data_2mbl_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 2mbl _Structure_validation_residue.Date_analyzed 2016-10-08 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 ' 4' ' ' LYS . . . . . . . . . . . . . 14.5 tppt? . . . . . 0 CA--C 1.537 0.468 0 CA-C-O 120.591 0.234 . . . . 72.24 110.973 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -84.83 93.5 8.51 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 106.792 -1.559 . . . . 74.13 106.792 169.383 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.426 HG21 HG22 ' A' ' 62' ' ' VAL . 5.9 p -106.36 152.82 7.87 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 C-N-CA 123.982 0.913 . . . . 74.11 110.395 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.418 ' OE2' ' HG3' ' A' ' 24' ' ' GLN . 11.1 mp0 -100.32 114.32 27.73 Favored 'General case' 0 C--N 1.351 0.631 0 N-CA-C 107.935 -1.135 . . . . 72.13 107.935 173.546 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.432 HG21 HG21 ' A' ' 62' ' ' VAL . 78.1 t -112.63 113.62 44.66 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 C-N-CA 124.617 1.167 . . . . 73.34 108.314 -177.424 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -101.0 108.45 20.17 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 108.906 -0.776 . . . . 75.41 108.906 -175.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 91.8 t -93.53 108.25 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 N-CA-C 108.062 -1.088 . . . . 70.3 108.062 179.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -112.72 103.47 11.5 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.269 1.028 . . . . 75.31 108.422 -174.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 11.7 tt -120.61 125.92 74.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 CA-C-O 121.337 0.589 . . . . 65.41 111.156 -171.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 19.9 m -98.34 121.38 40.2 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.974 0.909 . . . . 70.0 109.193 -177.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 5.4 t -148.06 131.78 16.94 Favored 'General case' 0 C--O 1.242 0.696 0 N-CA-C 109.579 -0.526 . . . . 72.34 109.579 179.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.648 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 2.8 t-20 78.49 -65.31 0.24 Allowed 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 125.93 1.692 . . . . 73.44 110.56 172.548 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -170.44 6.82 0.04 OUTLIER Glycine 0 N--CA 1.465 0.586 0 CA-C-N 116.474 -0.33 . . . . 63.41 112.624 172.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -119.72 154.55 33.96 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.126 0.971 . . . . 74.1 109.782 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 7.3 m -115.58 122.16 44.81 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 108.073 -1.084 . . . . 75.43 108.073 175.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -106.77 99.9 9.44 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 108.283 -1.006 . . . . 73.31 108.283 -174.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -114.77 146.1 41.36 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 121.063 0.459 . . . . 73.31 110.014 175.627 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -155.55 132.41 10.61 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 107.812 -1.181 . . . . 73.21 107.812 -176.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 51.7 m -87.47 111.25 20.96 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 109.536 -0.542 . . . . 74.35 109.536 177.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -98.71 140.66 32.58 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.48 0.712 . . . . 72.31 109.621 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.418 ' HG3' ' OE2' ' A' ' 7' ' ' GLU . 21.5 mp0 -97.21 105.91 18.14 Favored 'General case' 0 C--O 1.24 0.578 0 N-CA-C 107.151 -1.426 . . . . 73.12 107.151 174.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 45.7 mt -107.09 115.28 29.91 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 109.051 -0.722 . . . . 73.41 109.051 -179.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -107.12 123.63 48.52 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 109.21 -0.663 . . . . 75.42 109.21 177.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -145.9 122.05 10.81 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 122.738 0.415 . . . . 73.42 110.02 175.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 60.3 t -73.29 -30.86 31.96 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 C-N-CA 123.815 0.846 . . . . 62.53 109.774 171.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.431 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 58.4 mtt-85 -112.78 150.37 31.72 Favored 'General case' 0 CA--C 1.552 1.033 0 CA-C-N 114.96 -1.018 . . . . 74.32 110.043 -174.589 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -67.23 -44.85 78.44 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 123.939 0.896 . . . . 74.03 110.937 -178.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -61.77 -30.9 71.1 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.801 0.84 . . . . 74.52 111.633 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.431 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 35.0 mm-40 -61.7 -46.14 90.97 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 122.705 0.402 . . . . 61.14 111.293 177.142 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.7 -33.88 75.77 Favored 'General case' 0 CA--C 1.553 1.063 0 N-CA-C 109.871 -0.418 . . . . 64.3 109.871 -177.842 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -54.31 -58.2 8.3 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.131 0.572 . . . . 74.22 111.395 176.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.8 pp20? -66.91 -26.89 67.08 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 115.92 -0.582 . . . . 71.43 112.354 -177.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 40.2 mttp -71.59 -35.17 70.43 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.129 0.571 . . . . 72.24 111.048 176.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.58 HD11 HD22 ' A' ' 81' ' ' LEU . 81.5 mt -64.23 -45.31 88.77 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 123.334 0.397 . . . . 73.24 110.058 171.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.412 ' HG2' HG12 ' A' ' 84' ' ' VAL . 50.1 mtpt -58.88 -38.11 78.1 Favored 'General case' 0 C--N 1.357 0.917 0 C-N-CA 122.782 0.433 . . . . 74.32 111.086 174.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 43.3 mmtm -60.32 -62.83 1.58 Allowed 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 122.865 0.466 . . . . 72.52 110.515 175.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 93.9 t -59.7 -45.94 93.92 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 123.583 0.753 . . . . 74.21 111.695 -172.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.558 HD22 HD11 ' A' ' 60' ' ' ILE . 68.9 mt -64.95 -58.33 6.4 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.382 0.673 . . . . 74.45 111.271 -179.252 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -60.32 -38.4 83.59 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 123.357 0.663 . . . . 71.33 112.054 -176.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -67.67 -48.24 67.2 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 122.577 0.351 . . . . 74.44 111.027 178.207 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -73.55 -32.96 64.47 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 116.342 -0.39 . . . . 72.32 111.287 -172.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.42 ' HE3' ' HB3' ' A' ' 45' ' ' MET . 43.3 mtp -83.62 -11.53 57.18 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 122.972 0.509 . . . . 74.41 112.059 -177.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -61.02 -53.34 64.76 Favored Pre-proline 0 CA--C 1.564 1.484 0 CA-C-O 118.577 -0.725 . . . . 71.51 111.684 178.116 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.512 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 56.8 Cg_endo -68.47 -25.23 35.53 Favored 'Trans proline' 0 C--N 1.387 2.581 0 CA-C-N 121.169 1.453 . . . . 72.42 112.435 173.258 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 32.1 mm -63.52 -43.66 98.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 123.434 0.694 . . . . 73.32 111.398 -178.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.403 ' HG3' ' O ' ' A' ' 45' ' ' MET . 48.4 mtmt -67.12 -32.51 73.69 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 121.035 0.445 . . . . 73.13 110.098 178.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -71.57 -29.04 64.27 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.616 1.166 . . . . 74.13 111.101 176.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 86.9 mt -70.5 -33.86 71.69 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 109.312 -0.625 . . . . 73.31 109.312 175.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 89.58 119.99 1.91 Allowed Glycine 0 C--N 1.344 0.987 0 CA-C-N 115.448 -0.796 . . . . 64.43 113.315 168.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.648 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 72.3 m -153.24 156.11 37.88 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.322 1.049 . . . . 73.12 108.755 -179.33 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.414 ' HD2' ' H ' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -74.8 -37.2 62.42 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 109.152 -0.685 . . . . 74.21 109.152 171.377 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 29.0 ttm180 -157.81 148.47 20.9 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 123.951 0.901 . . . . 73.33 109.102 -175.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 15.7 m -114.68 140.47 35.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 123.527 0.731 . . . . 73.12 109.97 177.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 45.5 ttm105 -104.96 103.36 12.91 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 108.25 -1.018 . . . . 73.34 108.25 173.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 40.5 mt -94.76 146.11 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 N-CA-C 107.886 -1.153 . . . . 74.34 107.886 178.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 28.8 m -144.15 103.37 3.99 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 106.836 -1.542 . . . . 74.31 106.836 177.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.558 HD11 HD22 ' A' ' 41' ' ' LEU . 72.7 mt -101.92 107.44 21.64 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 N-CA-C 108.827 -0.805 . . . . 71.4 108.827 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 38.1 ttp85 -97.53 121.16 39.11 Favored 'General case' 0 C--O 1.238 0.468 0 N-CA-C 108.036 -1.098 . . . . 74.02 108.036 176.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.432 HG21 HG21 ' A' ' 8' ' ' VAL . 4.1 p -94.85 140.29 17.04 Favored 'Isoleucine or valine' 0 C--O 1.243 0.744 0 N-CA-C 107.49 -1.3 . . . . 74.31 107.49 178.178 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 19.6 ttpp -81.52 136.39 35.61 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 109.262 -0.644 . . . . 73.34 109.262 178.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . 0.568 ' HE1' ' HB2' ' A' ' 100' ' ' ASP . 37.6 m80 -85.89 117.3 24.66 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 108.663 -0.865 . . . . 71.25 108.663 178.444 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 30.7 p -65.79 -62.13 1.68 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.742 0.817 . . . . 64.32 111.79 -173.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -148.29 140.39 24.07 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 107.969 -1.123 . . . . 75.42 107.969 -177.199 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -53.67 -34.53 58.99 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.939 0.895 . . . . 72.13 113.379 -172.046 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.6 -42.16 74.79 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 122.783 0.433 . . . . 62.52 111.272 178.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -74.97 -47.63 28.41 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.372 0.669 . . . . 71.11 111.494 -176.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.3 pp20? -68.16 -20.61 64.9 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 114.458 1.281 . . . . 63.01 114.458 -159.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 64.6 mttm -65.48 -42.46 92.2 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-O 121.407 0.623 . . . . 75.4 109.848 173.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -79.71 -40.79 28.15 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 114.858 -1.064 . . . . 72.34 110.566 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -74.03 -33.4 63.74 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 112.429 0.529 . . . . 75.05 112.429 -172.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.91 -35.93 64.67 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 117.795 0.271 . . . . 64.22 110.694 177.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 65.1 tttp -65.65 -39.85 91.86 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.101 0.56 . . . . 75.22 110.243 175.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 5.6 tmmm? -67.15 -40.06 86.61 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.974 0.909 . . . . 75.42 109.825 175.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -72.76 -23.72 60.86 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.788 0.835 . . . . 73.33 110.702 -175.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.56 -46.15 89.69 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 123.576 0.547 . . . . 74.2 109.913 173.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.43 ' O ' ' HG2' ' A' ' 83' ' ' LYS . . . -65.98 -40.73 91.48 Favored 'General case' 0 CA--C 1.545 0.75 0 CA-C-N 115.531 -0.759 . . . . 73.0 111.223 177.389 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 37.5 mm -56.09 -47.43 80.47 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 C-N-CA 124.287 1.035 . . . . 74.45 110.773 176.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.594 HD11 HG12 ' A' ' 102' ' ' VAL . 45.8 mt -67.09 -40.02 86.89 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.865 0.866 . . . . 75.1 111.762 -179.685 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 -60.13 -33.15 71.74 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.259 0.624 . . . . 64.4 111.433 -178.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.43 ' HG2' ' O ' ' A' ' 79' ' ' ALA . 32.9 mmtp -67.2 -49.54 64.18 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 123.697 0.623 . . . . 74.33 110.706 173.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.412 HG12 ' HG2' ' A' ' 38' ' ' LYS . 71.1 t -65.13 -49.26 80.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 123.988 0.915 . . . . 61.31 111.456 -171.273 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.485 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 26.4 m-85 -63.24 -33.71 76.08 Favored 'General case' 0 N--CA 1.477 0.902 0 O-C-N 123.582 0.552 . . . . 65.34 111.326 179.062 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -68.06 -30.06 69.18 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.104 0.562 . . . . 73.2 111.389 175.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -85.47 -13.51 48.94 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.905 0.882 . . . . 75.41 111.89 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 94.3 mt -107.49 -16.04 14.46 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 122.984 0.513 . . . . 65.03 111.385 -175.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 97.57 49.23 1.85 Allowed Glycine 0 C--N 1.345 1.079 0 CA-C-O 120.857 0.143 . . . . 63.3 113.373 176.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.485 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 40.6 m-85 -126.31 134.66 51.06 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 107.889 -1.152 . . . . 75.24 107.889 174.441 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -78.1 159.27 28.77 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.297 0.639 . . . . 73.54 111.528 -174.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -62.38 -46.06 90.32 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.859 0.864 . . . . 72.15 112.173 -175.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 63.9 p -58.53 -34.82 71.42 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 124.05 0.94 . . . . 74.23 112.16 177.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . 0.417 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 2.5 m-20 -65.19 -25.66 67.81 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 115.412 -0.813 . . . . 75.04 110.932 -179.098 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 45.4 t -91.74 114.71 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.87 0 C-N-CA 124.333 1.053 . . . . 74.01 108.897 178.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 32.9 m -144.41 129.62 18.71 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 122.879 0.472 . . . . 74.51 110.389 178.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 66.3 m95 -86.05 137.97 32.3 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.403 0.681 . . . . 72.52 110.509 177.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -169.17 123.52 0.83 Allowed 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.481 1.112 . . . . 72.0 109.245 179.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 69.76 51.97 22.34 Favored Glycine 0 C--N 1.349 1.26 0 O-C-N 123.883 0.739 . . . . 73.25 113.193 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . 0.568 ' HB2' ' HE1' ' A' ' 64' ' ' HIS . 4.4 p-10 46.67 26.09 0.5 Allowed 'General case' 0 N--CA 1.499 2.018 0 C-N-CA 126.444 1.898 . . . . 73.4 113.537 -176.359 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 50.0 m -135.54 148.01 48.99 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 125.313 1.445 . . . . 72.23 107.931 -177.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . 0.594 HG12 HD11 ' A' ' 81' ' ' LEU . 13.4 p -103.35 121.58 54.83 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 N-CA-C 108.709 -0.849 . . . . 71.14 108.709 171.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 24.7 m -97.79 111.31 23.65 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 107.532 -1.284 . . . . 72.43 107.532 178.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.417 ' HA ' ' O ' ' A' ' 94' ' ' ASN . 55.1 t -119.35 125.0 74.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 N-CA-C 108.533 -0.914 . . . . 72.44 108.533 -178.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -107.95 153.83 22.49 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 109.578 -0.527 . . . . 73.35 109.578 174.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -148.51 136.98 6.15 Favored Glycine 0 C--O 1.238 0.368 0 N-CA-C 110.643 -0.983 . . . . 73.54 110.643 173.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 58.9 tp60 . . . . . 0 CA--C 1.543 0.697 0 N-CA-C 108.081 -1.081 . . . . 74.31 108.081 179.046 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.608 0 N-CA-C 110.225 -0.287 . . . . 74.14 110.225 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 33.6 ttpt -100.57 117.02 33.86 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.51 0.724 . . . . 72.41 110.593 -178.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.433 HG21 HG12 ' A' ' 62' ' ' VAL . 3.7 p -101.06 138.83 23.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 107.673 -1.232 . . . . 74.31 107.673 164.634 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -104.32 111.66 24.38 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 108.07 -1.085 . . . . 72.05 108.07 174.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.613 HG12 HG21 ' A' ' 60' ' ' ILE . 56.7 t -98.98 107.36 20.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 CA-C-N 113.593 -1.639 . . . . 74.24 108.841 -174.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.433 ' HB2' ' HB3' ' A' ' 61' ' ' ARG . 42.1 mt-30 -97.16 101.57 13.16 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 108.16 -1.052 . . . . 75.23 108.16 -176.537 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.407 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 67.0 t -93.23 111.95 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 108.848 -0.797 . . . . 72.21 108.848 -176.696 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -119.46 103.5 9.51 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.416 1.086 . . . . 65.32 108.259 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.476 HD12 HG13 ' A' ' 48' ' ' ILE . 12.3 tt -118.53 122.02 68.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 CA-C-O 121.036 0.446 . . . . 75.2 111.436 -173.648 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 31.9 m -97.39 112.08 24.06 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 108.361 -0.978 . . . . 75.12 108.361 178.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.627 ' SG ' HG23 ' A' ' 48' ' ' ILE . 14.6 t -122.24 115.92 23.22 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.464 1.106 . . . . 62.32 108.253 179.694 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 40.4 t-20 71.57 -73.1 0.1 Allowed 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 125.222 1.409 . . . . 74.34 110.29 178.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -161.48 10.18 0.12 Allowed Glycine 0 N--CA 1.469 0.894 0 N-CA-C 111.465 -0.654 . . . . 62.43 111.465 175.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.425 ' HA ' ' HE3' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -110.98 123.89 51.06 Favored 'General case' 0 C--N 1.349 0.559 0 C-N-CA 124.197 0.999 . . . . 75.02 109.264 177.207 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 91.5 m -106.81 123.89 48.81 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.688 0.795 . . . . 75.32 109.62 -179.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.663 ' HH ' HD13 ' A' ' 51' ' ' LEU . 5.4 m-85 -109.64 101.84 10.72 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.487 1.115 . . . . 75.52 108.316 -176.309 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.407 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 0.3 OUTLIER -114.58 142.42 46.46 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.05 0.54 . . . . 74.53 110.043 -177.898 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 52.6 ttm-85 -168.05 140.74 3.1 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 122.863 0.465 . . . . 65.14 111.393 175.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 24.7 m -86.68 109.24 19.06 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.661 1.185 . . . . 71.01 109.549 174.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -97.36 135.44 39.25 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.618 0.767 . . . . 75.44 109.41 177.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -94.48 109.46 21.34 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 107.85 -1.167 . . . . 73.15 107.85 177.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 58.0 mt -113.7 116.48 29.5 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.561 0.744 . . . . 70.31 109.344 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -114.79 120.53 40.33 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.438 1.095 . . . . 75.24 108.969 -176.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.491 ' HB2' ' HB2' ' A' ' 32' ' ' GLU . . . -150.98 150.88 31.31 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 122.946 0.499 . . . . 74.41 110.425 176.776 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.2 t -78.81 -42.94 25.08 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.773 0 CA-C-N 114.957 -1.019 . . . . 70.33 109.459 174.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.51 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 59.5 mtt-85 -116.83 164.33 14.83 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.846 0.858 . . . . 65.22 111.451 -169.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -62.39 -48.65 78.78 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 124.467 1.107 . . . . 65.24 111.662 178.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.421 ' HA ' ' HD3' ' A' ' 34' ' ' LYS . 49.4 mm-40 -64.29 -28.75 69.93 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 115.586 -0.733 . . . . 74.34 111.453 -176.543 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.51 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 29.1 mm-40 -74.52 -26.2 59.83 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.026 0.53 . . . . 60.14 111.123 177.719 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.425 HD23 ' HB3' ' A' ' 27' ' ' ALA . 0.2 OUTLIER -81.69 -37.87 26.72 Favored 'General case' 0 CA--C 1.555 1.147 0 N-CA-C 109.788 -0.449 . . . . 71.11 109.788 178.885 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.43 ' HG2' HG21 ' A' ' 80' ' ' ILE . 56.8 mtpt -56.12 -52.13 65.45 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 124.094 0.958 . . . . 73.24 112.452 -176.57 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -54.67 -37.87 66.27 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.667 0.787 . . . . 73.4 111.868 177.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 54.2 mttm -70.63 -38.0 73.85 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.232 0.613 . . . . 74.23 110.811 -178.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 57.6 mt -62.35 -40.86 97.79 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.571 0.748 . . . . 75.31 110.984 175.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.478 ' HG2' HG12 ' A' ' 84' ' ' VAL . 57.2 mtpt -63.71 -41.11 98.13 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.544 0.738 . . . . 62.33 111.326 175.236 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.504 ' HB3' ' HZ3' ' A' ' 39' ' ' LYS . 4.6 mmmp? -61.61 -53.09 60.85 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.332 0.653 . . . . 75.43 110.638 176.499 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 46.4 t -60.05 -38.95 78.88 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 124.826 1.25 . . . . 74.33 111.988 -179.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.419 HD21 HD12 ' A' ' 60' ' ' ILE . 23.3 mt -71.28 -50.11 35.97 Favored 'General case' 0 C--O 1.212 -0.877 0 CA-C-O 118.948 -0.549 . . . . 72.02 110.943 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 56.5 m-80 -66.4 -21.8 66.23 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-N 118.513 0.597 . . . . 75.21 111.594 177.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -74.87 -55.65 5.58 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.048 0.539 . . . . 72.24 110.252 176.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.408 ' HA ' ' CZ ' ' A' ' 44' ' ' ARG . 0.3 OUTLIER -72.94 -26.28 61.33 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.437 0.695 . . . . 74.35 111.312 -176.666 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 57.0 mtp -96.43 2.58 52.72 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.191 0.596 . . . . 63.4 112.326 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -59.37 -55.8 42.44 Favored Pre-proline 0 CA--C 1.566 1.579 0 CA-C-O 118.697 -0.668 . . . . 73.43 110.973 170.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -66.79 -20.93 51.75 Favored 'Trans proline' 0 C--N 1.39 2.718 0 C-N-CA 121.788 1.659 . . . . 75.43 112.429 176.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.627 HG23 ' SG ' ' A' ' 14' ' ' CYS . 48.2 mm -74.46 -40.19 48.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 124.434 1.094 . . . . 75.22 111.513 -174.446 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -68.44 -32.53 72.61 Favored 'General case' 0 N--CA 1.48 1.028 0 N-CA-C 109.424 -0.584 . . . . 74.4 109.424 176.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -69.45 -28.09 65.82 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 124.357 1.063 . . . . 73.14 110.959 175.343 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.663 HD13 ' HH ' ' A' ' 19' ' ' TYR . 83.9 mt -72.31 -39.37 68.3 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 109.004 -0.739 . . . . 74.33 109.004 172.736 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 62.42 62.27 5.76 Favored Glycine 0 C--N 1.352 1.433 0 CA-C-N 115.269 -0.878 . . . . 71.01 111.833 179.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 63.6 m -84.96 152.44 23.49 Favored 'General case' 0 C--O 1.242 0.686 0 C-N-CA 123.069 0.547 . . . . 64.14 112.145 -174.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -67.53 -39.5 85.04 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 115.073 -0.967 . . . . 72.34 110.018 178.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 11.4 ttm180 -142.53 140.77 31.91 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.387 1.075 . . . . 75.12 109.582 176.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 27.0 m -123.76 136.89 58.73 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 C-N-CA 124.471 1.109 . . . . 64.13 109.0 171.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.472 ' O ' ' HA ' ' A' ' 12' ' ' ILE . 47.1 mtt180 -112.09 106.63 15.31 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 108.749 -0.834 . . . . 74.32 108.749 172.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.454 HG12 HD13 ' A' ' 12' ' ' ILE . 17.8 mt -94.86 106.96 18.8 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 N-CA-C 108.014 -1.106 . . . . 75.5 108.014 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.9 m -99.64 102.45 13.94 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 107.045 -1.465 . . . . 75.32 107.045 179.