 . . . . 0.0 110.901 179.427 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.483 ' HB2' ' HB3' ' A' ' 64' ' ' SER . . . -65.46 -23.59 66.96 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.837 0.855 . . . . 0.0 113.244 179.112 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 34.9 mt -93.89 -51.12 11.51 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 123.091 0.556 . . . . 0.0 109.895 -179.187 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 58.1 pttt -75.62 -29.73 59.28 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.329 0.652 . . . . 0.0 112.297 -174.759 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -126.45 18.75 7.5 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 122.989 0.516 . . . . 0.0 110.886 -168.736 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -44.98 -57.35 3.88 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -174.671 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -61.27 -36.07 79.01 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.024 -0.989 . . . . 0.0 111.491 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -62.48 -56.55 20.97 Favored Glycine 0 C--N 1.351 1.365 0 O-C-N 124.152 0.908 . . . . 0.0 111.554 179.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.405 ' O ' HG13 ' A' ' 99' ' ' ILE . 33.7 mt -47.05 -57.76 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 125.039 1.336 . . . . 0.0 111.09 -179.383 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 1.9 mp -57.48 -53.49 43.48 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 O-C-N 124.244 0.965 . . . . 0.0 111.212 -176.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -27.26 67.64 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -176.567 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 24.3 mm-40 -69.33 -36.4 76.89 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.762 0.825 . . . . 0.0 109.744 178.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.405 HG13 ' O ' ' A' ' 95' ' ' ILE . 30.3 mt -77.99 -38.94 25.01 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -179.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -55.71 -47.84 76.17 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 114.22 -1.355 . . . . 0.0 111.489 176.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -74.56 -33.76 62.77 Favored 'General case' 0 C--N 1.349 0.557 0 O-C-N 123.566 0.541 . . . . 0.0 111.278 -177.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 70.3 mtm -60.46 -51.41 69.6 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 176.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 60.2 mt -65.76 -45.27 92.2 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.916 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.562 178.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.73 -31.53 72.24 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -175.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 66.1 m -84.2 -24.74 29.97 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -176.004 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -84.46 -31.8 24.38 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 122.002 0.121 . . . . 0.0 110.973 174.131 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -84.08 -33.32 24.41 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 122.847 0.459 . . . . 0.0 111.248 -178.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 27.3 mm-40 . . . . . 0 C--O 1.251 1.183 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 177.293 . . . . . . . . 0 0 . 1 stop_ save_