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.613 HG21 HG12 ' A' ' 8' ' ' VAL . 72.2 mt -96.59 107.99 20.65 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 N-CA-C 108.314 -0.995 . . . . 73.34 108.314 179.22 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.433 ' HB3' ' HB2' ' A' ' 9' ' ' GLN . 0.2 OUTLIER -93.17 106.71 18.64 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 107.204 -1.406 . . . . 73.54 107.204 -178.713 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.433 HG12 HG21 ' A' ' 6' ' ' VAL . 22.6 t -92.57 114.27 29.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 N-CA-C 107.966 -1.124 . . . . 74.52 107.966 177.557 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -84.92 105.7 15.88 Favored 'General case' 0 C--O 1.239 0.507 0 N-CA-C 108.118 -1.068 . . . . 75.1 108.118 177.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 25.6 p80 -64.64 139.36 58.76 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 109.336 -0.616 . . . . 75.22 109.336 177.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 30.4 t -80.46 -36.79 33.01 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.208 0.603 . . . . 74.01 111.389 -174.078 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.525 ' HB2' ' HB2' ' A' ' 69' ' ' GLU . 7.2 m-20 -125.07 137.94 54.2 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.606 0.763 . . . . 74.24 110.232 -174.555 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -79.68 -15.52 57.41 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.715 0.806 . . . . 61.22 112.502 -174.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -86.22 -44.54 12.08 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.168 0.587 . . . . 74.53 109.538 171.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.525 ' HB2' ' HB2' ' A' ' 66' ' ' ASP . 11.2 mm-40 -76.81 -14.3 59.93 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 114.711 -1.131 . . . . 72.44 112.821 -175.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.596 ' HG3' ' HD2' ' A' ' 71' ' ' LYS . 9.4 pt-20 -50.55 -31.42 15.61 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 114.554 1.316 . . . . 62.34 114.554 -176.44 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.596 ' HD2' ' HG3' ' A' ' 70' ' ' GLU . 3.7 mptp? -67.15 -42.09 84.93 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 109.418 -0.586 . . . . 73.15 109.418 176.187 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -71.3 -36.35 71.61 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.421 1.088 . . . . 74.14 110.664 177.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -77.7 -42.81 33.18 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.88 0.872 . . . . 75.5 112.159 -172.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.82 -41.81 67.76 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-O 120.806 0.336 . . . . 73.11 110.272 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -63.59 -33.46 75.66 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.134 0.974 . . . . 75.31 111.465 172.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 20.8 ttmm -60.97 -53.25 59.53 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.675 0.79 . . . . 73.42 109.703 173.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.562 ' HA ' ' HB ' ' A' ' 80' ' ' ILE . 19.1 m-85 -69.67 -20.11 63.58 Favored 'General case' 0 C--O 1.221 -0.443 0 C-N-CA 123.57 0.748 . . . . 74.23 111.943 -178.076 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.457 ' O ' ' HB2' ' A' ' 82' ' ' ASN . . . -55.55 -55.17 35.08 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 109.765 -0.458 . . . . 72.42 109.765 171.123 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.427 ' O ' ' HG2' ' A' ' 83' ' ' LYS . . . -69.86 -45.7 67.17 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.503 0.721 . . . . 72.4 111.389 178.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.562 ' HB ' ' HA ' ' A' ' 77' ' ' PHE . 21.6 mm -60.81 -52.38 62.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 C-N-CA 124.624 1.17 . . . . 73.11 111.823 -175.454 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 37.5 mt -67.09 -36.25 81.58 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 118.97 -0.538 . . . . 74.33 111.202 177.237 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.554 HD22 ' HB3' ' A' ' 92' ' ' ASP . 0.2 OUTLIER -60.55 -36.74 79.19 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 123.413 0.445 . . . . 73.53 109.892 178.655 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.427 ' HG2' ' O ' ' A' ' 79' ' ' ALA . 75.0 mmtt -61.74 -47.19 86.32 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.014 0.526 . . . . 74.54 110.261 174.796 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.478 HG12 ' HG2' ' A' ' 38' ' ' LYS . 74.2 t -62.26 -45.44 98.75 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 C-N-CA 124.03 0.932 . . . . 65.14 110.601 -175.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.484 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 20.0 m-85 -62.52 -41.07 98.61 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.617 0.767 . . . . 75.31 110.731 177.235 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -69.87 -24.76 63.47 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.607 0.763 . . . . 73.31 111.516 178.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -84.78 -11.42 55.79 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.614 0.766 . . . . 70.12 111.566 176.213 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 82.1 mt -99.71 -32.7 10.92 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 109.519 -0.548 . . . . 75.33 109.519 177.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 131.32 -19.43 4.84 Favored Glycine 0 C--N 1.349 1.268 0 C-N-CA 123.265 0.46 . . . . 62.44 112.938 -179.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.484 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 23.8 m-85 -68.48 145.93 53.61 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.452 0.701 . . . . 70.1 110.995 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -92.87 159.56 15.3 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.368 0.667 . . . . 75.53 110.142 -177.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . 0.554 ' HB3' HD22 ' A' ' 82' ' ' ASN . 9.2 p-10 -64.85 -25.24 67.82 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.875 0.87 . . . . 72.24 110.969 172.645 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 80.4 p -67.03 -11.02 55.88 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.933 0.893 . . . . 61.43 112.643 176.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -90.91 -19.69 23.05 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.697 0.799 . . . . 64.21 110.723 175.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.497 HG12 HG23 ' A' ' 102' ' ' VAL . 59.3 t -90.71 115.18 29.47 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.975 0 C-N-CA 124.702 1.201 . . . . 74.51 110.757 -166.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 63.7 m -120.89 108.61 14.12 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.603 0.761 . . . . 74.54 110.299 178.234 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 68.2 m95 -87.91 121.86 30.84 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.367 0.667 . . . . 75.43 111.672 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -117.92 81.85 1.74 Allowed 'General case' 0 C--O 1.243 0.748 0 C-N-CA 124.621 1.169 . . . . 75.53 107.895 169.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.05 -115.1 4.38 Favored Glycine 0 C--N 1.345 1.07 0 CA-C-N 114.908 -1.042 . . . . 71.51 112.535 -178.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -96.72 1.88 51.43 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.888 0.875 . . . . 64.32 111.363 -178.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 43.1 m -118.58 140.29 50.13 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 108.911 -0.774 . . . . 72.02 108.911 179.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . 0.497 HG23 HG12 ' A' ' 95' ' ' VAL . 5.9 p -121.19 128.07 75.94 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 C-N-CA 123.22 0.608 . . . . 71.42 110.087 174.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 85.7 m -101.75 104.56 15.36 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 107.375 -1.343 . . . . 73.34 107.375 172.137 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.1 t -94.01 111.84 25.82 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 N-CA-C 107.639 -1.245 . . . . 74.42 107.639 178.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -113.17 118.79 35.69 Favored 'General case' 0 C--O 1.241 0.658 0 N-CA-C 108.297 -1.001 . . . . 75.52 108.297 -177.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -167.78 -173.62 36.0 Favored Glycine 0 CA--C 1.502 -0.772 0 N-CA-C 110.884 -0.887 . . . . 61.24 110.884 -178.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 . . . . . 0 C--O 1.241 0.634 0 N-CA-C 108.579 -0.897 . . . . 74.53 108.579 175.216 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.3 tpmt? . . . . . 0 N--CA 1.472 0.638 0 CA-C-O 121.06 0.457 . . . . 73.34 110.82 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.8 ttmt -86.54 122.43 30.46 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.654 -0.703 . . . . 74.51 109.147 167.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -103.89 136.56 36.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 107.241 -1.392 . . . . 74.21 107.241 167.539 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.409 ' HB2' ' HD3' ' A' ' 63' ' ' LYS . 53.6 mt-10 -107.83 115.04 29.41 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 108.958 -0.756 . . . . 75.25 108.958 -179.75 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 92.2 t -96.34 114.41 33.08 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.688 0 C-N-CA 124.21 1.004 . . . . 75.55 109.572 -174.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -94.62 98.74 11.02 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 108.312 -0.996 . . . . 52.21 108.312 -177.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 90.7 t -93.76 108.23 20.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 N-CA-C 108.693 -0.854 . . . . 73.44 108.693 -176.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -108.04 103.93 13.26 Favored 'General case' 0 C--O 1.216 -0.709 0 N-CA-C 109.065 -0.717 . . . . 74.14 109.065 179.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.51 HD11 ' SD ' ' A' ' 45' ' ' MET . 12.8 tt -107.38 130.19 59.99 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 CA-C-O 121.085 0.469 . . . . 72.23 111.025 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 11.0 m -99.66 107.66 19.83 Favored 'General case' 0 C--O 1.241 0.61 0 C-N-CA 123.916 0.886 . . . . 75.14 108.652 177.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 37.5 t -130.66 120.31 23.72 Favored 'General case' 0 C--O 1.246 0.899 0 C-N-CA 123.911 0.884 . . . . 75.32 109.966 -179.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 57.9 t30 56.75 53.36 8.39 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.492 1.117 . . . . 71.21 110.986 178.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 68.95 6.87 54.65 Favored Glycine 0 C--N 1.343 0.922 0 CA-C-N 114.85 -1.068 . . . . 71.1 115.055 174.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -117.08 139.67 50.43 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.603 0.761 . . . . 65.44 110.376 -178.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 92.0 m -102.15 118.22 36.43 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.075 0.95 . . . . 65.21 110.17 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.552 ' HB3' ' NH2' ' A' ' 44' ' ' ARG . 50.4 m-85 -114.28 101.01 8.77 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.123 0.969 . . . . 75.33 109.0 -178.518 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -116.47 136.85 52.64 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 120.911 0.386 . . . . 71.32 110.719 178.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 51.8 ttt85 -147.43 139.88 24.63 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 123.518 0.727 . . . . 74.5 109.473 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 27.6 m -98.47 108.95 21.77 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 123.91 0.884 . . . . 64.34 109.671 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -97.37 127.09 43.03 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.094 0.957 . . . . 75.25 109.339 -176.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 26.2 mp0 -87.04 109.33 19.33 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 108.765 -0.828 . . . . 64.43 108.765 -178.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 70.4 mt -113.79 130.45 56.45 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.772 0.829 . . . . 74.14 109.144 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -121.79 119.06 30.58 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 108.473 -0.936 . . . . 74.24 108.473 -177.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.468 ' HB1' HD22 ' A' ' 33' ' ' LEU . . . -149.45 166.07 30.21 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-O 121.576 0.703 . . . . 74.11 110.753 177.478 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 41.6 t -106.33 -57.6 4.28 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 CA-C-N 114.38 -1.282 . . . . 65.23 108.825 176.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.647 ' HB2' ' HG3' ' A' ' 32' ' ' GLU . 66.5 mtp180 -87.97 158.29 18.69 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.805 1.242 . . . . 74.11 109.977 -179.783 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -77.07 -37.12 55.15 Favored 'General case' 0 N--CA 1.493 1.682 0 C-N-CA 124.485 1.114 . . . . 73.41 110.654 -172.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -64.08 -30.64 71.69 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 114.91 -1.041 . . . . 72.25 111.167 174.112 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.647 ' HG3' ' HB2' ' A' ' 29' ' ' ARG . 49.8 mt-10 -69.35 -23.18 63.72 Favored 'General case' 0 C--N 1.358 0.943 0 C-N-CA 122.161 0.184 . . . . 74.33 110.698 175.514 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.468 HD22 ' HB1' ' A' ' 27' ' ' ALA . 0.2 OUTLIER -84.24 -34.56 23.83 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-O 119.152 -0.451 . . . . 75.2 110.1 178.047 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.554 ' HG2' HG22 ' A' ' 80' ' ' ILE . 29.9 mtpt -53.75 -53.52 51.02 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 123.794 0.684 . . . . 74.45 112.033 -177.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.512 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 4.4 pt-20 -50.85 -47.21 60.35 Favored 'General case' 0 N--CA 1.474 0.772 0 O-C-N 124.515 1.135 . . . . 65.22 111.551 176.503 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 55.3 mttm -63.93 -38.05 89.65 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.415 0.686 . . . . 73.44 111.365 -173.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.454 HD13 HD22 ' A' ' 81' ' ' LEU . 79.8 mt -62.24 -50.48 71.56 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 124.098 0.874 . . . . 74.21 110.479 175.33 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.482 ' HB3' ' HZ1' ' A' ' 38' ' ' LYS . 7.1 mtpm? -59.72 -34.69 73.25 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.76 0.824 . . . . 74.25 111.535 177.513 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.512 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 32.5 mmmt -65.49 -61.33 2.16 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 123.527 0.517 . . . . 73.03 110.739 176.152 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 46.4 t -57.6 -39.72 71.2 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.226 0 C-N-CA 124.672 1.189 . . . . 75.32 111.537 -175.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 63.5 mt -63.63 -57.19 10.85 Favored 'General case' 0 C--O 1.217 -0.642 0 CA-C-N 115.732 -0.667 . . . . 75.04 110.27 175.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.5 -26.23 66.68 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 112.58 0.585 . . . . 75.31 112.58 -179.399 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.4 mm-40 -70.89 -51.86 23.64 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 120.879 0.371 . . . . 73.3 110.681 174.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.552 ' NH2' ' HB3' ' A' ' 19' ' ' TYR . 7.9 tpt180 -76.37 -32.29 58.51 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 115.481 -0.781 . . . . 74.13 112.139 -172.614 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.51 ' SD ' HD11 ' A' ' 12' ' ' ILE . 97.2 mmm -80.17 -12.8 59.61 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.161 0.584 . . . . 71.21 111.94 -172.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.75 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 9.5 t70 -70.85 -51.7 10.99 Favored Pre-proline 0 CA--C 1.569 1.707 0 CA-C-O 118.525 -0.75 . . . . 62.3 111.7 -177.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -62.04 -23.95 76.2 Favored 'Trans proline' 0 C--N 1.386 2.549 0 C-N-CA 122.031 1.821 . . . . 75.35 113.927 173.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 46.2 mm -65.27 -37.59 80.51 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 C-N-CA 123.889 0.876 . . . . 74.14 111.858 -178.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.75 ' HE2' ' HA ' ' A' ' 46' ' ' ASP . 45.1 mtmt -62.19 -34.41 76.39 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 122.777 0.431 . . . . 74.45 110.323 175.375 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -74.86 -29.09 60.92 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.767 0.827 . . . . 72.43 111.278 177.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.42 HD13 ' HH ' ' A' ' 19' ' ' TYR . 82.4 mt -68.28 -23.87 64.81 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 109.476 -0.564 . . . . 74.2 109.476 173.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.56 46.96 5.86 Favored Glycine 0 C--N 1.347 1.168 0 CA-C-N 115.163 -0.926 . . . . 63.32 112.481 166.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 20.8 p -117.03 107.35 14.42 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 123.803 0.841 . . . . 74.45 108.799 175.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -78.0 -12.8 60.02 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 110.293 -0.262 . . . . 75.12 110.293 177.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 37.1 ttt180 -116.7 127.71 54.66 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 108.781 -0.822 . . . . 73.33 108.781 170.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 28.7 m -130.8 142.11 44.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 123.825 0.85 . . . . 71.02 109.578 178.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 42.0 ttm180 -118.0 108.29 15.08 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.434 0.694 . . . . 64.3 109.819 173.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 36.6 mt -105.17 105.76 19.25 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 C-N-CA 124.593 1.157 . . . . 72.11 109.944 -177.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.418 ' HA ' ' O ' ' A' ' 102' ' ' VAL . 29.0 m -96.36 105.5 17.59 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 108.414 -0.958 . . . . 75.01 108.414 174.305 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 50.8 mt -97.5 125.11 50.7 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 123.017 0.527 . . . . 75.15 110.428 178.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 1.4 mpp_? -112.79 121.32 44.35 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 107.243 -1.391 . . . . 72.42 107.243 178.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.4 p -94.59 131.12 42.32 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 N-CA-C 109.563 -0.532 . . . . 55.44 109.563 -175.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.409 ' HD3' ' HB2' ' A' ' 7' ' ' GLU . 53.6 mtpt -95.85 133.3 40.16 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 108.29 -1.004 . . . . 73.44 108.29 -178.22 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 94.6 m-70 -101.17 155.89 17.75 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 114.009 1.115 . . . . 75.12 114.009 -161.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 34.0 t -69.47 -49.36 55.52 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 113.184 -1.825 . . . . 62.44 110.863 176.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -160.19 162.21 33.77 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 122.682 0.393 . . . . 74.41 110.688 -177.242 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.32 -37.5 83.49 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.171 0.989 . . . . 74.41 111.858 177.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.17 -39.05 78.96 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.921 -0.581 . . . . 72.21 111.421 177.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -83.01 -25.94 31.7 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 115.322 -0.854 . . . . 75.3 112.362 -173.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -62.58 -36.84 83.98 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 113.204 0.816 . . . . 75.24 113.204 -167.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.495 ' O ' ' HD3' ' A' ' 75' ' ' LYS . 21.3 pttp -67.11 -19.89 65.7 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.941 0.896 . . . . 75.42 112.139 178.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -86.24 -50.42 6.97 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.029 0.532 . . . . 71.22 110.69 169.312 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -52.44 -48.58 65.69 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 124.427 1.091 . . . . 63.01 112.132 -173.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.88 -49.56 75.74 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.877 0.871 . . . . 62.32 112.541 -176.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.495 ' HD3' ' O ' ' A' ' 71' ' ' LYS . 3.3 mptp? -69.8 -34.12 73.27 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 115.575 -0.738 . . . . 74.04 111.035 -175.58 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -64.67 -48.04 76.24 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.165 0.586 . . . . 72.0 110.106 171.16 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -70.18 -21.27 63.07 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.481 1.112 . . . . 75.33 110.111 -173.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.486 ' HA ' ' NE1' ' A' ' 97' ' ' TRP . . . -63.72 -48.77 75.71 Favored 'General case' 0 C--N 1.343 0.324 0 C-N-CA 123.955 0.902 . . . . 64.54 110.722 172.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.09 -42.21 85.01 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.573 -0.739 . . . . 63.23 111.021 176.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.554 HG22 ' HG2' ' A' ' 34' ' ' LYS . 44.0 mm -58.73 -50.33 79.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 123.966 0.907 . . . . 72.5 110.797 179.633 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.454 HD22 HD13 ' A' ' 37' ' ' LEU . 23.3 mt -68.12 -36.85 80.4 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 122.928 0.491 . . . . 75.14 111.883 179.027 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -59.74 -36.96 77.67 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.295 0.638 . . . . 75.32 110.21 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -71.98 -48.55 44.12 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 115.332 -0.849 . . . . 75.04 111.119 175.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.472 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 23.2 t -58.76 -55.33 23.82 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 C-N-CA 123.989 0.916 . . . . 74.51 111.323 -174.307 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.431 ' CE2' HG21 ' A' ' 104' ' ' VAL . 55.3 m-85 -59.89 -36.43 76.94 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 123.929 0.768 . . . . 70.02 112.231 179.257 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -71.19 -24.18 62.18 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 122.941 0.496 . . . . 75.11 111.858 178.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -84.8 -5.78 59.34 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.824 0.85 . . . . 70.31 111.004 175.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 68.4 mt -105.41 -31.06 9.2 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 122.701 0.4 . . . . 75.14 110.873 -179.578 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 143.6 -10.77 2.17 Favored Glycine 0 C--N 1.348 1.234 0 CA-C-O 119.404 -0.665 . . . . 72.12 114.287 177.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.42 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 97.1 m-85 -74.75 126.56 31.16 Favored 'General case' 0 N--CA 1.484 1.229 0 CA-C-N 118.271 1.036 . . . . 73.14 110.682 176.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -95.62 91.72 6.27 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.494 0.718 . . . . 75.11 111.333 -174.023 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 20.8 t70 54.8 -81.19 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 124.819 1.247 . . . . 73.04 113.989 165.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 20.1 m -66.73 -13.8 61.8 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 124.172 0.989 . . . . 72.02 113.144 -175.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . 0.468 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 10.6 m120 -55.37 -37.44 67.53 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.175 0.59 . . . . 73.51 110.671 168.506 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 45.1 t -99.03 118.32 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 125.137 1.375 . . . . 73.52 110.092 -174.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 45.5 m -144.69 128.05 16.87 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-N 118.442 0.565 . . . . 73.51 110.568 173.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.486 ' NE1' ' HA ' ' A' ' 78' ' ' ALA . 27.7 m95 -87.17 152.49 22.28 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 124.129 0.971 . . . . 73.41 111.513 -179.317 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -159.72 92.76 1.05 Allowed 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.139 0.975 . . . . 73.03 109.036 177.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 59.25 58.54 13.92 Favored Glycine 0 C--N 1.346 1.105 0 CA-C-N 115.887 -0.597 . . . . 73.25 113.501 177.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 71.03 3.41 4.64 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 124.88 1.272 . . . . 64.23 113.055 179.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 37.7 m -119.59 110.75 17.23 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 108.916 -0.772 . . . . 74.24 108.916 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . 0.418 ' O ' ' HA ' ' A' ' 59' ' ' SER . 6.9 p -99.76 119.8 48.3 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 N-CA-C 109.471 -0.566 . . . . 72.23 109.471 179.842 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 87.0 m -92.35 104.4 16.75 Favored 'General case' 0 C--O 1.241 0.634 0 N-CA-C 108.221 -1.029 . . . . 73.15 108.221 176.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.468 ' HA ' ' O ' ' A' ' 94' ' ' ASN . 48.8 t -108.48 109.49 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 C-N-CA 124.234 1.013 . . . . 72.35 108.37 179.056 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -135.76 147.24 48.32 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 122.465 0.306 . . . . 71.4 110.269 -176.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . 0.403 ' HA3' ' ND2' ' A' ' 94' ' ' ASN . . . 168.27 -160.39 33.9 Favored Glycine 0 C--O 1.245 0.782 0 CA-C-N 115.825 -0.625 . . . . 72.12 112.338 -177.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 27.2 pt20 . . . . . 0 CA--C 1.55 0.964 0 CA-C-O 121.758 0.789 . . . . 70.34 111.623 -174.775 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.9 mmmm . . . . . 0 C--O 1.24 0.604 0 CA-C-O 121.221 0.534 . . . . 74.45 110.975 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.503 ' HA ' ' HA ' ' A' ' 26' ' ' TYR . 40.5 ttpt -83.05 110.9 18.39 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 106.89 -1.522 . . . . 74.44 106.89 166.591 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.503 HG22 HG21 ' A' ' 62' ' ' VAL . 7.2 p -98.21 149.91 5.05 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 N-CA-C 108.87 -0.789 . . . . 74.1 108.87 -176.101 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.443 ' HB3' HG23 ' A' ' 22' ' ' THR . 37.2 mt-10 -109.85 113.19 25.73 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 108.988 -0.745 . . . . 72.41 108.988 -176.002 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 79.5 t -100.71 118.24 47.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 C-N-CA 124.614 1.166 . . . . 73.43 109.333 -176.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -96.84 102.48 14.27 Favored 'General case' 0 C--O 1.24 0.588 0 N-CA-C 108.034 -1.099 . . . . 75.43 108.034 -178.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.428 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 48.2 t -93.67 104.65 15.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 N-CA-C 108.442 -0.947 . . . . 73.25 108.442 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -108.17 105.17 14.78 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.946 0.898 . . . . 71.35 109.009 -175.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.524 HD12 HG13 ' A' ' 48' ' ' ILE . 17.6 tt -123.41 118.4 54.36 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-O 121.256 0.551 . . . . 75.24 110.973 -178.337 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 21.8 m -95.01 121.03 36.21 Favored 'General case' 0 C--O 1.242 0.703 0 N-CA-C 108.676 -0.861 . . . . 74.25 108.676 177.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.412 ' SG ' HG22 ' A' ' 48' ' ' ILE . 26.3 t -145.26 141.92 29.04 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 124.213 1.005 . . . . 65.14 109.756 -178.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 46.6 t-20 72.03 -74.02 0.09 Allowed 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 125.182 1.393 . . . . 72.52 109.471 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -168.2 11.56 0.06 OUTLIER Glycine 0 C--N 1.338 0.662 0 N-CA-C 111.024 -0.83 . . . . 53.04 111.024 172.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 27.8 mmmt -122.3 138.29 54.56 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 124.743 1.217 . . . . 71.41 109.368 -175.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 53.7 m -98.09 122.78 41.65 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 108.819 -0.808 . . . . 63.54 108.819 174.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -106.13 101.47 10.95 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 107.106 -1.442 . . . . 73.33 107.106 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.428 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 12.8 pt-20 -130.7 141.75 50.41 Favored 'General case' 0 C--O 1.241 0.619 0 CA-C-O 121.217 0.532 . . . . 71.21 110.17 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 57.9 ttt85 -155.29 148.01 24.28 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 114.805 -1.089 . . . . 74.52 108.497 174.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.443 HG23 ' HB3' ' A' ' 7' ' ' GLU . 22.4 m -93.38 108.69 20.31 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.88 0.872 . . . . 74.03 108.926 177.694 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 80.3 m-85 -98.76 132.14 44.36 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.121 0.968 . . . . 72.14 110.169 -174.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.418 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 1.9 mp0 -88.96 107.59 19.11 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 108.365 -0.976 . . . . 74.22 108.365 178.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 33.5 mt -112.06 106.82 15.56 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.119 0.967 . . . . 73.32 109.288 179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.503 ' HA ' ' HA ' ' A' ' 5' ' ' LYS . 55.0 t80 -81.07 128.16 33.42 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.165 0.586 . . . . 74.54 109.844 176.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.433 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -141.19 147.88 39.07 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.182 0.593 . . . . 74.04 110.461 174.096 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 58.7 t -84.85 -40.23 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 CA-C-N 115.645 -0.707 . . . . 75.04 109.163 172.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.543 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 40.0 mtt180 -120.16 162.49 19.26 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 115.043 -0.98 . . . . 74.42 109.841 -178.166 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -63.56 -38.01 89.52 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 115.133 -0.939 . . . . 64.21 110.797 171.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -65.91 -27.49 68.23 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.942 0.897 . . . . 65.21 111.781 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.543 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 12.4 mm-40 -68.0 -39.13 83.3 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 122.399 0.28 . . . . 75.25 110.362 177.682 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.558 HD21 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -66.11 -20.19 66.08 Favored 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 123.583 0.753 . . . . 74.41 110.986 -175.136 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.1 mtpp -54.03 -62.97 1.31 Allowed 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.661 0.785 . . . . 73.33 111.994 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.547 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 2.5 pp20? -65.0 -30.37 71.36 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 116.107 -0.497 . . . . 73.53 111.471 -176.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.558 ' HD2' HD21 ' A' ' 33' ' ' LEU . 53.8 mttm -64.42 -41.69 96.47 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.665 0.786 . . . . 74.4 110.495 178.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.43 HD12 HD22 ' A' ' 81' ' ' LEU . 74.4 mt -56.31 -52.75 63.37 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 124.014 0.821 . . . . 74.42 109.746 171.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.2 mtpm? -56.77 -37.79 71.57 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 124.121 0.888 . . . . 73.54 112.004 -178.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.547 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 29.9 mmtp -61.84 -55.29 31.45 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 122.948 0.499 . . . . 74.32 110.137 177.105 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 92.7 t -64.55 -34.11 67.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-N 115.008 -0.997 . . . . 75.04 111.422 -176.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 64.2 mt -72.4 -41.0 66.78 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.358 0.663 . . . . 75.11 111.023 -177.17 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.8 m-80 -64.94 -40.38 94.95 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 122.356 0.262 . . . . 70.31 111.109 174.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 47.7 mm-40 -65.95 -46.81 76.78 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.262 0.625 . . . . 73.44 111.4 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? -69.58 -39.26 77.45 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.35 0.66 . . . . 74.25 111.54 -177.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.471 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 54.3 mtp -88.45 -7.91 55.81 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 113.169 0.803 . . . . 74.33 113.169 -175.63 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -63.27 -51.47 68.59 Favored Pre-proline 0 CA--C 1.569 1.693 0 CA-C-O 118.548 -0.739 . . . . 73.41 111.573 178.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -66.49 -23.28 50.58 Favored 'Trans proline' 0 C--N 1.398 3.181 0 C-N-CA 122.383 2.056 . . . . 74.33 112.801 175.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.524 HG13 HD12 ' A' ' 12' ' ' ILE . 51.2 mm -67.07 -29.98 47.95 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 C-N-CA 124.148 0.979 . . . . 71.44 110.077 179.693 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.471 ' HG3' ' O ' ' A' ' 45' ' ' MET . 92.7 mttt -70.02 -34.5 73.37 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 115.272 -0.877 . . . . 74.44 110.6 175.625 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.541 ' HB2' ' HZ2' ' A' ' 50' ' ' LYS . 4.4 ttmp? -74.24 -26.64 60.35 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.088 0.555 . . . . 74.5 111.319 178.201 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 88.8 mt -70.99 -45.01 64.76 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 108.995 -0.743 . . . . 73.04 108.995 172.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 88.21 17.87 56.64 Favored Glycine 0 C--N 1.342 0.903 0 CA-C-N 115.392 -0.822 . . . . 63.14 114.671 171.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.538 ' SG ' HG11 ' A' ' 56' ' ' VAL . 6.6 p -62.04 122.45 15.54 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 123.602 0.761 . . . . 75.13 110.131 175.209 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm -62.65 -57.15 12.06 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.212 0.605 . . . . 75.13 110.445 -177.189 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 33.5 ttp180 -103.48 128.23 50.71 Favored 'General case' 0 C--N 1.345 0.384 0 CA-C-N 115.504 -0.771 . . . . 72.22 109.11 176.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.538 HG11 ' SG ' ' A' ' 53' ' ' CYS . 34.5 m -116.08 142.96 27.32 Favored 'Isoleucine or valine' 0 C--O 1.244 0.785 0 C-N-CA 123.62 0.768 . . . . 75.32 109.437 176.467 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -100.42 103.1 14.46 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 108.52 -0.918 . . . . 73.05 108.52 177.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 36.9 mt -102.09 140.07 21.56 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 N-CA-C 107.994 -1.113 . . . . 75.11 107.994 179.065 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 32.4 t -141.9 104.24 4.47 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 107.327 -1.36 . . . . 62.44 107.327 175.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 78.2 mt -103.26 107.55 22.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 N-CA-C 108.511 -0.922 . . . . 75.31 108.511 -178.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 28.0 ttt180 -102.27 131.79 48.62 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 108.518 -0.919 . . . . 73.42 108.518 173.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.503 HG21 HG22 ' A' ' 6' ' ' VAL . 8.0 p -95.04 139.2 19.16 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 N-CA-C 106.979 -1.489 . . . . 75.15 106.979 174.709 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -82.77 136.99 34.52 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-O 121.134 0.492 . . . . 73.25 109.872 -175.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . 0.561 ' HB3' ' HG3' ' A' ' 70' ' ' GLU . 73.7 m80 -105.43 127.61 53.08 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 124.47 1.108 . . . . 72.54 109.397 -169.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 23.3 t -83.35 -47.81 11.07 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.643 0.777 . . . . 74.42 111.481 -171.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -109.29 -105.04 0.36 Allowed 'General case' 0 CA--C 1.56 1.329 0 C-N-CA 123.439 0.696 . . . . 74.23 109.998 -175.027 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . 176.71 -60.25 0.01 OUTLIER 'General case' 0 C--N 1.362 1.111 0 C-N-CA 125.351 1.46 . . . . 75.54 107.9 -177.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.27 -42.79 68.31 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 115.436 -0.802 . . . . 73.52 110.419 178.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -62.19 -36.04 80.69 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 115.572 -0.74 . . . . 65.55 110.461 173.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.561 ' HG3' ' HB3' ' A' ' 64' ' ' HIS . 41.5 mm-40 -73.2 -22.61 60.42 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.23 0.612 . . . . 73.31 112.137 -175.024 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.541 ' HZ3' ' HB3' ' A' ' 71' ' ' LYS . 3.1 mmmp? -63.39 -33.58 75.85 Favored 'General case' 0 N--CA 1.483 1.187 0 CA-C-O 121.285 0.564 . . . . 73.02 110.128 172.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 34.1 ttpt -84.29 -46.0 12.25 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.764 1.226 . . . . 73.42 110.96 177.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -80.5 -30.81 37.3 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 112.873 0.694 . . . . 74.45 112.873 -168.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -78.62 -30.6 46.58 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 122.594 0.358 . . . . 73.4 110.279 175.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 51.9 tttm -63.39 -40.5 97.39 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.618 0.767 . . . . 72.14 110.201 168.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -67.19 -40.69 86.57 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.693 0.797 . . . . 71.43 110.384 175.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -76.47 -19.04 58.43 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.984 0.914 . . . . 72.12 110.588 -175.215 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.2 -45.74 83.5 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.286 0.634 . . . . 74.43 110.448 173.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.69 -34.17 75.28 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.54 -0.755 . . . . 74.13 111.255 176.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 46.4 mm -67.68 -50.72 58.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 123.86 0.864 . . . . 74.1 110.918 -179.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.43 HD22 HD12 ' A' ' 37' ' ' LEU . 34.4 mt -66.11 -50.72 63.07 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 123.625 0.578 . . . . 74.1 110.174 -176.154 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -56.89 -41.29 77.78 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 124.029 0.932 . . . . 64.35 111.543 -177.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 19.7 mmmt -64.96 -44.71 88.5 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 123.76 0.663 . . . . 75.23 111.255 176.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.409 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 25.0 t -62.61 -44.7 99.62 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 C-N-CA 123.017 0.527 . . . . 64.2 110.124 -176.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.538 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 20.6 m-85 -60.77 -42.3 97.2 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 124.091 0.869 . . . . 74.54 110.273 177.741 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.39 -34.13 77.07 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.529 0.731 . . . . 73.51 111.331 177.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -81.27 -8.02 59.67 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.022 0.929 . . . . 74.25 110.85 -178.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 93.1 mt -107.22 -9.77 16.01 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.821 0.848 . . . . 71.12 110.397 176.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 109.4 -5.73 31.65 Favored Glycine 0 N--CA 1.478 1.485 0 N-CA-C 114.096 0.399 . . . . 51.51 114.096 175.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.575 ' HB3' HD22 ' A' ' 94' ' ' ASN . 9.9 m-85 -79.66 138.85 37.51 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.374 0.67 . . . . 73.53 109.438 179.048 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 28.3 m-80 -96.53 168.77 10.34 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.548 0.739 . . . . 73.11 111.735 -176.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -54.45 -45.46 73.11 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.926 1.29 . . . . 75.43 111.041 177.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 23.9 m -57.48 -46.45 83.69 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 124.71 1.204 . . . . 71.2 113.424 -173.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . 0.575 HD22 ' HB3' ' A' ' 90' ' ' TYR . 3.7 p-10 -83.05 -11.24 58.23 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 122.743 0.417 . . . . 74.35 111.675 -177.111 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 97.0 t -88.6 102.1 12.48 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 N-CA-C 107.956 -1.127 . . . . 75.23 107.956 172.031 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 22.7 m -108.25 103.78 13.03 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.572 0.749 . . . . 72.11 110.458 -173.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 43.0 m95 -79.94 150.48 30.5 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.347 0.659 . . . . 74.11 111.65 178.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -144.28 69.88 1.28 Allowed 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 106.966 -1.494 . . . . 75.21 106.966 170.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 52.37 -82.4 0.01 OUTLIER Glycine 0 C--N 1.361 1.955 0 CA-C-N 114.156 -1.384 . . . . 63.51 114.777 179.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -72.55 -39.1 67.75 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 126.041 1.736 . . . . 71.14 112.776 -174.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 35.6 m -131.4 149.65 52.46 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.754 0.822 . . . . 74.32 110.475 -174.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 7.4 p -116.82 137.98 48.93 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 C-N-CA 123.329 0.652 . . . . 75.04 110.361 176.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 39.4 m -114.28 108.76 17.36 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.864 1.266 . . . . 72.21 109.073 176.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.4 t -101.04 119.69 49.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 C-N-CA 123.406 0.682 . . . . 73.43 109.475 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -86.32 113.07 22.01 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 107.333 -1.358 . . . . 75.22 107.333 171.724 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -105.02 167.31 14.99 Favored Glycine 0 C--N 1.34 0.804 0 N-CA-C 111.815 -0.514 . . . . 60.13 111.815 -176.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.241 0.633 0 C-N-CA 123.79 0.836 . . . . 72.35 110.179 -175.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.7 tppp? . . . . . 0 C--O 1.24 0.593 0 CA-C-O 120.802 0.334 . . . . 74.01 110.126 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 26.8 ttpt -85.94 111.07 19.9 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-N 115.436 -0.802 . . . . 74.0 109.12 174.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.4 p -99.66 142.38 15.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 N-CA-C 108.122 -1.066 . . . . 61.22 108.122 171.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.539 ' HB3' HG21 ' A' ' 22' ' ' THR . 50.2 mt-10 -113.71 118.91 35.65 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 109.521 -0.548 . . . . 73.01 109.521 177.507 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 59.2 t -106.75 116.02 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 124.429 1.092 . . . . 73.32 109.688 -171.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.413 ' O ' ' HA ' ' A' ' 60' ' ' ILE . 43.4 tt0 -92.26 102.7 15.2 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 107.987 -1.116 . . . . 55.25 107.987 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 98.0 t -96.89 102.71 13.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 N-CA-C 108.317 -0.994 . . . . 73.35 108.317 178.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.48 ' HA ' ' HB3' ' A' ' 20' ' ' GLU . 22.1 ttmm -104.22 103.56 13.34 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 108.573 -0.899 . . . . 72.11 108.573 -178.119 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.499 HD11 HG13 ' A' ' 48' ' ' ILE . 11.8 tt -112.55 124.21 69.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 CA-C-O 121.069 0.462 . . . . 75.45 109.943 179.419 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 11.9 m -98.04 113.5 25.39 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.615 0.766 . . . . 75.34 109.247 178.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.589 ' SG ' HG23 ' A' ' 48' ' ' ILE . 18.4 t -153.81 150.6 28.63 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.914 1.286 . . . . 64.45 108.849 179.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.499 ' HB2' HD11 ' A' ' 51' ' ' LEU . 62.5 t30 69.82 12.77 8.02 Favored 'General case' 0 N--CA 1.504 2.261 0 C-N-CA 124.273 1.029 . . . . 72.05 111.295 178.715 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 77.94 4.86 86.39 Favored Glycine 0 C--N 1.349 1.291 0 CA-C-N 116.414 -0.357 . . . . 54.14 112.319 -171.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.4 mmpt? -113.53 165.78 12.15 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.583 1.153 . . . . 73.21 109.526 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 39.8 m -119.36 115.66 24.59 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 109.281 -0.637 . . . . 72.22 109.281 174.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -103.62 106.22 16.67 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 107.131 -1.433 . . . . 73.21 107.131 -179.4 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.48 ' HB3' ' HA ' ' A' ' 11' ' ' LYS . 16.9 pt-20 -143.29 161.6 37.88 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.523 0.678 . . . . 71.2 112.212 -176.032 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 35.6 ttm180 -167.21 148.24 5.66 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-N 113.764 -1.562 . . . . 74.52 108.063 176.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.539 HG21 ' HB3' ' A' ' 7' ' ' GLU . 27.8 m -92.37 112.99 25.13 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 107.337 -1.357 . . . . 62.41 107.337 169.651 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 -97.51 127.26 43.33 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.062 0.945 . . . . 74.04 109.902 -173.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -83.85 106.07 15.24 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 107.502 -1.296 . . . . 73.54 107.502 178.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 81.5 mt -112.98 119.95 39.69 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.292 1.037 . . . . 73.11 108.337 -179.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -109.1 118.81 37.73 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 109.024 -0.732 . . . . 75.54 109.024 -177.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -124.84 150.91 45.92 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.269 0.628 . . . . 74.31 110.098 178.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 44.9 t -95.01 -26.31 4.39 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 C-N-CA 123.881 0.872 . . . . 75.11 109.489 175.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.589 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 90.3 mtt180 -131.72 157.03 44.86 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 108.158 -1.052 . . . . 73.01 108.158 174.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -67.67 -32.96 74.0 Favored 'General case' 0 N--CA 1.488 1.427 0 CA-C-O 121.239 0.542 . . . . 64.14 111.012 -178.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -70.2 -21.35 63.04 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.138 0.975 . . . . 73.42 111.343 -179.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.589 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 27.6 mm-40 -68.93 -23.7 64.19 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 122.875 0.47 . . . . 73.01 110.813 174.8 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.589 HD21 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -73.18 -19.29 61.14 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 123.238 0.615 . . . . 71.02 111.217 -177.386 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -54.86 -59.19 5.06 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.682 0.793 . . . . 74.33 111.573 178.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -57.5 -36.37 71.45 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.847 0.859 . . . . 64.21 112.487 -177.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.589 ' HD2' HD21 ' A' ' 33' ' ' LEU . 62.0 mttm -67.25 -46.09 74.77 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.298 -0.865 . . . . 73.42 109.912 -177.327 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.474 HD13 HD21 ' A' ' 81' ' ' LEU . 95.9 mt -65.63 -40.04 92.12 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.411 0.684 . . . . 72.11 111.874 177.767 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 60.2 mtpt -59.47 -42.44 92.06 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 122.929 0.492 . . . . 64.23 110.697 177.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 34.1 mmtm -67.64 -57.21 6.82 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 123.506 0.504 . . . . 74.2 111.268 176.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 53.0 t -56.07 -44.51 78.9 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.94 0 C-N-CA 123.213 0.605 . . . . 74.11 111.508 -175.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 83.8 mt -68.99 -59.82 2.79 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.003 0.521 . . . . 70.24 111.311 179.407 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 60.8 t30 -60.69 -38.42 84.92 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 123.415 0.686 . . . . 70.15 112.173 -172.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 -80.17 -32.55 38.77 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.366 0.666 . . . . 72.02 111.921 -177.322 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 4.5 tpt180 -68.74 -33.83 74.57 Favored 'General case' 0 N--CA 1.486 1.358 0 CA-C-O 121.318 0.58 . . . . 74.55 109.506 172.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.527 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 58.2 mtp -86.64 -6.35 58.88 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.295 -0.866 . . . . 72.22 112.058 178.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -63.19 -51.08 72.05 Favored Pre-proline 0 CA--C 1.565 1.549 0 CA-C-O 118.814 -0.612 . . . . 74.01 111.723 178.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -66.72 -22.31 50.23 Favored 'Trans proline' 0 C--N 1.384 2.422 0 C-N-CA 121.423 1.415 . . . . 75.52 112.263 172.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.589 HG23 ' SG ' ' A' ' 14' ' ' CYS . 45.3 mm -71.82 -27.13 26.91 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 123.552 0.741 . . . . 71.44 110.354 179.13 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.527 ' HG3' ' O ' ' A' ' 45' ' ' MET . 90.1 mttt -71.08 -36.58 72.29 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.474 0.71 . . . . 72.21 110.348 174.513 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.33 -32.73 70.58 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 123.561 0.744 . . . . 72.14 109.335 175.545 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.499 HD11 ' HB2' ' A' ' 15' ' ' ASN . 92.9 mt -70.07 -34.42 73.17 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 109.655 -0.498 . . . . 72.22 109.655 175.176 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 73.83 45.62 26.72 Favored Glycine 0 C--N 1.342 0.871 0 CA-C-N 115.513 -0.767 . . . . 71.22 113.285 176.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 49.9 m -76.0 112.74 12.75 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 108.918 -0.771 . . . . 73.11 108.918 169.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -58.52 -33.06 69.43 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.254 1.021 . . . . 75.21 111.084 -179.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 43.9 ttp180 -145.7 143.79 29.98 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.452 1.101 . . . . 75.24 108.489 177.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.465 ' O ' ' HA ' ' A' ' 105' ' ' GLU . 28.7 m -131.42 147.88 32.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 123.953 0.901 . . . . 65.54 109.488 179.371 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 52.3 ttt85 -102.7 107.22 18.03 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 108.812 -0.81 . . . . 73.54 108.812 175.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.408 ' HA ' ' O ' ' A' ' 11' ' ' LYS . 37.9 mt -107.6 107.91 23.93 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 C-N-CA 123.371 0.668 . . . . 72.2 109.641 -177.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 18.2 m -98.75 105.67 17.84 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 108.479 -0.934 . . . . 74.43 108.479 174.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.413 ' HA ' ' O ' ' A' ' 9' ' ' GLN . 71.8 mt -100.3 134.27 40.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 123.129 0.572 . . . . 72.03 109.481 177.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 21.9 mtm180 -128.37 136.53 51.06 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.564 0.746 . . . . 75.2 109.544 174.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.7 p -95.78 137.22 24.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 123.542 0.737 . . . . 75.32 109.203 178.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.8 tttm -83.16 114.8 21.58 Favored 'General case' 0 C--O 1.244 0.798 0 N-CA-C 107.602 -1.258 . . . . 72.34 107.602 174.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . 0.591 ' HA ' ' HG2' ' A' ' 73' ' ' GLU . 21.6 m170 -69.71 132.97 46.96 Favored 'General case' 0 C--O 1.234 0.258 0 O-C-N 123.885 0.741 . . . . 73.43 110.132 -172.214 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 19.7 t -57.04 -52.34 65.65 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 123.836 0.854 . . . . 61.45 111.529 -179.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.533 ' H ' ' HB2' ' A' ' 69' ' ' GLU . 21.8 m-20 -144.99 179.69 7.18 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 124.306 1.043 . . . . 71.34 109.576 -178.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.26 -51.28 64.36 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.974 0.91 . . . . 74.44 111.085 176.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.17 -26.27 68.09 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.473 0.709 . . . . 63.52 111.421 177.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.533 ' HB2' ' H ' ' A' ' 66' ' ' ASP . 30.9 mm-40 -73.97 -30.2 62.38 Favored 'General case' 0 C--O 1.204 -1.327 0 CA-C-O 118.136 -0.935 . . . . 74.35 112.516 179.147 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -49.48 -47.89 48.2 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 114.166 1.173 . . . . 74.4 114.166 -168.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 40.9 mtmt -69.2 -39.71 78.47 Favored 'General case' 0 N--CA 1.479 0.975 0 CA-C-N 115.477 -0.783 . . . . 74.33 110.585 -177.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -69.54 -33.66 73.1 Favored 'General case' 0 C--O 1.212 -0.914 0 CA-C-N 114.581 -1.191 . . . . 74.23 110.225 175.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.591 ' HG2' ' HA ' ' A' ' 64' ' ' HIS . 10.1 tp10 -73.16 -39.32 65.74 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.953 1.301 . . . . 73.42 110.376 -166.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.23 -53.46 56.9 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 115.304 -0.862 . . . . 63.13 110.841 173.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 59.0 mttp -66.44 -39.47 88.93 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 124.396 1.078 . . . . 73.22 112.447 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -58.32 -54.58 45.45 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 125.387 1.475 . . . . 75.23 109.815 -179.12 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -73.37 -26.5 61.03 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 113.45 -1.705 . . . . 74.54 110.371 -177.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.4 -44.66 90.61 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.433 0.693 . . . . 73.34 111.076 175.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.51 -43.13 99.42 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.351 0.66 . . . . 53.53 111.219 178.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 49.0 mm -66.45 -44.29 90.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 CA-C-N 115.866 -0.606 . . . . 72.51 110.756 178.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.474 HD21 HD13 ' A' ' 37' ' ' LEU . 32.1 mt -64.7 -36.98 86.02 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.368 0.667 . . . . 65.43 110.975 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -55.53 -44.26 76.51 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.215 1.006 . . . . 60.34 110.233 179.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.426 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 33.7 mmtp -68.05 -45.09 74.89 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 114.841 -1.072 . . . . 75.52 110.961 177.562 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 77.5 t -66.87 -45.75 86.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 123.312 0.645 . . . . 73.22 111.151 -172.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.459 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 24.1 m-85 -60.75 -38.48 85.34 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.214 0.606 . . . . 72.45 110.718 176.145 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.32 -28.22 67.81 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.105 0.562 . . . . 65.24 111.485 176.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 83' ' ' LYS . 45.0 mt-10 -82.07 -14.96 55.06 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.538 0.735 . . . . 75.22 110.645 176.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 97.2 mt -107.34 -2.77 20.31 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.77 0.828 . . . . 75.41 110.846 -178.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 82.01 19.21 65.64 Favored Glycine 0 C--N 1.348 1.245 0 N-CA-C 114.503 0.561 . . . . 71.43 114.503 175.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.459 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 14.6 m-85 -89.39 137.68 32.11 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 109.419 -0.586 . . . . 74.04 109.419 173.084 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -80.51 150.69 29.55 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.57 0.748 . . . . 74.53 110.189 -176.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -67.37 -31.63 72.0 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.903 0.881 . . . . 74.23 112.11 -176.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 16.8 m -58.42 -27.02 63.92 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.123 0.569 . . . . 72.25 112.224 174.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 42.1 m-20 -75.6 -22.34 57.0 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.071 0.549 . . . . 70.42 111.116 178.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.508 ' HA ' HG23 ' A' ' 104' ' ' VAL . 47.9 t -91.16 105.84 16.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 124.335 1.054 . . . . 71.24 109.616 -171.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 19.3 m -129.75 112.84 14.02 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.059 0.544 . . . . 73.44 111.318 -174.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 65.5 m95 -87.34 119.34 27.51 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.683 0.793 . . . . 72.21 111.351 177.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -137.85 115.06 10.97 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.437 1.095 . . . . 71.43 108.64 172.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 64.26 43.7 96.62 Favored Glycine 0 C--N 1.351 1.404 0 O-C-N 124.05 0.844 . . . . 71.34 113.63 175.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 63.07 17.55 10.23 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 124.97 1.308 . . . . 74.52 111.672 179.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 25.4 m -118.56 119.78 35.53 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 107.087 -1.449 . . . . 71.03 107.087 175.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . 0.412 HG13 HD11 ' A' ' 81' ' ' LEU . 7.7 p -99.04 115.65 40.13 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 N-CA-C 109.013 -0.736 . . . . 75.32 109.013 178.188 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 41.7 m -94.52 118.52 31.79 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 107.913 -1.143 . . . . 70.43 107.913 177.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.508 HG23 ' HA ' ' A' ' 95' ' ' VAL . 55.9 t -128.54 114.97 35.73 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 C-N-CA 123.994 0.917 . . . . 74.31 108.609 -178.236 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . 0.465 ' HA ' ' O ' ' A' ' 56' ' ' VAL . 3.4 mp0 -85.1 110.95 19.33 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 108.007 -1.109 . . . . 73.55 108.007 171.219 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -104.11 148.14 16.77 Favored Glycine 0 C--N 1.337 0.629 0 N-CA-C 109.747 -1.341 . . . . 75.35 109.747 179.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 . . . . . 0 C--O 1.241 0.658 0 CA-C-O 121.216 0.531 . . . . 71.23 110.518 -173.61 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.533 ' HE3' ' HA ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.239 0.513 0 CA-C-O 120.956 0.408 . . . . 75.4 110.801 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.634 ' HB3' ' HZ2' ' A' ' 5' ' ' LYS . 5.7 ttpm? -88.8 105.35 17.67 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 107.241 -1.392 . . . . 72.32 107.241 162.316 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.8 p -97.1 143.18 12.9 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 N-CA-C 108.901 -0.777 . . . . 74.45 108.901 -178.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.52 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 49.6 mt-10 -106.97 111.71 24.33 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 108.107 -1.072 . . . . 74.22 108.107 176.109 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 95.7 t -101.17 116.27 44.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 C-N-CA 124.773 1.229 . . . . 74.52 108.952 -175.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -96.64 101.34 12.93 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 107.982 -1.118 . . . . 72.3 107.982 -178.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 84.6 t -93.69 108.11 20.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 N-CA-C 108.434 -0.95 . . . . 72.52 108.434 179.127 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -108.07 137.81 45.42 Favored 'General case' 0 C--O 1.224 -0.255 0 C-N-CA 124.748 1.219 . . . . 75.53 107.718 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.485 HD12 HG13 ' A' ' 48' ' ' ILE . 11.9 tt -143.98 136.57 23.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 CA-C-N 118.405 0.548 . . . . 74.51 110.966 176.642 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 28.0 m -101.9 120.48 40.47 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 108.66 -0.867 . . . . 71.12 108.66 173.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.6 ' SG ' HG22 ' A' ' 48' ' ' ILE . 0.9 OUTLIER -157.58 137.96 12.8 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.467 1.107 . . . . 75.32 109.201 -178.99 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.418 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 3.1 t-20 75.89 -46.33 0.55 Allowed 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 126.107 1.763 . . . . 74.52 112.482 179.378 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 155.44 2.02 0.12 Allowed Glycine 0 CA--C 1.522 0.52 0 N-CA-C 110.949 -0.86 . . . . 73.42 110.949 -175.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 49.3 mtpt -119.13 162.63 18.32 Favored 'General case' 0 C--N 1.355 0.822 0 C-N-CA 123.976 0.91 . . . . 75.24 109.621 -178.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.0 m -117.74 114.91 24.01 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 108.605 -0.887 . . . . 74.24 108.605 176.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -101.34 100.16 10.62 Favored 'General case' 0 C--O 1.24 0.563 0 N-CA-C 106.536 -1.653 . . . . 73.43 106.536 -175.039 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -134.48 145.2 48.59 Favored 'General case' 0 C--O 1.243 0.724 0 C-N-CA 123.361 0.665 . . . . 64.43 110.589 -173.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.8 ttm180 -167.71 144.71 4.3 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.619 0.768 . . . . 73.03 109.755 -179.144 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 28.1 m -87.6 108.74 19.21 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.645 0.778 . . . . 62.22 109.484 175.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -97.81 128.45 44.46 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.778 0.831 . . . . 75.22 109.48 -178.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.52 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 26.8 mp0 -93.87 109.15 20.86 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 108.414 -0.958 . . . . 74.44 108.414 -176.34 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 78.5 mt -120.04 106.73 12.27 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.533 1.133 . . . . 74.25 109.469 -175.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.504 ' HA ' ' HA ' ' A' ' 5' ' ' LYS . 61.9 t80 -95.23 142.0 28.17 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 122.745 0.418 . . . . 74.02 110.312 175.087 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.505 ' HB2' ' HB2' ' A' ' 32' ' ' GLU . . . -148.46 149.16 31.19 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 123.43 0.692 . . . . 73.12 110.243 174.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.0 t -86.13 -21.89 7.41 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.043 0 C-N-CA 124.613 1.165 . . . . 63.04 109.463 175.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.61 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 48.2 mtp180 -131.47 141.77 49.85 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 108.025 -1.102 . . . . 72.24 108.025 171.493 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -64.45 -19.39 65.51 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 122.565 0.346 . . . . 70.01 111.027 174.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 -66.78 -33.36 75.46 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.284 0.634 . . . . 71.44 111.621 170.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.61 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 8.4 mm-40 -68.83 -25.81 64.85 Favored 'General case' 0 N--CA 1.49 1.544 0 CA-C-N 117.871 0.305 . . . . 74.34 110.47 177.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.565 HD21 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -71.37 -25.39 62.35 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 123.426 0.691 . . . . 73.44 111.146 -177.901 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.41 ' HG2' HG21 ' A' ' 80' ' ' ILE . 57.3 mtpt -56.97 -52.18 66.27 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.786 0.834 . . . . 75.14 112.28 -176.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -61.46 -35.43 77.58 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.095 0.558 . . . . 72.43 111.645 179.495 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.565 ' HD2' HD21 ' A' ' 33' ' ' LEU . 65.4 mttm -65.88 -45.33 82.45 Favored 'General case' 0 C--N 1.352 0.7 0 C-N-CA 123.573 0.749 . . . . 74.45 109.988 -178.078 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 71.9 mt -58.39 -47.7 83.01 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 124.518 1.136 . . . . 75.5 110.843 176.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -58.41 -43.02 88.47 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 123.903 0.752 . . . . 63.21 111.346 178.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -70.85 -41.38 71.54 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.585 0.754 . . . . 73.41 112.52 -178.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 36' ' ' LYS . 94.5 t -64.66 -42.15 94.23 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 C-N-CA 123.234 0.614 . . . . 73.22 110.46 175.591 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.545 HD21 HD11 ' A' ' 60' ' ' ILE . 35.7 mt -64.74 -48.95 72.69 Favored 'General case' 0 C--O 1.212 -0.874 0 CA-C-N 115.481 -0.781 . . . . 64.42 110.135 179.129 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -63.04 -34.65 78.04 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.18 0.592 . . . . 50.51 111.678 177.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -68.86 -40.19 79.47 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.134 0.574 . . . . 63.43 110.079 178.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.41 ' HA ' ' CZ ' ' A' ' 44' ' ' ARG . 0.0 OUTLIER -76.14 -30.14 58.05 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 123.729 0.812 . . . . 75.45 111.337 179.166 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.455 ' SD ' HD13 ' A' ' 12' ' ' ILE . 87.7 mmm -91.1 -15.8 28.86 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 124.272 1.029 . . . . 74.13 112.35 -175.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.573 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 14.4 t70 -68.24 -50.77 28.1 Favored Pre-proline 0 CA--C 1.555 1.172 0 CA-C-O 118.247 -0.882 . . . . 73.41 112.038 -175.732 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.478 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 38.8 Cg_endo -63.08 -23.47 73.54 Favored 'Trans proline' 0 C--N 1.391 2.786 0 C-N-CA 121.812 1.675 . . . . 73.31 111.837 176.339 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.6 HG22 ' SG ' ' A' ' 14' ' ' CYS . 49.1 mm -71.12 -30.34 40.38 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 C-N-CA 124.788 1.235 . . . . 61.43 111.149 -177.244 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.573 ' HE2' ' HA ' ' A' ' 46' ' ' ASP . 45.7 mtmt -73.31 -36.99 66.33 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 122.87 0.468 . . . . 75.13 109.994 176.126 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.5 tmmm? -67.03 -31.48 72.05 Favored 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 123.398 0.679 . . . . 75.33 110.476 173.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 81.8 mt -72.6 -36.45 68.11 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 122.671 0.388 . . . . 75.12 110.021 173.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.57 40.51 18.37 Favored Glycine 0 C--N 1.345 1.083 0 CA-C-N 115.672 -0.695 . . . . 74.04 113.421 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.418 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 94.8 m -77.21 109.77 11.36 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 109.493 -0.558 . . . . 60.44 109.493 174.4 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -63.53 -51.46 65.37 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.978 0.911 . . . . 72.31 110.697 -174.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 68.5 ttt180 -111.36 133.5 53.63 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 109.313 -0.625 . . . . 74.42 109.313 174.007 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 31.5 m -126.34 146.11 32.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 124.002 0.921 . . . . 74.11 109.455 178.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.402 ' O ' ' HA ' ' A' ' 12' ' ' ILE . 24.7 ttm180 -110.0 104.8 13.75 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 108.663 -0.866 . . . . 73.1 108.663 173.064 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 38.0 mt -101.34 105.91 18.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 N-CA-C 108.697 -0.853 . . . . 73.23 108.697 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 11.7 t -103.85 104.7 14.74 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 108.928 -0.767 . . . . 61.24 108.928 178.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.545 HD11 HD21 ' A' ' 41' ' ' LEU . 73.9 mt -96.51 112.43 28.63 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 124.266 1.026 . . . . 75.32 108.921 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 70.4 ttt180 -101.08 120.08 39.68 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 108.019 -1.104 . . . . 73.43 108.019 174.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 4.1 p -95.21 144.67 9.46 Favored 'Isoleucine or valine' 0 C--O 1.243 0.729 0 N-CA-C 108.433 -0.951 . . . . 74.14 108.433 -178.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -92.05 144.17 25.72 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 109.137 -0.69 . . . . 75.42 109.137 177.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -117.32 154.87 30.51 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 124.162 0.985 . . . . 75.11 109.112 -167.725 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 36.7 t -64.54 -56.0 16.88 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 124.311 1.007 . . . . 75.14 111.598 -175.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -149.26 159.63 44.09 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 115.474 -0.784 . . . . 74.51 109.867 -167.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.73 -20.26 65.93 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 114.091 1.145 . . . . 73.25 114.091 -174.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -88.05 -31.05 19.48 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.175 0.59 . . . . 72.13 110.247 170.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 46.0 mm-40 -79.72 -11.25 59.85 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 114.913 -1.04 . . . . 74.55 113.298 -177.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -38.5 -51.45 1.59 Allowed 'General case' 0 N--CA 1.5 2.064 0 C-N-CA 124.381 1.072 . . . . 64.12 112.561 -179.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -80.93 -29.63 35.46 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 114.215 -1.357 . . . . 74.1 111.814 -172.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 56.7 tptt -74.46 -35.82 63.33 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.679 0.792 . . . . 72.41 110.458 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -84.94 -29.11 25.39 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.311 0.644 . . . . 72.24 110.157 -179.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.26 -47.67 75.9 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 123.897 0.748 . . . . 75.21 110.602 173.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp -73.79 -30.28 62.66 Favored 'General case' 0 CA--C 1.551 1.005 0 CA-C-N 116.093 -0.503 . . . . 72.32 111.395 179.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.592 ' HB2' ' HZ3' ' A' ' 76' ' ' LYS . 4.6 ttmp? -57.43 -52.24 66.16 Favored 'General case' 0 N--CA 1.487 1.412 0 CA-C-O 121.438 0.637 . . . . 74.44 109.783 168.847 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -70.8 -19.2 62.71 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-N 114.742 -1.117 . . . . 74.32 111.812 179.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.442 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -61.61 -43.72 98.33 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 117.942 0.337 . . . . 60.23 110.665 174.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.83 -44.16 77.86 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.222 0.609 . . . . 72.24 111.569 174.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.41 HG21 ' HG2' ' A' ' 34' ' ' LYS . 35.2 mm -61.68 -46.71 95.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 C-N-CA 124.172 0.989 . . . . 74.43 111.476 -178.048 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.58 HD13 HG12 ' A' ' 102' ' ' VAL . 51.0 mt -76.53 -30.86 57.32 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.835 0.854 . . . . 74.42 111.118 -178.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 61.4 t30 -60.06 -39.27 85.43 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.207 0.603 . . . . 72.21 109.965 176.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -67.35 -43.28 81.92 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 115.104 -0.953 . . . . 75.24 111.336 175.316 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.408 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 42.8 t -64.36 -50.39 76.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 123.676 0.79 . . . . 75.21 110.676 -174.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.515 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 20.0 m-85 -66.22 -27.03 67.67 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.611 0.764 . . . . 71.25 111.239 -179.439 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.9 -35.58 78.73 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.324 0.649 . . . . 61.52 111.199 172.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -84.79 -1.99 57.09 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.73 0.812 . . . . 72.2 110.606 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 96.3 mt -107.21 -29.48 9.31 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.124 0.97 . . . . 73.01 110.415 176.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 103.44 9.28 38.9 Favored Glycine 0 C--N 1.351 1.389 0 C-N-CA 123.179 0.419 . . . . 62.23 114.121 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.515 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 27.0 m-85 -83.49 135.58 34.61 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.38 0.672 . . . . 74.22 110.052 174.777 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -91.71 168.31 11.57 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 123.814 0.846 . . . . 74.25 110.705 -177.172 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -59.43 -30.65 68.64 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 123.982 0.913 . . . . 63.32 111.254 175.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 54.8 p -65.84 -39.56 90.91 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.175 0.99 . . . . 64.54 111.103 177.209 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -72.17 -22.9 61.22 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.558 0.743 . . . . 74.24 111.241 178.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 88.7 t -96.36 128.38 47.61 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 C-N-CA 124.193 0.997 . . . . 62.24 110.203 -175.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 9.0 t -128.36 141.09 51.53 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.08 0.552 . . . . 62.41 109.885 170.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.442 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 59.9 m95 -111.86 136.76 50.74 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.904 0.882 . . . . 70.11 109.847 178.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -143.11 87.4 1.97 Allowed 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.494 1.118 . . . . 72.14 108.076 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 72.45 -83.65 0.55 Allowed Glycine 0 C--N 1.348 1.24 0 CA-C-N 115.28 -0.873 . . . . 73.24 113.613 176.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 29.4 p-10 -126.66 -6.4 6.3 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.145 0.978 . . . . 74.23 111.745 -175.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 25.8 m -116.18 133.08 56.42 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.641 0.776 . . . . 74.32 109.202 -176.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . 0.58 HG12 HD13 ' A' ' 81' ' ' LEU . 4.8 p -115.39 123.05 70.52 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 C-N-CA 124.057 0.943 . . . . 74.51 108.947 176.491 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 61.0 m -107.08 114.83 29.14 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 108.633 -0.877 . . . . 62.13 108.633 176.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 49.1 t -109.11 110.73 33.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 C-N-CA 123.797 0.839 . . . . 75.14 108.786 175.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -95.56 111.95 23.77 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 107.971 -1.122 . . . . 73.01 107.971 173.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -118.72 177.73 16.5 Favored Glycine 0 C--O 1.24 0.526 0 O-C-N 123.801 0.688 . . . . 44.31 112.24 -176.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 . . . . . 0 C--O 1.243 0.721 0 C-N-CA 123.804 0.842 . . . . 75.42 108.946 177.418 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.2 tptp . . . . . 0 C--O 1.24 0.602 0 CA-C-O 120.694 0.283 . . . . 74.32 110.588 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -86.18 121.9 29.42 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 108.455 -0.943 . . . . 72.41 108.455 169.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.424 HG22 HG21 ' A' ' 62' ' ' VAL . 0.9 OUTLIER -113.17 137.62 45.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 C-N-CA 124.662 1.185 . . . . 74.11 108.108 177.795 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -104.25 112.11 25.0 Favored 'General case' 0 C--O 1.242 0.678 0 N-CA-C 108.181 -1.044 . . . . 75.31 108.181 171.295 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 62.3 t -96.16 106.08 17.88 Favored 'Isoleucine or valine' 0 C--N 1.345 0.373 0 C-N-CA 125.141 1.376 . . . . 72.43 107.98 -176.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -96.81 99.81 11.37 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 108.063 -1.088 . . . . 72.33 108.063 -172.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.8 t -99.15 112.0 30.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 124.115 0.966 . . . . 70.21 109.726 -174.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.484 ' HB3' ' HB3' ' A' ' 59' ' ' SER . 26.6 ttpp -118.56 103.85 10.11 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 107.874 -1.158 . . . . 72.14 107.874 177.604 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.443 HD12 HG13 ' A' ' 48' ' ' ILE . 14.6 tt -113.94 129.84 69.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 123.441 0.696 . . . . 74.24 110.319 -173.38 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 84.8 m -97.82 117.8 32.94 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 109.394 -0.595 . . . . 75.43 109.394 174.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.714 ' SG ' HG21 ' A' ' 48' ' ' ILE . 49.1 t -129.48 118.18 21.69 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.332 1.053 . . . . 53.32 109.171 -178.581 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.562 ' HB2' ' SG ' ' A' ' 53' ' ' CYS . 6.4 t-20 74.3 -1.28 3.12 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 125.341 1.456 . . . . 74.45 112.263 170.338 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 123.41 -6.02 9.27 Favored Glycine 0 C--N 1.351 1.368 0 CA-C-O 119.874 -0.404 . . . . 71.05 113.415 -178.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -108.5 147.38 31.79 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.398 0.679 . . . . 75.51 110.242 179.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 40.2 m -112.31 115.45 28.77 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.717 0.807 . . . . 72.1 110.057 -176.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.401 ' HH ' HD13 ' A' ' 51' ' ' LEU . 61.6 m-85 -110.79 112.74 24.82 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.446 1.098 . . . . 74.24 109.066 -175.406 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -112.93 140.51 47.68 Favored 'General case' 0 N--CA 1.485 1.286 0 CA-C-N 118.329 0.513 . . . . 74.43 110.537 -179.517 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 17.3 tpt180 -161.23 120.46 2.54 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.357 0.663 . . . . 75.12 110.059 -175.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 61.8 m -89.27 116.32 27.4 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.551 0.74 . . . . 74.33 110.013 174.201 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -98.27 136.82 37.91 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.124 0.97 . . . . 74.33 108.764 176.138 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 25.6 mp0 -101.78 111.71 24.06 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 108.823 -0.806 . . . . 73.32 108.823 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.422 ' HB2' HG12 ' A' ' 6' ' ' VAL . 89.9 mt -112.52 161.09 17.15 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.061 0.944 . . . . 75.52 109.893 -179.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 86.1 t80 -151.95 129.38 11.36 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 108.752 -0.833 . . . . 72.41 108.752 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.523 ' HB2' ' HB2' ' A' ' 32' ' ' GLU . . . -150.89 146.21 26.15 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 122.611 0.364 . . . . 72.34 111.171 -179.311 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 48.6 t -65.66 -52.41 50.89 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 O-C-N 124.506 1.129 . . . . 74.15 109.802 175.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 -113.56 160.99 17.94 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 115.371 -0.832 . . . . 70.34 110.167 -177.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.476 ' HB2' HG13 ' A' ' 80' ' ' ILE . 21.6 p-10 -69.59 -28.42 65.94 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.489 0.715 . . . . 71.04 109.969 173.518 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -55.09 -39.44 69.3 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.398 1.079 . . . . 74.33 111.387 170.001 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.523 ' HB2' ' HB2' ' A' ' 27' ' ' ALA . 19.5 mm-40 -77.48 -20.86 53.71 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.271 -0.877 . . . . 73.01 111.677 -177.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.01 -27.86 64.0 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 122.682 0.393 . . . . 72.12 110.556 178.214 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 20.7 mtpp -54.14 -60.25 3.58 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.225 1.01 . . . . 75.45 112.823 -177.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -53.22 -33.96 55.1 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 124.392 1.077 . . . . 75.55 112.132 178.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 52.4 mttm -77.93 -37.43 47.77 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.643 0.777 . . . . 73.21 110.819 -175.182 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.555 HD13 HD23 ' A' ' 81' ' ' LEU . 93.7 mt -65.19 -40.6 94.44 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.445 0.698 . . . . 73.23 111.202 172.868 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 58.1 mtpt -59.69 -40.83 89.16 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.203 0.601 . . . . 74.45 110.637 174.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt -65.91 -53.05 44.55 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 123.562 0.539 . . . . 75.5 111.42 175.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 20.8 t -53.49 -45.15 58.0 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 C-N-CA 124.14 0.976 . . . . 74.1 112.134 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.534 HD23 HD11 ' A' ' 60' ' ' ILE . 97.2 mt -72.94 -51.28 19.06 Favored 'General case' 0 CA--C 1.54 0.577 0 O-C-N 123.58 0.55 . . . . 70.31 111.3 -178.479 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -67.1 -40.39 86.91 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 122.924 0.49 . . . . 73.22 112.006 -174.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -62.05 -43.27 99.19 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.576 0.35 . . . . 64.42 110.079 174.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.1 tpp180 -62.12 -41.99 98.78 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.531 0.732 . . . . 75.32 111.078 176.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.489 ' SD ' HD11 ' A' ' 58' ' ' ILE . 83.2 mtp -94.41 6.91 47.31 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 112.822 0.675 . . . . 74.2 112.822 -169.74 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -75.84 -48.82 3.62 Favored Pre-proline 0 CA--C 1.56 1.363 0 CA-C-O 118.741 -0.647 . . . . 75.25 110.444 168.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.455 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 31.4 Cg_exo -51.97 -37.76 67.99 Favored 'Trans proline' 0 C--N 1.396 3.057 0 C-N-CA 122.146 1.897 . . . . 74.24 112.72 166.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.714 HG21 ' SG ' ' A' ' 14' ' ' CYS . 50.6 mm -66.64 -30.47 49.82 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.35 0 C-N-CA 124.286 1.035 . . . . 74.14 111.528 -173.015 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -66.91 -45.28 78.43 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 123.399 0.679 . . . . 64.14 110.191 173.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.4 tmmm? -61.75 -34.74 76.39 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 114.695 -1.138 . . . . 65.14 111.193 176.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.495 HD11 HD13 ' A' ' 48' ' ' ILE . 85.3 mt -72.39 -29.03 63.37 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.192 0.597 . . . . 75.05 110.811 176.669 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 68.93 83.23 0.17 Allowed Glycine 0 C--N 1.353 1.498 0 O-C-N 123.976 0.798 . . . . 65.24 112.188 174.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.562 ' SG ' ' HB2' ' A' ' 15' ' ' ASN . 89.5 m -123.98 134.51 53.46 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.272 0.629 . . . . 62.14 110.701 -174.209 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -63.66 -65.5 0.67 Allowed 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.554 0.741 . . . . 74.12 110.156 177.075 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 31.9 ttt180 -127.99 126.94 42.33 Favored 'General case' 0 C--O 1.241 0.616 0 C-N-CA 124.019 0.928 . . . . 73.2 108.577 -176.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.456 HG23 ' HE2' ' A' ' 45' ' ' MET . 34.0 m -115.91 140.54 37.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 C-N-CA 123.155 0.582 . . . . 71.13 109.664 179.192 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 24.4 ttm180 -105.96 106.89 17.61 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 108.417 -0.957 . . . . 74.41 108.417 177.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.489 HD11 ' SD ' ' A' ' 45' ' ' MET . 50.9 mt -93.9 114.0 29.7 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 N-CA-C 107.993 -1.114 . . . . 64.32 107.993 179.498 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.484 ' HB3' ' HB3' ' A' ' 11' ' ' LYS . 37.2 t -102.86 102.27 12.37 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.21 -1.033 . . . . 74.24 108.21 -177.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.534 HD11 HD23 ' A' ' 41' ' ' LEU . 78.9 mt -104.85 115.83 47.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 123.409 0.684 . . . . 73.15 109.555 -177.751 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -109.77 129.4 55.63 Favored 'General case' 0 C--O 1.238 0.471 0 N-CA-C 108.518 -0.919 . . . . 75.34 108.518 171.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.424 HG21 HG22 ' A' ' 6' ' ' VAL . 12.4 p -94.97 148.32 5.13 Favored 'Isoleucine or valine' 0 C--O 1.246 0.899 0 N-CA-C 108.293 -1.002 . . . . 74.13 108.293 177.106 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 24.2 ttmm -80.49 137.5 36.46 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 108.813 -0.81 . . . . 73.22 108.813 172.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 31.8 m170 -85.38 128.97 34.9 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.069 0.948 . . . . 74.42 110.446 -173.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 28.0 m -66.23 -65.79 0.63 Allowed 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.713 0.805 . . . . 75.32 111.061 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.455 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 29.6 t70 -162.53 151.98 15.66 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.758 0.823 . . . . 74.01 108.887 -178.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.78 -32.33 63.39 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 124.316 1.047 . . . . 51.13 113.282 -174.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.2 -41.9 89.53 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.054 0.541 . . . . 74.42 110.658 174.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -70.71 -50.03 40.73 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-N 115.157 -0.929 . . . . 74.22 111.592 -177.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 58.0 mt-10 -43.53 -34.56 1.41 Allowed 'General case' 0 N--CA 1.501 2.081 0 C-N-CA 126.026 1.73 . . . . 75.21 115.431 -163.503 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -65.44 -51.27 61.38 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.773 0.829 . . . . 74.23 110.77 -178.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -81.93 -29.93 32.04 Favored 'General case' 0 CA--C 1.552 1.054 0 CA-C-N 115.103 -0.953 . . . . 72.4 111.053 177.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -68.84 -39.08 80.13 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 124.509 1.124 . . . . 73.43 110.3 -173.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.08 -49.69 69.06 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 115.517 -0.765 . . . . 72.31 111.098 177.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -59.97 -40.57 89.51 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.424 1.09 . . . . 72.43 111.503 177.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 68.6 tttt -64.6 -50.59 66.6 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.26 1.424 . . . . 75.13 110.543 -179.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -75.28 -23.69 57.44 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 115.812 -0.631 . . . . 72.05 110.266 -177.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.61 -33.41 72.62 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.584 0.753 . . . . 74.32 110.784 174.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.8 -40.93 83.86 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.422 0.689 . . . . 64.52 110.829 173.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.476 HG13 ' HB2' ' A' ' 30' ' ' ASP . 46.2 mm -67.86 -41.82 85.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.023 0.929 . . . . 73.33 110.794 178.614 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.555 HD23 HD13 ' A' ' 37' ' ' LEU . 42.3 mt -63.96 -47.74 79.25 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.54 0.736 . . . . 64.23 109.533 176.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -55.84 -42.95 76.55 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 124.669 1.187 . . . . 61.13 111.337 -177.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.453 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 43.4 mmtm -67.2 -41.59 85.56 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 115.562 -0.745 . . . . 73.32 111.33 179.291 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.404 HG23 ' HB2' ' A' ' 37' ' ' LEU . 54.4 t -64.68 -40.72 90.02 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.119 0 C-N-CA 123.378 0.671 . . . . 73.4 110.301 -178.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.529 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 19.6 m-85 -64.95 -39.99 94.34 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.265 -0.88 . . . . 75.33 110.53 177.51 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -68.11 -24.33 65.02 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.199 0.6 . . . . 75.11 111.95 176.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.453 ' HG3' ' O ' ' A' ' 83' ' ' LYS . 45.9 mt-10 -80.95 -20.94 40.88 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.651 0.78 . . . . 73.42 111.018 178.08 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.1 mt -106.68 -22.71 12.66 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 122.968 0.507 . . . . 74.52 110.923 -173.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 103.54 39.97 2.47 Favored Glycine 0 C--N 1.351 1.403 0 C-N-CA 123.153 0.406 . . . . 62.1 114.054 177.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.529 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 10.1 m-85 -112.76 134.6 54.2 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 107.432 -1.322 . . . . 74.21 107.432 169.625 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 -83.61 158.37 21.93 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.447 0.699 . . . . 74.54 110.092 -175.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.79 -39.66 78.04 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 124.491 1.117 . . . . 73.4 111.539 177.509 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 22.6 t -60.57 -35.64 76.56 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 124.452 1.101 . . . . 73.54 111.761 178.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -65.3 -26.41 68.06 Favored 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 124.222 1.009 . . . . 74.44 111.977 178.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.482 HG23 HG11 ' A' ' 104' ' ' VAL . 47.1 t -90.91 117.88 35.04 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 124.219 1.007 . . . . 74.1 109.174 -177.51 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 20.7 m -134.65 106.78 7.13 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.598 0.759 . . . . 72.12 109.958 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 69.3 m95 -68.97 109.95 4.2 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 122.731 0.413 . . . . 70.24 110.167 176.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -107.73 96.92 6.73 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 107.993 -1.114 . . . . 74.0 107.993 177.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 68.37 -120.32 11.51 Favored Glycine 0 C--N 1.343 0.927 0 O-C-N 123.675 0.609 . . . . 54.32 112.415 -178.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -79.67 -32.55 41.5 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 124.663 1.185 . . . . 73.42 110.335 -178.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 20.2 m -105.84 148.8 27.14 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.946 0.899 . . . . 74.21 110.129 -169.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.9 p -104.06 136.49 37.03 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 CA-C-O 121.274 0.559 . . . . 73.31 110.012 177.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 27.6 m -103.67 100.02 9.83 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.467 1.507 . . . . 75.11 108.198 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.482 HG11 HG23 ' A' ' 95' ' ' VAL . 42.0 t -108.71 109.6 28.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 N-CA-C 108.23 -1.026 . . . . 73.3 108.23 -179.612 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -106.49 109.58 21.54 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 109.855 -0.424 . . . . 73.43 109.855 -176.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -115.12 137.41 13.91 Favored Glycine 0 C--N 1.333 0.373 0 N-CA-C 110.552 -1.019 . . . . 70.54 110.552 179.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 . . . . . 0 C--O 1.242 0.674 0 N-CA-C 108.823 -0.806 . . . . 74.21 108.823 173.028 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt . . . . . 0 C--O 1.239 0.523 0 N-CA-C 110.788 -0.078 . . . . 75.31 110.788 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 25.3 ttpt -88.49 98.61 11.73 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 107.062 -1.459 . . . . 75.1 107.062 163.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.513 HG21 HG21 ' A' ' 62' ' ' VAL . 0.2 OUTLIER -99.23 126.62 52.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 107.54 -1.282 . . . . 74.34 107.54 -179.745 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -102.25 113.8 27.4 Favored 'General case' 0 C--O 1.24 0.554 0 N-CA-C 108.29 -1.004 . . . . 72.34 108.29 179.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 64.0 t -100.67 109.18 24.68 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 C-N-CA 124.933 1.293 . . . . 74.01 108.658 -172.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.435 ' O ' ' HA ' ' A' ' 60' ' ' ILE . 41.7 mt-30 -96.45 98.17 10.03 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 107.7 -1.222 . . . . 72.25 107.7 -176.113 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 48.6 t -94.07 104.63 15.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 N-CA-C 108.525 -0.917 . . . . 70.5 108.525 -175.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.405 ' HE3' HG21 ' A' ' 18' ' ' THR . 1.7 tmtp? -111.98 102.82 11.03 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 107.573 -1.269 . . . . 71.31 107.573 -176.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.413 ' HA ' ' O ' ' A' ' 57' ' ' ARG . 8.7 tt -119.47 124.34 72.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 122.902 0.481 . . . . 75.23 110.451 -172.047 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 39.0 m -91.5 121.71 33.44 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.269 0.628 . . . . 70.55 109.493 178.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.646 ' SG ' HG22 ' A' ' 48' ' ' ILE . 1.3 t -158.43 143.13 16.13 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.709 1.204 . . . . 74.14 109.878 -177.543 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.401 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 63.3 t30 62.44 25.32 15.1 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 124.182 0.993 . . . . 73.23 111.526 172.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 85.86 -8.19 73.95 Favored Glycine 0 C--N 1.345 1.054 0 CA-C-N 115.766 -0.652 . . . . 73.24 113.498 179.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -108.66 169.51 8.61 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.677 0.791 . . . . 75.14 110.738 -179.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.405 HG21 ' HE3' ' A' ' 11' ' ' LYS . 87.0 m -115.03 123.96 50.4 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 114.905 -1.043 . . . . 74.41 108.771 171.298 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -110.28 100.77 9.59 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 107.718 -1.216 . . . . 70.0 107.718 178.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.7 pp20? -106.27 146.39 30.42 Favored 'General case' 0 C--O 1.242 0.704 0 N-CA-C 108.982 -0.747 . . . . 72.1 108.982 177.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.1 tpt180 -157.21 124.64 5.27 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 123.305 0.378 . . . . 74.34 110.204 174.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 44.0 m -89.17 109.57 20.42 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 108.962 -0.755 . . . . 75.45 108.962 173.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -98.01 135.79 39.21 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 108.814 -0.81 . . . . 73.45 108.814 178.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -97.12 108.69 21.47 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 107.732 -1.21 . . . . 74.04 107.732 175.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 94.7 mt -115.24 137.83 51.6 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 108.233 -1.025 . . . . 73.54 108.233 -178.291 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -132.18 132.55 43.28 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 109.334 -0.617 . . . . 73.21 109.334 -175.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -156.27 149.86 24.76 Favored 'General case' 0 C--O 1.239 0.509 0 C-N-CA 123.323 0.649 . . . . 75.02 109.626 173.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 51.7 t -63.41 -37.69 80.2 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 C-N-CA 124.215 1.006 . . . . 74.11 109.869 174.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 53.4 mtt180 -130.12 145.31 51.69 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.442 0.697 . . . . 74.32 110.848 175.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 35.2 p-10 -69.53 -23.26 63.56 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.063 0.945 . . . . 73.0 111.333 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -59.26 -37.75 78.4 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.224 0.61 . . . . 73.33 110.731 170.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -81.94 -22.24 36.81 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.486 0.715 . . . . 75.44 111.348 179.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.574 HD21 ' HD2' ' A' ' 36' ' ' LYS . 0.7 OUTLIER -70.4 -22.55 62.73 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.411 1.084 . . . . 75.44 110.265 178.189 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.519 ' HG2' HG22 ' A' ' 80' ' ' ILE . 50.1 mtpt -52.79 -53.59 46.13 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 124.004 0.922 . . . . 75.04 113.168 -178.495 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -61.1 -30.14 70.18 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 123.41 0.444 . . . . 63.24 111.717 -177.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.574 ' HD2' HD21 ' A' ' 33' ' ' LEU . 58.0 mttm -67.58 -45.35 75.78 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 123.503 0.502 . . . . 71.43 110.355 174.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.442 HD11 HD23 ' A' ' 81' ' ' LEU . 95.8 mt -58.63 -44.77 90.12 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.735 0.814 . . . . 74.12 111.439 177.124 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.503 ' HG2' HG11 ' A' ' 84' ' ' VAL . 51.2 mtpt -61.25 -47.45 86.0 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 123.764 0.665 . . . . 75.41 111.044 -178.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -62.42 -52.46 63.48 Favored 'General case' 0 N--CA 1.476 0.83 0 O-C-N 123.607 0.567 . . . . 65.32 110.982 178.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 22.4 t -58.0 -42.18 82.08 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 C-N-CA 124.894 1.278 . . . . 74.0 112.52 -178.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 39.4 mt -70.35 -37.75 74.7 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.341 0.657 . . . . 74.31 110.965 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -68.06 -35.76 78.73 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 119.426 -0.321 . . . . 75.54 111.473 175.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -72.93 -45.29 58.93 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.373 0.669 . . . . 73.34 110.818 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.7 tpm_? -60.25 -41.39 93.11 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.86 0.864 . . . . 74.04 110.235 176.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.439 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 64.4 mtp -92.67 2.81 56.52 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 115.64 -0.709 . . . . 74.41 112.821 -178.222 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -65.47 -49.57 62.11 Favored Pre-proline 0 CA--C 1.553 1.07 0 CA-C-O 118.603 -0.713 . . . . 71.53 111.404 178.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.474 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 37.9 Cg_endo -63.69 -27.42 68.66 Favored 'Trans proline' 0 C--N 1.389 2.699 0 C-N-CA 121.391 1.394 . . . . 72.0 111.756 172.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.646 HG22 ' SG ' ' A' ' 14' ' ' CYS . 45.0 mm -74.19 -34.06 36.7 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.02 0 C-N-CA 124.149 0.979 . . . . 72.43 110.729 -173.534 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 45' ' ' MET . 93.0 mttt -73.9 -31.36 63.07 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.276 0.63 . . . . 73.5 110.086 176.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.8 tmmm? -76.14 -29.06 57.66 Favored 'General case' 0 CA--C 1.548 0.903 0 CA-C-N 115.108 -0.951 . . . . 73.31 109.654 175.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 92.1 mt -71.89 -32.28 67.26 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 109.08 -0.711 . . . . 71.15 109.08 173.805 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.38 40.32 33.57 Favored Glycine 0 C--N 1.349 1.253 0 CA-C-N 115.834 -0.621 . . . . 72.42 112.369 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.401 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 68.5 m -71.44 97.11 1.58 Allowed 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 109.415 -0.587 . . . . 74.24 109.415 174.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -50.9 -39.7 55.03 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 125.792 1.637 . . . . 75.41 112.539 -169.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 9.5 ttp180 -134.21 130.76 37.68 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 107.796 -1.187 . . . . 73.51 107.796 179.154 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 23.0 m -124.86 145.19 32.55 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 C-N-CA 122.897 0.479 . . . . 73.43 110.669 -178.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.499 ' HG3' HG23 ' A' ' 103' ' ' THR . 21.1 ttt180 -104.39 108.55 20.02 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 108.237 -1.024 . . . . 74.52 108.237 170.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 37.7 mt -101.62 104.25 16.08 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 N-CA-C 108.253 -1.017 . . . . 74.22 108.253 176.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 70.3 m -101.91 103.48 14.15 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 107.839 -1.171 . . . . 75.12 107.839 177.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.435 ' HA ' ' O ' ' A' ' 9' ' ' GLN . 61.5 mt -98.93 130.25 48.09 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 123.258 0.623 . . . . 72.24 109.83 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 27.8 ttm-85 -115.92 120.04 37.89 Favored 'General case' 0 C--O 1.239 0.506 0 N-CA-C 107.726 -1.212 . . . . 71.34 107.726 174.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.513 HG21 HG21 ' A' ' 6' ' ' VAL . 7.6 p -94.73 139.09 19.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 N-CA-C 108.636 -0.875 . . . . 71.12 108.636 -178.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -81.08 121.56 26.24 Favored 'General case' 0 C--O 1.24 0.596 0 N-CA-C 108.904 -0.776 . . . . 73.24 108.904 -177.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -95.19 149.99 20.7 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.626 0.77 . . . . 71.02 110.35 -176.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 23.5 m -77.32 -44.41 29.66 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.2 1.0 . . . . 71.23 111.455 -178.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -156.39 158.0 36.59 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.189 0.596 . . . . 72.43 110.473 -174.08 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.52 -44.15 89.44 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 124.599 1.16 . . . . 74.33 112.984 -176.353 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -75.6 -22.26 57.07 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 122.9 0.48 . . . . 72.13 110.892 178.085 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -84.6 -17.38 38.92 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 118.894 -0.574 . . . . 75.54 112.034 178.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -57.35 -44.01 83.94 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.096 0.558 . . . . 71.42 111.785 -179.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.423 ' HZ2' ' HB2' ' A' ' 71' ' ' LYS . 0.1 OUTLIER -62.75 -33.98 76.28 Favored 'General case' 0 N--CA 1.479 1.018 0 O-C-N 124.001 0.813 . . . . 74.41 111.17 -179.808 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -70.55 -59.42 2.85 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 109.524 -0.547 . . . . 71.13 109.524 176.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -63.4 -30.21 71.37 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.055 1.342 . . . . 64.12 112.784 -173.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.34 -55.63 15.02 Favored 'General case' 0 C--O 1.213 -0.841 0 N-CA-C 109.313 -0.625 . . . . 74.1 109.313 179.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 5.5 tmtm? -62.24 -43.8 98.0 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 125.241 1.416 . . . . 64.24 110.711 179.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 60.3 tttm -64.1 -55.44 21.97 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.427 1.491 . . . . 73.45 111.637 -175.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -75.04 -19.12 60.18 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 115.207 -0.906 . . . . 75.21 110.603 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.15 -43.18 99.03 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 122.887 0.475 . . . . 73.44 110.89 172.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.456 ' O ' ' HG2' ' A' ' 83' ' ' LYS . . . -60.1 -41.92 93.58 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 124.0 0.812 . . . . 65.23 110.482 176.22 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.519 HG22 ' HG2' ' A' ' 34' ' ' LYS . 42.8 mm -63.09 -50.64 78.58 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 124.385 1.074 . . . . 73.52 111.604 178.549 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.442 HD23 HD11 ' A' ' 37' ' ' LEU . 34.1 mt -64.35 -43.36 94.8 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.279 0.632 . . . . 72.32 110.315 -179.198 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 60.8 t30 -59.5 -40.08 85.91 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 124.505 1.122 . . . . 73.5 110.854 -177.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.456 ' HG2' ' O ' ' A' ' 79' ' ' ALA . 74.7 mmtt -69.26 -41.86 76.36 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 115.588 -0.733 . . . . 73.41 111.213 176.237 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.535 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 37.4 t -62.11 -50.64 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 123.343 0.657 . . . . 72.42 109.884 -178.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.447 ' CE2' HG21 ' A' ' 104' ' ' VAL . 28.3 m-85 -61.28 -36.19 79.37 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.099 0.96 . . . . 74.42 111.544 178.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.83 -31.91 73.01 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.426 0.691 . . . . 73.42 111.449 175.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -85.39 -12.86 51.1 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.139 0.976 . . . . 73.22 111.117 178.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 54.6 mt -98.69 0.24 44.23 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 122.783 0.433 . . . . 75.55 110.11 -178.535 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 96.13 -1.62 62.97 Favored Glycine 0 C--N 1.35 1.355 0 O-C-N 123.443 0.464 . . . . 35.42 113.374 177.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -82.25 140.34 33.71 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 109.603 -0.517 . . . . 72.15 109.603 178.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -70.36 147.33 49.71 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.062 0.545 . . . . 72.31 110.093 178.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -50.67 -55.99 13.97 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 125.288 1.435 . . . . 73.41 111.515 178.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 11.6 t -59.37 -19.92 50.67 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 124.287 1.035 . . . . 72.14 113.543 -174.035 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -74.09 -19.07 60.71 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.104 0.561 . . . . 72.14 112.139 -179.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.474 ' HA ' HG23 ' A' ' 104' ' ' VAL . 49.0 t -74.29 101.2 1.69 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 N-CA-C 107.058 -1.46 . . . . 75.01 107.058 175.62 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 8.1 m -111.43 94.16 4.83 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 109.496 -0.557 . . . . 65.24 109.496 -172.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 65.7 m95 -72.04 107.43 4.74 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 109.003 -0.74 . . . . 74.13 109.003 174.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -101.63 75.57 1.59 Allowed 'General case' 0 C--O 1.238 0.478 0 C-N-CA 124.556 1.143 . . . . 74.42 108.402 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 64.9 -88.14 0.08 OUTLIER Glycine 0 C--N 1.346 1.092 0 CA-C-N 114.988 -1.005 . . . . 72.01 112.789 -178.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -82.97 -61.3 1.9 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.461 1.105 . . . . 75.1 109.779 -178.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 11.5 m -102.5 144.26 31.17 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 114.947 -1.024 . . . . 74.31 110.302 -167.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 6.3 p -103.44 120.05 52.87 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 C-N-CA 123.032 0.533 . . . . 74.41 110.255 -178.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.499 HG23 ' HG3' ' A' ' 57' ' ' ARG . 52.5 m -99.72 110.61 23.0 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.453 1.101 . . . . 73.33 108.812 177.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.474 HG23 ' HA ' ' A' ' 95' ' ' VAL . 46.2 t -112.41 112.66 41.43 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 124.266 1.026 . . . . 74.33 108.381 -176.843 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -92.38 114.34 26.87 Favored 'General case' 0 C--O 1.24 0.599 0 N-CA-C 109.206 -0.664 . . . . 73.24 109.206 -179.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -107.79 137.96 14.32 Favored Glycine 0 C--N 1.342 0.872 0 CA-C-N 115.972 -0.558 . . . . 64.42 112.981 -176.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 23.6 tm0? . . . . . 0 N--CA 1.471 0.588 0 N-CA-C 107.98 -1.118 . . . . 73.23 107.98 171.364 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.4 tmtm? . . . . . 0 C--O 1.243 0.716 0 N-CA-C 107.18 -1.415 . . . . 74.33 107.18 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -71.96 101.39 2.68 Favored 'General case' 0 C--N 1.351 0.657 0 CA-C-O 121.192 0.52 . . . . 74.32 109.612 178.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.3 p -100.35 150.23 5.64 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 124.129 0.972 . . . . 75.24 109.805 -178.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -100.5 113.61 26.53 Favored 'General case' 0 C--O 1.239 0.536 0 N-CA-C 108.463 -0.94 . . . . 71.34 108.463 172.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.434 HG22 HD13 ' A' ' 25' ' ' LEU . 88.8 t -101.39 107.49 21.54 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 124.833 1.253 . . . . 70.21 108.688 -177.21 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -94.93 101.08 12.83 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 107.862 -1.162 . . . . 75.21 107.862 -177.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 92.2 t -96.14 111.07 25.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 N-CA-C 108.907 -0.775 . . . . 75.55 108.907 -177.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.3 ttmm -107.49 102.92 12.15 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.265 1.026 . . . . 74.21 108.329 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 15.2 tt -111.11 121.52 63.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 CA-C-O 121.3 0.571 . . . . 74.51 110.515 -177.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 30.2 m -95.16 119.78 34.25 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.031 0.933 . . . . 73.21 109.364 178.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.647 ' SG ' HG21 ' A' ' 48' ' ' ILE . 21.7 t -150.72 134.98 16.97 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.926 1.29 . . . . 73.31 108.835 -175.405 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.572 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 4.0 t30 65.56 29.87 10.85 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 125.014 1.326 . . . . 75.21 110.473 177.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.19 0.03 75.63 Favored Glycine 0 C--N 1.353 1.52 0 CA-C-N 115.487 -0.779 . . . . 74.24 113.879 -178.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -112.71 164.54 13.24 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.918 0.887 . . . . 74.4 110.645 -177.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 82.3 m -115.84 119.86 37.37 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.569 0.748 . . . . 65.04 110.487 176.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -109.93 120.75 43.45 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 107.115 -1.439 . . . . 74.42 107.115 176.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -143.36 156.46 44.69 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 118.433 0.56 . . . . 74.31 111.994 -177.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 39.3 ttp180 -166.49 134.9 2.85 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-N 114.9 -1.045 . . . . 73.22 108.721 -174.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 57.4 m -91.62 118.6 30.77 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.729 0.812 . . . . 73.11 109.813 178.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 67.7 m-85 -100.41 137.57 38.65 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.203 1.001 . . . . 73.01 109.041 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -100.18 107.89 19.87 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 106.776 -1.565 . . . . 73.12 106.776 173.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.434 HD13 HG22 ' A' ' 8' ' ' VAL . 67.3 mt -111.23 98.28 7.39 Favored 'General case' 0 C--O 1.239 0.513 0 C-N-CA 123.514 0.726 . . . . 73.21 109.304 -175.225 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 68.5 t80 -92.36 140.59 29.44 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 115.568 -0.742 . . . . 73.11 109.464 172.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.513 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -141.5 171.62 13.81 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.883 0.873 . . . . 74.35 109.498 178.078 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 48.1 t -101.81 -28.65 3.14 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 C-N-CA 123.255 0.622 . . . . 73.41 109.455 173.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.579 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 95.2 mtt180 -130.86 174.24 10.17 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.941 0.897 . . . . 75.54 109.745 176.567 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.419 ' HB3' ' HE3' ' A' ' 76' ' ' LYS . 14.0 p-10 -72.46 -39.18 67.95 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.549 0.74 . . . . 74.34 109.91 173.817 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -64.11 -26.72 68.66 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.089 0.956 . . . . 75.24 111.455 -178.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.579 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 38.2 mm-40 -67.84 -32.74 73.48 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.642 0.777 . . . . 71.43 111.293 178.632 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.42 ' HA ' ' HD2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -67.67 -20.08 65.26 Favored 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 123.759 0.824 . . . . 74.11 110.689 -177.391 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.413 ' HE2' ' HB3' ' A' ' 34' ' ' LYS . 36.2 mtpt -56.83 -61.22 2.59 Favored 'General case' 0 C--N 1.362 1.15 0 C-N-CA 123.2 0.6 . . . . 64.13 112.344 179.577 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -57.46 -31.84 66.34 Favored 'General case' 0 N--CA 1.481 1.122 0 O-C-N 124.0 0.812 . . . . 55.41 111.657 -176.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.42 ' HD2' ' HA ' ' A' ' 33' ' ' LEU . 65.9 mttm -67.13 -47.31 71.47 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.907 0.883 . . . . 75.54 110.29 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.513 HD11 HD22 ' A' ' 81' ' ' LEU . 97.2 mt -63.9 -48.17 77.68 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.72 0.808 . . . . 73.1 111.916 177.242 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -60.25 -41.14 92.56 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.605 0.762 . . . . 74.14 111.514 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.428 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 30.2 mmmt -66.93 -51.89 49.7 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 122.611 0.365 . . . . 72.42 111.195 175.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 20.6 t -56.02 -44.11 77.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 C-N-CA 123.381 0.672 . . . . 75.45 111.578 -179.078 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 82.4 mt -69.69 -52.62 24.06 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.051 0.541 . . . . 75.02 110.993 -179.009 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -63.97 -42.74 97.15 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 113.196 0.813 . . . . 72.11 113.196 -177.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.428 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 23.2 mm-40 -67.44 -46.14 73.97 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 122.223 0.209 . . . . 72.43 110.59 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 36.1 tpt85 -70.08 -35.15 73.98 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 122.647 0.379 . . . . 74.43 111.518 -176.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 60.4 mtp -86.93 -7.79 57.85 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 113.11 0.782 . . . . 75.55 113.11 -176.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.405 ' HA ' ' HD3' ' A' ' 49' ' ' LYS . 24.2 t70 -61.49 -48.13 91.43 Favored Pre-proline 0 CA--C 1.569 1.683 0 CA-C-O 118.843 -0.599 . . . . 65.35 111.608 177.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -68.92 -19.17 40.55 Favored 'Trans proline' 0 C--N 1.391 2.811 0 C-N-CA 122.182 1.922 . . . . 71.35 113.554 170.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.647 HG21 ' SG ' ' A' ' 14' ' ' CYS . 46.8 mm -74.68 -34.29 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 C-N-CA 123.624 0.77 . . . . 71.13 110.466 177.135 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.405 ' HD3' ' HA ' ' A' ' 46' ' ' ASP . 5.2 mtpm? -72.85 -32.71 65.65 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.924 0.889 . . . . 72.32 109.626 173.359 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.34 -27.72 68.79 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.549 1.14 . . . . 74.13 110.718 172.641 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.516 HD11 ' SG ' ' A' ' 14' ' ' CYS . 68.3 mt -76.18 -35.09 59.29 Favored 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 109.712 -0.477 . . . . 75.01 109.712 171.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 79.11 35.95 29.07 Favored Glycine 0 C--N 1.345 1.069 0 O-C-N 123.822 0.701 . . . . 71.43 112.374 177.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.572 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 80.8 m -69.99 99.3 1.41 Allowed 'General case' 0 C--N 1.345 0.411 0 N-CA-C 109.285 -0.635 . . . . 61.2 109.285 176.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 44.0 mtmt -55.16 -32.84 62.44 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.954 1.301 . . . . 74.43 112.203 -169.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -125.28 136.63 53.71 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 108.01 -1.107 . . . . 74.24 108.01 168.011 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.406 ' O ' ' HA ' ' A' ' 105' ' ' GLU . 17.1 m -121.16 134.89 63.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 123.603 0.761 . . . . 73.14 109.058 174.664 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -100.55 107.53 19.23 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 108.716 -0.846 . . . . 74.31 108.716 172.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 35.7 mt -104.18 103.42 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 N-CA-C 108.904 -0.776 . . . . 73.51 108.904 177.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 51.4 m -99.91 102.73 14.21 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 108.3 -1.0 . . . . 72.42 108.3 176.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 73.8 mt -97.24 109.54 23.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 C-N-CA 124.021 0.928 . . . . 75.51 108.73 179.242 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -92.07 134.7 34.59 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 107.952 -1.129 . . . . 75.51 107.952 171.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.8 p -94.02 146.96 5.94 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 N-CA-C 106.813 -1.551 . . . . 62.2 106.813 174.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.5 tmtm? -80.43 125.29 29.74 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 107.934 -1.135 . . . . 71.55 107.934 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 14.7 m170 -92.21 106.09 18.17 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 114.874 -1.057 . . . . 62.54 108.312 -178.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 13.6 p -63.85 -43.7 95.35 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.084 0.954 . . . . 73.53 111.35 -178.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -163.83 157.26 18.65 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.551 1.141 . . . . 74.2 108.766 -179.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.43 -26.77 68.08 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.553 0.741 . . . . 74.24 112.844 -174.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -86.38 -45.84 10.82 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.406 0.682 . . . . 64.34 110.44 176.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -68.66 -29.36 67.82 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.838 0.855 . . . . 74.24 112.095 -173.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -67.06 -27.27 67.24 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.412 0.685 . . . . 74.41 111.071 -177.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 71.0 mmtt -67.61 -33.09 74.29 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.82 0.448 . . . . 73.41 109.91 -177.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.497 ' HZ2' ' HB2' ' A' ' 72' ' ' LYS . 0.1 OUTLIER -74.16 -58.08 3.53 Favored 'General case' 0 C--N 1.347 0.469 0 CA-C-N 115.674 -0.694 . . . . 73.21 109.74 172.592 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 48.9 mm-40 -67.06 -31.42 71.91 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 113.735 1.013 . . . . 74.14 113.735 -167.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -78.85 -42.49 27.39 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 118.082 0.401 . . . . 74.54 110.949 -177.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 53.8 tptt -68.74 -38.63 80.28 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.61 0.764 . . . . 75.04 111.128 177.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.419 ' HE3' ' HB3' ' A' ' 30' ' ' ASP . 76.6 tttt -59.18 -50.04 75.56 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 125.483 1.513 . . . . 75.03 110.387 172.51 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -70.12 -29.08 65.93 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 114.934 -1.03 . . . . 74.03 110.48 -177.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.87 -43.71 87.54 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.925 0.89 . . . . 74.24 110.521 178.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.82 -41.95 99.53 Favored 'General case' 0 C--N 1.354 0.798 0 O-C-N 123.987 0.805 . . . . 75.24 110.903 176.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 50.0 mm -62.78 -41.83 93.95 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 C-N-CA 123.66 0.784 . . . . 75.4 110.894 175.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.513 HD22 HD11 ' A' ' 37' ' ' LEU . 47.1 mt -64.76 -37.92 89.23 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.764 0.826 . . . . 75.14 110.921 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -57.25 -45.14 84.25 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.771 0.828 . . . . 72.31 110.49 178.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 9.7 mmpt? -66.97 -41.26 87.13 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 114.892 -1.049 . . . . 74.52 110.495 -178.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.48 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 54.6 t -65.69 -56.71 13.82 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 C-N-CA 124.071 0.949 . . . . 63.21 110.571 -177.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.516 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 22.0 m-85 -60.13 -38.1 82.05 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 124.098 0.959 . . . . 74.42 111.569 -177.345 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.74 -30.04 71.18 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.577 0.751 . . . . 75.33 111.835 177.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -87.59 -9.03 55.5 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.491 0.716 . . . . 75.05 111.949 177.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.48 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 59.8 mt -105.0 -15.32 15.14 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 122.724 0.409 . . . . 75.21 110.543 -178.695 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 95.11 13.83 51.07 Favored Glycine 0 C--N 1.348 1.213 0 CA-C-N 116.257 -0.429 . . . . 64.21 113.484 178.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.516 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 14.3 m-85 -87.5 124.32 33.34 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 108.518 -0.919 . . . . 71.45 108.518 173.699 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 38.6 t-20 -81.87 146.84 29.63 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.708 0.803 . . . . 74.22 110.008 -171.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -53.15 -36.15 60.53 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 125.257 1.423 . . . . 75.2 111.425 173.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 17.2 m -57.15 -21.23 31.24 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 124.706 1.202 . . . . 75.43 113.378 178.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -105.89 -10.48 16.63 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.425 1.09 . . . . 71.02 111.896 -173.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 60.9 t -87.43 103.43 13.37 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 C-N-CA 123.628 0.771 . . . . 74.5 109.696 -175.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 30.8 m -108.89 115.49 30.18 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.015 0.926 . . . . 71.44 110.798 -172.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 55.5 m95 -97.81 144.1 27.76 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.007 0.523 . . . . 73.32 111.314 177.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -132.41 66.54 1.55 Allowed 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 108.172 -1.047 . . . . 73.32 108.172 170.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 42.06 22.7 0.12 Allowed Glycine 0 N--CA 1.488 2.135 0 N-CA-C 118.023 1.969 . . . . 62.4 118.023 174.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -175.04 -52.73 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.418 0 CA-C-N 118.148 0.974 . . . . 74.43 110.615 -168.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 52.7 m -117.58 151.8 36.42 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.393 1.077 . . . . 73.15 109.483 -177.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 6.5 p -126.05 113.47 34.31 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.198 0 C-N-CA 123.275 0.63 . . . . 74.33 111.074 176.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 53.6 m -92.8 101.21 13.59 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.693 1.197 . . . . 75.35 109.082 175.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.469 HG21 ' CE2' ' A' ' 85' ' ' PHE . 55.8 t -104.9 112.33 38.09 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 C-N-CA 124.623 1.169 . . . . 74.44 108.419 177.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . 0.406 ' HA ' ' O ' ' A' ' 56' ' ' VAL . 47.4 mt-10 -96.12 156.67 16.24 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.048 -0.723 . . . . 75.22 109.048 175.0 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -154.05 142.37 9.06 Favored Glycine 0 C--O 1.241 0.541 0 C-N-CA 121.387 -0.435 . . . . 72.24 112.332 176.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 23.0 tp60 . . . . . 0 C--N 1.351 0.644 0 N-CA-C 106.897 -1.52 . . . . 74.03 106.897 171.525 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.807 0 CA-C-O 121.172 0.51 . . . . 74.42 110.674 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -97.06 101.95 13.63 Favored 'General case' 0 C--O 1.239 0.513 0 N-CA-C 106.659 -1.608 . . . . 75.11 106.659 167.168 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.2 p -100.23 134.42 39.93 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 C-N-CA 124.148 0.979 . . . . 75.32 108.642 -178.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.42 ' HA ' ' O ' ' A' ' 23' ' ' TYR . 34.6 mt-10 -106.29 113.51 27.08 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 108.058 -1.09 . . . . 74.52 108.058 175.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 77.6 t -97.25 107.74 20.46 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 114.827 -1.079 . . . . 71.4 108.331 -176.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -94.52 99.75 11.85 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 107.26 -1.385 . . . . 74.12 107.26 -177.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 97.2 t -94.56 103.31 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 N-CA-C 108.113 -1.069 . . . . 74.41 108.113 -177.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.442 ' HG3' ' HB3' ' A' ' 20' ' ' GLU . 34.7 ttmt -115.0 101.21 8.79 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 107.732 -1.21 . . . . 75.24 107.732 -176.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.45 HD12 HG13 ' A' ' 48' ' ' ILE . 11.3 tt -116.24 125.95 73.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 C-N-CA 123.376 0.67 . . . . 74.53 110.373 -169.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 55.5 m -92.07 122.47 34.61 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 109.944 -0.391 . . . . 72.42 109.944 176.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.508 ' SG ' HG22 ' A' ' 48' ' ' ILE . 14.6 t -155.86 147.99 23.45 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.462 1.505 . . . . 64.41 108.644 -178.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.448 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 11.6 t30 67.17 18.51 10.39 Favored 'General case' 0 N--CA 1.499 1.994 0 CA-C-O 121.791 0.805 . . . . 74.44 110.682 174.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.5 7.11 88.73 Favored Glycine 0 C--N 1.358 1.772 0 CA-C-N 115.495 -0.775 . . . . 74.23 113.586 -176.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.621 ' HB3' ' HZ2' ' A' ' 17' ' ' LYS . 7.9 mtpm? -124.98 169.2 12.34 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.114 0.965 . . . . 72.35 110.397 -178.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.4 m -120.05 115.0 22.84 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 109.923 -0.399 . . . . 72.34 109.923 -178.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 61.9 m-85 -104.45 102.97 12.6 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.717 1.207 . . . . 75.33 108.996 -175.423 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.442 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -105.57 161.25 14.53 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 122.84 0.456 . . . . 75.45 111.282 -179.261 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 20.2 ttt180 -169.15 130.11 1.13 Allowed 'General case' 0 N--CA 1.477 0.888 0 O-C-N 123.893 0.746 . . . . 72.42 109.778 174.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 26.0 m -93.16 111.82 23.57 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.006 0.923 . . . . 74.22 109.692 178.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.42 ' O ' ' HA ' ' A' ' 7' ' ' GLU . 87.5 m-85 -98.69 122.49 41.98 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.646 0.778 . . . . 74.14 110.363 -177.394 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 24.9 mp0 -88.69 111.07 21.52 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 107.972 -1.122 . . . . 74.01 107.972 174.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.517 HD13 HG21 ' A' ' 40' ' ' VAL . 80.9 mt -124.77 119.26 28.39 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.215 1.006 . . . . 75.04 108.459 -177.715 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 87.2 t80 -113.74 138.87 49.64 Favored 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 109.751 -0.462 . . . . 75.15 109.751 179.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -156.7 149.79 24.04 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.125 0.57 . . . . 74.32 110.187 175.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 26.7 t -68.48 -26.94 34.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 124.627 1.171 . . . . 71.01 110.417 175.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.524 ' HB3' ' HG2' ' A' ' 31' ' ' GLU . 74.4 mtt180 -135.35 137.71 42.65 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.111 0.964 . . . . 72.1 110.017 178.254 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -71.82 -17.78 62.13 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 123.269 0.628 . . . . 63.2 111.717 176.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.524 ' HG2' ' HB3' ' A' ' 29' ' ' ARG . 13.5 pt-20 -70.74 -27.68 64.14 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 122.621 0.368 . . . . 73.23 110.876 172.116 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.464 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 31.5 mm-40 -83.47 -23.04 32.39 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.22 0.608 . . . . 74.2 110.476 177.323 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.01 -21.29 65.95 Favored 'General case' 0 CA--C 1.56 1.364 0 C-N-CA 124.168 0.987 . . . . 74.43 110.106 178.031 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -48.29 -56.56 7.73 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 124.289 1.036 . . . . 74.12 112.505 178.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.409 ' HA ' ' HD3' ' A' ' 38' ' ' LYS . 1.9 pp20? -60.33 -31.87 70.71 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.215 0.606 . . . . 74.33 112.08 -176.711 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -70.59 -40.6 73.14 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.378 0.671 . . . . 74.01 110.59 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.47 HD12 HD23 ' A' ' 81' ' ' LEU . 77.6 mt -63.33 -33.65 75.99 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.717 0.807 . . . . 72.31 111.067 174.625 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.528 ' HA ' HD11 ' A' ' 88' ' ' LEU . 57.3 mtpt -65.3 -41.85 93.67 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.383 0.673 . . . . 72.45 110.93 175.54 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.4 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 42.7 mmtm -61.5 -51.51 68.35 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 109.392 -0.596 . . . . 74.4 109.392 175.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.517 HG21 HD13 ' A' ' 25' ' ' LEU . 38.7 t -54.05 -50.86 51.47 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 C-N-CA 124.781 1.232 . . . . 71.43 111.863 -178.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 80.1 mt -67.41 -51.53 50.65 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.165 0.586 . . . . 74.02 111.534 -177.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -66.1 -38.9 89.37 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.088 0.555 . . . . 71.44 112.296 -174.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -70.72 -42.54 70.46 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.022 0.529 . . . . 75.34 110.736 176.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 18.6 tpt180 -69.93 -34.49 73.53 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 122.658 0.383 . . . . 72.13 111.743 -178.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 62.0 mtp -91.88 -8.24 46.98 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.532 0.567 . . . . 75.41 112.532 -177.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -59.05 -49.29 94.04 Favored Pre-proline 0 CA--C 1.569 1.674 0 CA-C-O 118.9 -0.572 . . . . 74.12 111.673 174.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -67.54 -25.53 40.99 Favored 'Trans proline' 0 C--N 1.394 2.967 0 C-N-CA 122.035 1.824 . . . . 72.43 112.571 174.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.508 HG22 ' SG ' ' A' ' 14' ' ' CYS . 50.9 mm -72.64 -33.89 45.96 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.114 0 C-N-CA 124.169 0.988 . . . . 73.5 110.918 -177.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -71.09 -31.98 68.5 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.753 0.821 . . . . 75.02 110.073 176.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.7 tmmm? -71.7 -33.11 68.51 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 115.112 -0.949 . . . . 71.5 110.699 172.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 91.2 mt -69.43 -30.68 68.66 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 109.345 -0.613 . . . . 73.55 109.345 177.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 93.28 19.19 36.52 Favored Glycine 0 C--N 1.345 1.067 0 CA-C-N 115.446 -0.797 . . . . 75.4 113.787 172.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.448 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 71.6 m -71.35 102.82 2.7 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.837 0.319 . . . . 73.14 111.055 -177.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -55.67 -56.62 18.31 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.87 1.268 . . . . 73.54 110.016 176.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 14.1 tpp85 -103.23 125.54 49.95 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 114.781 -1.1 . . . . 74.05 109.366 176.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 26.8 m -122.09 142.97 36.31 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.03 0.932 . . . . 74.44 109.212 172.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.3 ttm105 -111.17 106.11 15.02 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 108.006 -1.109 . . . . 74.5 108.006 172.174 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 24.5 mt -101.57 112.46 34.7 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 N-CA-C 108.203 -1.036 . . . . 75.43 108.203 -179.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 46.5 m -100.73 104.61 15.89 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 107.859 -1.163 . . . . 75.13 107.859 176.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 75.8 mt -100.38 115.31 41.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 N-CA-C 109.081 -0.711 . . . . 74.42 109.081 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -101.66 123.97 46.54 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 108.518 -0.919 . . . . 75.44 108.518 172.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 7.8 p -93.19 130.5 42.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 N-CA-C 107.683 -1.229 . . . . 73.55 107.683 178.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? -81.76 118.79 23.15 Favored 'General case' 0 C--O 1.243 0.713 0 N-CA-C 107.11 -1.441 . . . . 72.4 107.11 179.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 23.1 m170 -72.5 131.65 42.82 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 115.328 -0.851 . . . . 73.2 108.989 -177.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 40.6 t -59.81 -45.05 93.57 Favored 'General case' 0 CA--C 1.55 0.963 0 O-C-N 123.948 0.78 . . . . 52.14 110.933 -179.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -154.97 163.83 39.75 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 123.523 0.729 . . . . 73.11 110.672 -178.488 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -56.66 -47.69 79.22 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.397 1.479 . . . . 62.21 112.817 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.43 -31.31 68.44 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 122.642 0.377 . . . . 74.52 111.015 177.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -76.79 -15.98 59.59 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 115.36 -0.837 . . . . 72.33 112.747 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -54.0 -54.84 33.51 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.901 0.48 . . . . 71.33 112.197 -174.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -66.85 -44.72 80.28 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.442 0.697 . . . . 75.23 111.196 -174.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 24.4 ttmm -63.62 -59.54 4.48 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 115.47 -0.786 . . . . 75.42 110.529 -178.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -74.14 -20.66 60.16 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 113.301 0.852 . . . . 71.04 113.301 -172.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.16 -43.34 64.74 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-N 119.386 0.994 . . . . 72.12 109.559 175.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -65.44 -37.91 88.28 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.115 0.966 . . . . 73.02 111.681 176.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.418 ' HZ3' ' HB3' ' A' ' 76' ' ' LYS . 9.7 mtpm? -71.11 -44.24 66.05 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.048 0.539 . . . . 65.33 110.65 177.627 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -76.88 -18.73 58.15 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.253 0.621 . . . . 75.44 109.784 -176.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.12 -45.96 92.53 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.346 0.659 . . . . 75.43 109.904 169.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -73.03 -32.9 65.39 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 124.047 0.842 . . . . 54.03 111.391 178.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.437 ' O ' HG21 ' A' ' 84' ' ' VAL . 46.3 mm -62.81 -54.24 36.37 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 C-N-CA 123.095 0.558 . . . . 74.02 109.825 174.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.47 HD23 HD12 ' A' ' 37' ' ' LEU . 32.2 mt -60.41 -44.99 95.17 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.8 0.84 . . . . 74.4 110.339 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 57.5 t30 -64.27 -33.7 76.41 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.602 0.761 . . . . 73.43 110.721 -175.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.474 ' O ' ' HG2' ' A' ' 87' ' ' GLU . 27.7 mmtp -73.04 -35.16 66.69 Favored 'General case' 0 C--O 1.213 -0.843 0 CA-C-O 119.007 -0.52 . . . . 71.44 111.485 174.15 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.437 HG21 ' O ' ' A' ' 80' ' ' ILE . 69.0 t -66.81 -36.44 77.22 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 CA-C-O 121.388 0.614 . . . . 73.42 110.604 177.286 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.545 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 24.2 m-85 -62.38 -43.24 99.28 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 114.9 -1.045 . . . . 73.31 109.623 173.33 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -69.45 -28.53 66.19 Favored 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 122.851 0.46 . . . . 74.34 111.461 175.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 83' ' ' LYS . 58.0 mm-40 -65.11 -34.75 79.14 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 124.084 0.954 . . . . 73.11 110.84 177.65 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.528 HD11 ' HA ' ' A' ' 38' ' ' LYS . 70.9 mt -107.27 -6.6 17.14 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 122.994 0.518 . . . . 74.11 112.204 -170.188 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 93.28 54.9 1.65 Allowed Glycine 0 C--N 1.346 1.09 0 CA-C-O 121.331 0.406 . . . . 72.34 113.267 176.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.545 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 72.9 m-85 -118.16 145.96 44.55 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 106.816 -1.55 . . . . 73.24 106.816 169.236 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -76.83 158.44 30.82 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 122.949 0.5 . . . . 71.34 110.273 178.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -64.82 -35.94 82.74 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.333 0.653 . . . . 74.21 110.359 176.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 18.1 m -51.11 -35.38 35.02 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 124.938 1.295 . . . . 74.13 112.975 174.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . 0.437 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 3.2 m-20 -58.96 -37.88 77.79 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 124.057 0.943 . . . . 75.53 110.973 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 17.6 t -83.73 110.24 18.23 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 C-N-CA 124.183 0.993 . . . . 54.35 109.502 -169.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 51.8 m -139.26 113.98 9.24 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 122.867 0.467 . . . . 54.32 109.972 174.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.438 ' HA ' ' HA ' ' A' ' 102' ' ' VAL . 60.7 m95 -79.04 121.77 25.38 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.197 0.599 . . . . 72.33 110.597 176.709 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -101.07 87.9 3.38 Favored 'General case' 0 C--O 1.242 0.678 0 C-N-CA 124.79 1.236 . . . . 75.3 107.71 168.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.87 -103.1 0.78 Allowed Glycine 0 C--N 1.343 0.956 0 CA-C-N 115.82 -0.627 . . . . 64.42 112.196 -174.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -106.4 -8.51 17.13 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.405 0.682 . . . . 70.24 111.645 -176.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 37.3 m -109.71 127.21 54.44 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 108.881 -0.785 . . . . 73.21 108.881 178.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . 0.438 ' HA ' ' HA ' ' A' ' 97' ' ' TRP . 8.1 p -95.32 118.4 41.43 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 N-CA-C 108.841 -0.8 . . . . 73.22 108.841 176.458 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 39.4 m -92.72 100.41 12.91 Favored 'General case' 0 C--O 1.242 0.67 0 N-CA-C 107.576 -1.268 . . . . 72.12 107.576 176.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.437 ' HA ' ' O ' ' A' ' 94' ' ' ASN . 60.8 t -103.69 110.3 29.66 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 N-CA-C 108.301 -1.0 . . . . 73.33 108.301 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -101.71 111.46 23.71 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 108.526 -0.916 . . . . 71.24 108.526 176.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -116.57 155.16 16.37 Favored Glycine 0 C--N 1.342 0.876 0 CA-C-N 115.421 -0.809 . . . . 70.42 112.594 -172.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 . . . . . 0 C--O 1.243 0.75 0 C-N-CA 123.475 0.71 . . . . 71.54 109.217 170.413 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 57.2 mttm . . . . . 0 C--O 1.245 0.858 0 CA-C-O 120.891 0.376 . . . . 71.51 110.61 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -80.35 102.67 9.71 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 105.432 -2.062 . . . . 74.12 105.432 160.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.1 p -102.42 134.29 43.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 124.373 1.069 . . . . 75.44 108.44 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.534 ' HB2' ' HG3' ' A' ' 63' ' ' LYS . 46.8 mt-10 -107.96 115.2 29.69 Favored 'General case' 0 C--O 1.243 0.728 0 N-CA-C 107.876 -1.157 . . . . 75.03 107.876 175.9 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 99.1 t -95.72 109.27 22.33 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 CA-C-N 114.025 -1.443 . . . . 64.12 108.333 -174.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.441 ' HG2' HG22 ' A' ' 22' ' ' THR . 36.5 mt-30 -94.21 100.97 12.95 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 107.933 -1.136 . . . . 74.24 107.933 -176.151 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 98.5 t -95.77 104.2 15.56 Favored 'Isoleucine or valine' 0 C--O 1.243 0.753 0 N-CA-C 108.779 -0.823 . . . . 75.14 108.779 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.498 ' HG3' ' HB3' ' A' ' 20' ' ' GLU . 39.0 ttpt -108.64 102.54 11.59 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 108.042 -1.095 . . . . 73.43 108.042 -179.261 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.507 HD11 HG13 ' A' ' 48' ' ' ILE . 15.8 tt -111.48 120.19 61.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 C-N-CA 123.364 0.666 . . . . 75.52 110.29 -176.142 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 7.0 m -92.28 108.46 19.97 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 108.605 -0.887 . . . . 62.43 108.605 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.646 ' SG ' HG21 ' A' ' 48' ' ' ILE . 52.5 t -128.7 119.34 24.46 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.947 0.899 . . . . 75.54 108.986 -175.157 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.496 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 22.1 t-20 77.3 -8.61 1.65 Allowed 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 126.327 1.851 . . . . 74.4 112.602 173.619 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 124.17 -4.43 8.96 Favored Glycine 0 C--N 1.341 0.857 0 CA-C-O 119.861 -0.41 . . . . 73.44 112.588 -175.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -106.25 144.97 32.19 Favored 'General case' 0 C--O 1.241 0.642 0 C-N-CA 123.084 0.554 . . . . 74.14 109.672 179.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 47.2 m -94.32 108.32 20.22 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.809 0.844 . . . . 75.42 108.731 177.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 70.6 m-85 -101.65 101.35 11.86 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 107.843 -1.169 . . . . 75.11 107.843 177.191 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.498 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 0.2 OUTLIER -123.23 141.84 51.56 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 122.846 0.458 . . . . 75.51 111.049 -178.146 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 41.1 ttm180 -154.94 135.8 13.69 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.374 -0.83 . . . . 73.44 108.94 177.055 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.441 HG22 ' HG2' ' A' ' 9' ' ' GLN . 29.8 m -94.6 117.13 29.65 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.377 1.071 . . . . 75.35 108.31 177.668 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.524 ' HH ' ' HD3' ' A' ' 44' ' ' ARG . 94.9 m-85 -99.17 120.28 39.24 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.111 0.964 . . . . 71.21 110.034 -176.644 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -83.33 109.24 17.11 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 108.204 -1.036 . . . . 73.3 108.204 178.104 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 96.6 mt -119.49 148.36 43.36 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.02 0.928 . . . . 75.34 109.101 179.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 54.0 t80 -136.39 139.86 42.79 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 108.42 -0.955 . . . . 74.44 108.42 174.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.545 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -162.72 151.81 15.12 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 123.683 0.793 . . . . 73.34 109.377 174.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 43.5 t -76.0 -71.14 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 N-CA-C 108.633 -0.877 . . . . 73.13 108.633 175.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.469 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 57.1 mtp85 -82.18 155.36 25.0 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.352 0.596 . . . . 73.54 110.977 -179.52 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -68.63 -28.65 67.09 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 114.952 -1.022 . . . . 70.14 110.955 175.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 60.8 mm-40 -58.61 -36.07 73.47 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.529 0.732 . . . . 73.53 111.644 171.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.545 ' HB2' ' HB1' ' A' ' 27' ' ' ALA . 9.2 mm-40 -67.58 -34.09 76.34 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 123.717 0.807 . . . . 74.32 110.822 -179.443 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.4 HD22 ' HB2' ' A' ' 27' ' ' ALA . 0.2 OUTLIER -73.07 -25.26 60.84 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.554 0.742 . . . . 70.55 110.871 -177.633 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -53.94 -59.73 4.25 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.766 0.826 . . . . 74.15 112.252 -178.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -57.65 -33.46 68.32 Favored 'General case' 0 N--CA 1.479 0.987 0 O-C-N 124.088 0.868 . . . . 73.11 111.894 -178.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 64.6 mttm -68.66 -44.9 73.12 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 123.418 0.687 . . . . 74.53 109.912 -179.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 89.6 mt -65.08 -36.84 85.61 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.767 0.827 . . . . 72.41 111.482 178.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.529 ' HA ' HD11 ' A' ' 88' ' ' LEU . 59.2 mtpt -63.58 -43.22 97.61 Favored 'General case' 0 C--N 1.357 0.897 0 C-N-CA 122.778 0.431 . . . . 72.25 110.138 177.18 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -66.92 -47.91 70.27 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 123.467 0.479 . . . . 74.33 111.623 176.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 54.8 t -57.86 -41.87 80.88 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.227 0 C-N-CA 123.57 0.748 . . . . 72.3 110.747 -178.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.549 HD23 HD12 ' A' ' 60' ' ' ILE . 74.6 mt -72.21 -51.12 22.53 Favored 'General case' 0 C--O 1.217 -0.633 0 CA-C-O 118.755 -0.64 . . . . 75.0 111.425 178.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -55.69 -50.21 70.88 Favored 'General case' 0 N--CA 1.496 1.851 0 C-N-CA 122.901 0.48 . . . . 70.15 112.027 -179.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 56.3 mm-40 -63.01 -34.77 78.27 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 115.966 -0.561 . . . . 75.3 110.827 178.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.524 ' HD3' ' HH ' ' A' ' 23' ' ' TYR . 20.5 tpt180 -65.7 -45.52 82.48 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.296 0.638 . . . . 75.12 110.954 176.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.591 ' HE3' HG23 ' A' ' 56' ' ' VAL . 94.6 mmm -80.57 -21.83 41.33 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.698 0.799 . . . . 74.32 112.379 -170.13 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -57.38 -55.73 41.38 Favored Pre-proline 0 CA--C 1.565 1.531 0 O-C-N 123.721 0.638 . . . . 63.34 111.521 -178.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.406 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 60.8 Cg_endo -69.27 -24.71 31.61 Favored 'Trans proline' 0 C--N 1.389 2.689 0 C-N-CA 121.623 1.549 . . . . 65.54 112.334 177.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.646 HG21 ' SG ' ' A' ' 14' ' ' CYS . 44.7 mm -69.99 -34.42 59.7 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.015 0 C-N-CA 123.938 0.895 . . . . 73.21 111.506 -177.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 58.4 mtpt -67.14 -35.6 80.07 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 109.998 -0.371 . . . . 75.2 109.998 173.591 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.32 -35.65 79.85 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 123.772 0.829 . . . . 75.45 109.376 176.088 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.41 HD11 HD12 ' A' ' 48' ' ' ILE . 91.7 mt -70.79 -23.29 62.35 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 122.86 0.464 . . . . 73.01 110.008 175.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 71.88 39.63 59.0 Favored Glycine 0 C--N 1.343 0.97 0 CA-C-N 115.667 -0.697 . . . . 75.1 113.968 168.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.496 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 72.8 m -79.03 111.76 15.55 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 122.498 0.319 . . . . 74.32 111.03 -178.462 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -46.74 -37.22 8.16 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 126.177 1.791 . . . . 73.32 112.864 178.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.463 ' HD2' ' N ' ' A' ' 56' ' ' VAL . 0.0 OUTLIER -146.2 136.86 24.16 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 107.469 -1.308 . . . . 75.32 107.469 175.096 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.591 HG23 ' HE3' ' A' ' 45' ' ' MET . 31.0 m -124.66 142.14 42.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 124.472 1.109 . . . . 71.34 109.879 177.075 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.4 ' O ' ' HA ' ' A' ' 12' ' ' ILE . 52.9 ttp180 -111.01 105.5 14.28 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 109.056 -0.72 . . . . 72.32 109.056 176.357 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.416 HD13 ' SD ' ' A' ' 45' ' ' MET . 52.0 mt -94.79 109.59 22.51 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 125.312 1.445 . . . . 73.43 108.184 176.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 27.4 m -107.19 105.48 15.48 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 108.229 -1.026 . . . . 73.0 108.229 177.069 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.549 HD12 HD23 ' A' ' 41' ' ' LEU . 79.8 mt -97.6 122.83 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 123.564 0.746 . . . . 75.15 109.341 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 79.6 mtt-85 -110.68 138.01 47.62 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.515 0.726 . . . . 74.5 109.604 174.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.5 p -99.39 139.64 20.62 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 N-CA-C 108.21 -1.033 . . . . 75.32 108.21 170.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.534 ' HG3' ' HB2' ' A' ' 7' ' ' GLU . 10.6 mmpt? -81.97 127.48 33.09 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 122.641 0.376 . . . . 75.35 110.438 178.81 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 20.2 p80 -147.16 154.16 40.74 Favored 'General case' 0 C--O 1.24 0.564 0 C-N-CA 123.896 0.878 . . . . 61.41 110.598 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 71.8 p -164.91 32.66 0.06 Allowed 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.981 0.912 . . . . 62.24 109.056 174.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -135.85 82.11 1.93 Allowed 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 107.509 -1.293 . . . . 75.44 107.509 -175.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.61 -6.23 5.04 Favored 'General case' 0 N--CA 1.483 1.181 0 N-CA-C 113.911 1.078 . . . . 61.02 113.911 -166.08 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -78.48 -66.99 0.78 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.231 0.612 . . . . 74.51 110.205 170.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.409 ' O ' ' HG2' ' A' ' 73' ' ' GLU . 44.5 mm-40 -84.35 -27.65 27.58 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 113.384 0.883 . . . . 75.35 113.384 -168.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -59.73 -29.39 68.11 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 112.943 0.72 . . . . 71.31 112.943 -172.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -76.36 -30.23 57.51 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.029 0.932 . . . . 73.33 110.496 -178.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -72.94 -41.72 64.2 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.417 1.087 . . . . 73.23 109.884 172.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.409 ' HG2' ' O ' ' A' ' 69' ' ' GLU . 10.7 mm-40 -79.92 -23.0 42.06 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 115.781 -0.645 . . . . 72.12 111.946 -173.345 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -76.48 -40.3 50.71 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 122.824 0.449 . . . . 64.22 109.947 174.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.3 ttmm -57.26 -41.71 80.19 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 124.238 1.015 . . . . 74.24 110.587 170.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -66.75 -45.02 79.88 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 114.423 -1.262 . . . . 74.41 110.712 178.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -72.7 -22.35 60.91 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.411 1.084 . . . . 74.12 110.089 -176.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.423 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -63.87 -46.51 84.6 Favored 'General case' 0 C--N 1.354 0.761 0 C-N-CA 123.812 0.845 . . . . 52.12 110.472 173.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.38 -34.96 73.18 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 115.372 -0.831 . . . . 63.01 111.533 178.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 31.9 mm -62.13 -54.76 30.1 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 123.636 0.775 . . . . 72.22 111.224 177.096 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 16.2 mt -67.78 -26.97 66.37 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 122.564 0.345 . . . . 75.23 111.535 178.076 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -61.63 -37.54 84.34 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.045 0.538 . . . . 73.41 110.074 174.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.547 ' HB3' ' HZ2' ' A' ' 83' ' ' LYS . 3.1 mmmp? -69.07 -47.37 65.45 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 115.9 -0.591 . . . . 71.12 110.931 172.322 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.413 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 71.8 t -61.01 -55.96 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 123.745 0.818 . . . . 72.34 111.083 -172.314 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.443 ' CZ ' HG22 ' A' ' 104' ' ' VAL . 35.0 m-85 -56.6 -44.26 80.93 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 124.218 0.949 . . . . 74.35 111.607 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.41 -32.06 73.39 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.19 0.596 . . . . 75.32 111.633 -179.268 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -86.15 -12.34 50.19 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.858 0.863 . . . . 74.23 111.77 -179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.529 HD11 ' HA ' ' A' ' 38' ' ' LYS . 41.7 mt -106.64 8.97 31.42 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.126 0.57 . . . . 70.54 111.253 -179.213 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 86.54 14.8 65.05 Favored Glycine 0 C--N 1.347 1.172 0 N-CA-C 114.221 0.448 . . . . 63.15 114.221 174.082 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.472 ' HH ' ' HG3' ' A' ' 45' ' ' MET . 63.4 m-85 -94.94 134.66 37.35 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.285 0.634 . . . . 72.45 110.304 174.636 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -88.47 162.03 16.69 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.001 0.92 . . . . 73.4 108.957 178.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -60.94 -28.29 68.85 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.635 0.774 . . . . 64.0 111.9 177.137 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 35.9 t -59.56 -31.36 69.35 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.087 0.955 . . . . 74.03 111.466 177.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . 0.515 ' ND2' ' HA2' ' A' ' 106' ' ' GLY . 18.7 m120 -76.04 -32.89 59.55 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 122.902 0.481 . . . . 72.34 111.019 178.196 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 44.5 t -106.42 116.21 49.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 123.515 0.726 . . . . 63.14 111.287 -165.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 10.6 t -126.07 122.93 37.21 Favored 'General case' 0 CA--C 1.556 1.199 0 C-N-CA 123.06 0.544 . . . . 74.31 110.065 173.388 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.423 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 37.8 m95 -91.12 146.05 24.17 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.567 0.747 . . . . 74.23 112.086 -177.795 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -152.31 73.93 1.06 Allowed 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 115.303 -0.862 . . . . 52.01 109.129 172.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 61.47 -93.41 0.08 OUTLIER Glycine 0 C--N 1.352 1.444 0 CA-C-N 114.443 -1.253 . . . . 71.05 114.656 173.425 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -69.23 -43.99 72.93 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.831 1.253 . . . . 75.52 111.251 -176.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 16.8 m -121.37 139.73 53.05 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.354 -0.839 . . . . 73.2 110.053 -171.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 6.7 p -107.04 126.67 63.09 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 N-CA-C 108.593 -0.891 . . . . 74.13 108.593 166.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 33.5 m -96.23 104.03 15.96 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 107.947 -1.131 . . . . 75.1 107.947 177.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.443 HG22 ' CZ ' ' A' ' 85' ' ' PHE . 58.9 t -105.38 110.6 31.61 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.516 0 N-CA-C 107.623 -1.251 . . . . 75.04 107.623 178.327 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . 0.417 ' HB3' ' HD3' ' A' ' 55' ' ' ARG . 46.3 mt-10 -109.96 110.03 20.83 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 107.728 -1.212 . . . . 73.34 107.728 173.433 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . 0.515 ' HA2' ' ND2' ' A' ' 94' ' ' ASN . . . -118.78 135.22 11.32 Favored Glycine 0 C--N 1.342 0.909 0 N-CA-C 111.437 -0.665 . . . . 71.52 111.437 -179.286 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 4.3 pm0 . . . . . 0 C--O 1.24 0.58 0 N-CA-C 108.047 -1.094 . . . . 73.5 108.047 172.167 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.611 0 N-CA-C 109.847 -0.427 . . . . 74.41 109.847 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.556 ' HZ1' ' HB3' ' A' ' 5' ' ' LYS . 5.8 ttpm? -86.71 113.1 22.28 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 108.931 -0.766 . . . . 72.21 108.931 173.398 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.487 HG21 HG21 ' A' ' 62' ' ' VAL . 1.6 p -100.35 138.09 25.75 Favored 'Isoleucine or valine' 0 C--O 1.241 0.636 0 N-CA-C 107.544 -1.28 . . . . 74.3 107.544 170.165 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.417 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 40.2 mt-10 -100.16 113.12 25.54 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 107.445 -1.317 . . . . 75.4 107.445 176.024 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.405 HG13 HG21 ' A' ' 60' ' ' ILE . 90.0 t -95.38 107.25 19.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 N-CA-C 108.033 -1.099 . . . . 74.12 108.033 -176.898 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -95.08 100.1 11.98 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 108.294 -1.002 . . . . 74.22 108.294 -175.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 64.1 t -95.09 107.98 20.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 N-CA-C 108.968 -0.753 . . . . 61.32 108.968 -177.28 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.0 ttmm -109.82 103.65 12.49 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 108.356 -0.979 . . . . 71.0 108.356 -179.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.485 HD12 HG13 ' A' ' 48' ' ' ILE . 15.0 tt -112.29 123.35 67.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 CA-C-O 121.22 0.534 . . . . 74.41 110.618 -176.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 17.4 m -100.16 103.3 14.77 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 108.726 -0.842 . . . . 75.42 108.726 -179.033 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 35.1 t -113.73 129.17 56.61 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.784 0.833 . . . . 74.34 110.004 -178.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 72.08 -72.64 0.11 Allowed 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 125.584 1.553 . . . . 61.14 110.934 176.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -163.93 16.54 0.11 Allowed Glycine 0 C--N 1.34 0.793 0 CA-C-O 119.924 -0.375 . . . . 74.43 112.21 176.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -127.92 156.05 43.24 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.741 0.816 . . . . 73.32 110.638 -179.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 62.2 m -104.23 121.72 43.88 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.166 0.986 . . . . 73.1 109.814 179.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 39.6 m-85 -116.11 105.28 12.43 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 108.084 -1.08 . . . . 74.42 108.084 178.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -135.76 154.61 51.18 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 112.291 0.478 . . . . 73.04 112.291 -173.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 75.4 ttt180 -161.52 140.81 10.06 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 114.942 -1.026 . . . . 75.14 109.65 177.116 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 88.4 m -90.86 114.52 26.97 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 123.818 0.847 . . . . 73.35 109.208 174.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -98.17 129.77 44.94 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.549 0.74 . . . . 74.53 109.871 -178.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -89.95 108.31 19.64 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 108.104 -1.073 . . . . 71.04 108.104 178.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 82.9 mt -122.96 100.95 7.15 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.326 0.65 . . . . 74.42 109.83 -173.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.485 ' HA ' ' HA ' ' A' ' 5' ' ' LYS . 80.0 t80 -84.18 131.95 34.71 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 109.637 -0.505 . . . . 75.22 109.637 172.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.533 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -132.63 149.89 52.24 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.399 0.68 . . . . 74.54 109.445 175.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 60.6 t -87.76 -36.66 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-O 122.035 0.921 . . . . 75.34 109.442 176.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.428 ' O ' ' HB1' ' A' ' 27' ' ' ALA . 84.0 mtt180 -121.31 155.93 33.65 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 107.217 -1.401 . . . . 72.23 107.217 170.121 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.427 ' HB3' ' HZ1' ' A' ' 76' ' ' LYS . 8.3 p-10 -56.51 -30.28 62.84 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.265 0.626 . . . . 74.54 110.602 166.561 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -65.3 -28.95 69.68 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.646 1.178 . . . . 65.43 112.086 176.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.533 ' HB2' ' HB1' ' A' ' 27' ' ' ALA . 19.9 mm-40 -67.98 -32.78 73.44 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 110.511 -0.181 . . . . 75.23 110.511 176.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.706 HD23 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -71.34 -16.81 62.45 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.585 0.754 . . . . 75.24 111.334 -177.08 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -53.51 -64.89 0.68 Allowed 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.554 0.741 . . . . 65.32 111.949 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -59.67 -30.16 68.56 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 124.218 0.949 . . . . 72.11 112.383 -178.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.706 ' HD2' HD23 ' A' ' 33' ' ' LEU . 50.4 mttm -66.1 -47.09 75.35 Favored 'General case' 0 C--N 1.355 0.814 0 C-N-CA 123.099 0.56 . . . . 75.23 110.06 178.31 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.574 HD12 HD23 ' A' ' 81' ' ' LEU . 85.1 mt -59.54 -43.74 93.43 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 124.128 0.893 . . . . 72.45 110.993 177.456 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.575 ' HA ' HD12 ' A' ' 88' ' ' LEU . 54.3 mtpt -58.3 -50.95 71.8 Favored 'General case' 0 C--N 1.358 0.939 0 O-C-N 123.999 0.812 . . . . 73.31 111.1 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -66.18 -47.0 75.38 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 123.537 0.523 . . . . 71.21 111.328 -178.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 40.3 t -54.68 -43.73 67.18 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 C-N-CA 123.73 0.812 . . . . 64.4 111.542 179.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.613 HD22 HD12 ' A' ' 60' ' ' ILE . 46.7 mt -66.15 -48.51 70.54 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.206 0.603 . . . . 73.43 111.246 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -58.61 -49.21 78.3 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.229 0.611 . . . . 74.25 111.439 179.389 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -66.8 -40.02 87.94 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.407 1.083 . . . . 71.31 111.565 -176.203 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -66.09 -41.14 91.05 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 123.452 0.47 . . . . 75.41 110.714 176.325 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.473 ' SD ' ' OH ' ' A' ' 90' ' ' TYR . 48.1 mtp -92.49 -7.98 45.88 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 113.905 1.076 . . . . 71.15 113.905 -172.072 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -67.24 -44.8 49.34 Favored Pre-proline 0 CA--C 1.564 1.494 0 CA-C-O 118.995 -0.526 . . . . 73.24 111.581 -179.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -71.2 -22.93 25.07 Favored 'Trans proline' 0 C--N 1.386 2.536 0 C-N-CA 121.692 1.595 . . . . 73.4 113.139 169.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.485 HG13 HD12 ' A' ' 12' ' ' ILE . 43.5 mm -66.64 -32.67 59.09 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 C-N-CA 123.494 0.717 . . . . 74.23 110.487 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.425 ' HG3' ' O ' ' A' ' 45' ' ' MET . 90.2 mttt -55.97 -50.45 70.76 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-O 121.512 0.672 . . . . 73.04 109.268 172.882 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -65.55 -29.34 69.94 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 114.044 -1.434 . . . . 74.42 111.48 -177.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.473 HD13 HD13 ' A' ' 48' ' ' ILE . 87.8 mt -71.76 -29.5 64.57 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 122.588 0.355 . . . . 72.24 110.759 175.605 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 72.13 84.25 0.23 Allowed Glycine 0 C--N 1.35 1.336 0 O-C-N 123.763 0.664 . . . . 72.41 113.082 170.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 1.2 p -131.64 134.08 45.6 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.322 0.649 . . . . 75.24 111.234 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -72.3 -37.07 69.07 Favored 'General case' 0 C--N 1.356 0.869 0 C-N-CA 124.302 1.041 . . . . 72.11 110.586 -178.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 41.8 ttm180 -127.42 131.96 50.17 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 109.627 -0.509 . . . . 74.41 109.627 175.642 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 31.5 m -120.37 137.66 53.44 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 124.961 1.304 . . . . 73.54 108.385 171.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.431 ' O ' ' HA ' ' A' ' 12' ' ' ILE . 24.9 ttm180 -108.26 106.61 16.85 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 108.304 -0.999 . . . . 75.35 108.304 173.191 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 30.9 mt -96.72 105.38 17.03 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 N-CA-C 108.187 -1.042 . . . . 73.03 108.187 178.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 27.7 t -105.13 103.21 12.71 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 107.844 -1.169 . . . . 75.1 107.844 -179.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.613 HD12 HD22 ' A' ' 41' ' ' LEU . 66.6 mt -101.2 121.67 52.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 123.625 0.77 . . . . 75.55 109.829 -176.809 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -102.14 134.72 44.93 Favored 'General case' 0 C--O 1.241 0.611 0 N-CA-C 109.35 -0.611 . . . . 75.05 109.35 175.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.487 HG21 HG21 ' A' ' 6' ' ' VAL . 7.3 p -95.93 116.44 37.72 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.047 0 N-CA-C 106.975 -1.491 . . . . 74.32 106.975 173.147 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.417 ' HB3' ' H ' ' A' ' 7' ' ' GLU . 24.2 tptm -90.57 110.36 21.5 Favored 'General case' 0 C--O 1.239 0.529 0 O-C-N 121.366 -0.834 . . . . 75.22 108.903 -176.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 18.7 p80 -110.56 111.5 22.77 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.356 1.063 . . . . 73.24 108.558 178.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 27.7 t -70.9 -30.72 67.16 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 122.979 0.512 . . . . 70.14 110.425 177.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -85.64 155.44 21.12 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.009 0.924 . . . . 70.14 110.276 177.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.05 -8.65 11.19 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.143 0.977 . . . . 61.42 112.375 -176.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -86.22 -68.67 0.72 Allowed 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.068 0.547 . . . . 71.31 111.652 -175.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -76.1 -17.63 59.52 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.385 1.074 . . . . 75.21 112.685 -174.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -58.12 -26.07 62.18 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 114.14 1.163 . . . . 72.53 114.14 -170.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.5 pttp -66.56 -38.42 87.05 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 123.409 0.684 . . . . 74.51 110.943 174.246 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -70.5 -44.8 66.89 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.794 0.838 . . . . 71.1 109.322 173.031 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.495 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 24.3 mm-40 -68.52 -17.89 64.26 Favored 'General case' 0 C--N 1.353 0.746 0 O-C-N 124.389 1.055 . . . . 71.12 111.97 -176.018 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.14 -54.77 18.15 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 122.766 0.426 . . . . 65.23 110.538 174.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 50.3 mtpt -63.77 -41.14 98.03 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 124.265 0.978 . . . . 74.32 111.178 177.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.495 ' HB3' ' HA ' ' A' ' 73' ' ' GLU . 50.2 tttm -65.93 -42.16 90.43 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.257 1.423 . . . . 74.12 111.232 -178.03 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -79.1 -21.85 46.06 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.485 0.714 . . . . 74.51 110.815 176.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.2 -42.73 99.37 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 122.664 0.386 . . . . 74.24 110.418 176.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.64 -35.39 77.79 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.359 0.664 . . . . 65.3 111.259 176.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 49.3 mm -64.57 -46.31 92.95 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.801 0 C-N-CA 124.212 1.005 . . . . 75.11 110.297 174.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.574 HD23 HD12 ' A' ' 37' ' ' LEU . 48.1 mt -64.67 -48.1 76.0 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.683 0.793 . . . . 74.1 111.52 -178.872 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 61.9 m-80 -62.35 -34.14 76.08 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 123.669 0.606 . . . . 72.43 111.446 -173.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.8 mmmm -72.64 -37.28 68.05 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 123.261 0.351 . . . . 75.24 111.785 176.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.478 HG12 ' HG2' ' A' ' 38' ' ' LYS . 40.4 t -66.61 -52.54 44.69 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.121 0 C-N-CA 123.474 0.71 . . . . 73.31 110.168 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.558 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 29.9 m-85 -56.25 -42.98 78.25 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 124.36 1.038 . . . . 74.32 111.229 176.746 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -59.87 -34.0 72.56 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.788 0.835 . . . . 73.22 112.4 179.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -86.37 -15.44 40.44 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.353 0.661 . . . . 73.15 112.429 -176.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.575 HD12 ' HA ' ' A' ' 38' ' ' LYS . 78.2 mt -106.57 -9.51 16.56 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 112.474 0.546 . . . . 72.43 112.474 -171.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 118.51 14.4 6.36 Favored Glycine 0 N--CA 1.478 1.44 0 N-CA-C 113.918 0.327 . . . . 62.31 113.918 174.388 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.558 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 12.6 m-85 -109.2 150.08 28.43 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 108.745 -0.835 . . . . 74.21 108.745 174.651 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -86.12 166.89 15.43 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 109.697 -0.483 . . . . 75.25 109.697 171.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -88.48 32.38 0.78 Allowed 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 121.541 0.686 . . . . 53.22 110.062 174.359 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 79.2 p -110.46 -28.36 8.57 Favored 'General case' 0 C--N 1.343 0.325 0 C-N-CA 125.065 1.346 . . . . 71.01 108.112 176.018 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -76.97 -9.54 58.76 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.122 -0.944 . . . . 73.51 110.957 178.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 23.3 t -89.34 99.26 9.05 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.796 0 N-CA-C 108.751 -0.833 . . . . 74.21 108.751 -175.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 59.5 m -126.22 106.14 9.33 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.609 0.763 . . . . 74.22 109.636 -176.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 56.1 m95 -77.04 111.88 13.08 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.318 0.647 . . . . 74.32 110.461 177.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -108.44 95.17 5.48 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 105.437 -2.06 . . . . 73.12 105.437 170.053 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 64.95 -121.87 22.76 Favored Glycine 0 C--N 1.345 1.035 0 O-C-N 123.741 0.65 . . . . 61.24 112.106 -172.3 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -90.89 0.33 57.52 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.763 0.825 . . . . 64.14 111.444 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 63.5 m -119.48 118.95 32.46 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.543 0.737 . . . . 45.2 110.362 -169.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . 0.491 HG12 HD12 ' A' ' 81' ' ' LEU . 7.2 p -91.9 128.02 43.82 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.184 0 N-CA-C 109.052 -0.722 . . . . 64.04 109.052 173.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 40.5 m -105.08 112.24 25.29 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.567 0.747 . . . . 73.33 109.129 178.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 78.7 t -114.91 113.01 42.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 125.262 1.425 . . . . 75.34 108.112 179.54 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.4 145.65 46.98 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 109.217 -0.66 . . . . 75.5 109.217 -179.614 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 161.77 -147.91 14.78 Favored Glycine 0 C--N 1.332 0.35 0 N-CA-C 110.917 -0.873 . . . . 55.3 110.917 -173.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 5.0 pm0 . . . . . 0 N--CA 1.471 0.584 0 CA-C-N 117.226 0.513 . . . . 72.21 110.103 177.76 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 63.4 mttm . . . . . 0 N--CA 1.469 0.522 0 CA-C-O 120.953 0.406 . . . . 74.03 111.397 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.423 ' HE3' ' HB3' ' A' ' 5' ' ' LYS . 1.0 OUTLIER -101.13 105.25 16.38 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 106.635 -1.617 . . . . 75.1 106.635 169.664 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.3 p -98.79 144.77 11.22 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 N-CA-C 109.083 -0.71 . . . . 72.54 109.083 176.341 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.403 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 41.0 mt-10 -100.46 110.6 22.79 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 107.49 -1.3 . . . . 73.52 107.49 170.03 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.453 HG21 HD12 ' A' ' 25' ' ' LEU . 77.2 t -99.54 106.68 19.41 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 125.072 1.349 . . . . 74.31 108.282 -179.372 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.446 ' NE2' ' HB3' ' A' ' 61' ' ' ARG . 39.6 mt-30 -98.73 100.28 11.48 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 107.824 -1.176 . . . . 72.32 107.824 -176.404 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.439 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 95.8 t -93.69 103.08 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 N-CA-C 108.605 -0.887 . . . . 75.21 108.605 -176.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.409 ' HA ' ' HB3' ' A' ' 20' ' ' GLU . 22.5 ttmm -109.61 102.85 11.65 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 108.021 -1.103 . . . . 74.11 108.021 -178.111 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.519 HD11 HG13 ' A' ' 48' ' ' ILE . 13.7 tt -112.82 141.83 27.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 109.46 -0.57 . . . . 73.13 109.46 -179.332 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 45.0 m -121.22 133.05 55.15 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.591 0.756 . . . . 75.24 110.031 -178.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.522 ' SG ' ' ND2' ' A' ' 15' ' ' ASN . 19.6 t -160.31 133.88 6.95 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.599 1.16 . . . . 75.03 110.015 176.952 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.522 ' ND2' ' SG ' ' A' ' 14' ' ' CYS . 63.6 m-80 63.92 23.45 13.34 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 124.705 1.202 . . . . 75.33 112.17 -178.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 74.72 16.21 80.37 Favored Glycine 0 C--N 1.35 1.333 0 CA-C-N 116.307 -0.406 . . . . 70.42 113.013 -174.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.3 mmpt? -118.71 122.26 42.06 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.977 0.911 . . . . 75.23 109.859 178.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 89.9 m -98.46 121.5 40.47 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 123.15 0.58 . . . . 75.24 110.122 178.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.1 m-85 -106.17 111.11 23.59 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 107.364 -1.347 . . . . 63.14 107.364 176.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.439 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 0.8 OUTLIER -140.51 155.47 46.63 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 112.393 0.516 . . . . 61.03 112.393 -173.575 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 40.8 ttm180 -168.32 145.06 3.93 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.003 0.921 . . . . 74.2 109.549 175.108 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 53.5 m -85.47 112.29 20.76 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.669 0.787 . . . . 72.01 109.05 172.047 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -98.88 138.85 35.41 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.761 0.824 . . . . 72.54 109.111 178.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 26.2 mp0 -104.89 109.43 21.4 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 107.616 -1.253 . . . . 75.13 107.616 -178.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.453 HD12 HG21 ' A' ' 8' ' ' VAL . 81.6 mt -117.02 102.6 9.47 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.865 0.866 . . . . 74.51 109.322 -175.266 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.419 ' O ' ' HE3' ' A' ' 36' ' ' LYS . 72.5 t80 -94.67 126.27 39.86 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.308 0.643 . . . . 73.31 109.612 176.741 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.476 ' HB3' ' HB2' ' A' ' 32' ' ' GLU . . . -139.95 153.21 46.85 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.808 0.843 . . . . 72.4 109.5 175.171 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 47.2 t -74.86 -58.68 4.26 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 N-CA-C 108.664 -0.865 . . . . 73.53 108.664 174.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.486 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 79.2 mtt180 -101.42 168.21 9.66 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 115.571 -0.74 . . . . 65.33 111.223 -178.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.8 -46.15 76.11 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.448 1.499 . . . . 75.11 110.038 -178.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -60.22 -30.15 69.2 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 113.774 -1.557 . . . . 75.3 111.766 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.486 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 37.4 mm-40 -71.34 -24.58 62.13 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.49 0.716 . . . . 75.35 111.645 -178.738 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.68 -28.31 61.68 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 122.917 0.487 . . . . 74.24 110.034 178.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.433 ' HE2' ' HB3' ' A' ' 34' ' ' LYS . 39.5 mtpt -52.59 -56.85 12.43 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 123.351 0.66 . . . . 74.42 112.477 -176.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.455 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 2.8 pp20? -59.65 -32.62 70.63 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 123.993 0.808 . . . . 73.33 112.153 -175.511 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.419 ' HE3' ' O ' ' A' ' 26' ' ' TYR . 55.3 mttm -67.85 -46.49 71.62 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.296 0.639 . . . . 74.04 110.206 177.825 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 72.5 mt -58.38 -42.42 87.0 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.168 0.987 . . . . 73.51 110.844 177.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.581 ' HZ2' ' HB3' ' A' ' 38' ' ' LYS . 8.5 mtpm? -62.41 -40.98 98.29 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.095 0.958 . . . . 74.22 111.266 178.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.455 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 74.3 mmtt -63.46 -51.68 64.65 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 123.434 0.459 . . . . 73.34 110.837 175.707 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 92.3 t -60.36 -37.95 76.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 124.171 0.988 . . . . 74.51 111.629 -177.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.43 HD21 HD11 ' A' ' 60' ' ' ILE . 65.2 mt -68.46 -51.15 46.75 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 122.901 0.48 . . . . 74.31 110.257 178.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -61.76 -30.51 70.83 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.169 0.588 . . . . 74.34 111.725 178.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -67.56 -53.13 30.98 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.243 0.617 . . . . 72.43 110.721 175.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.412 ' NE ' ' HA ' ' A' ' 44' ' ' ARG . 0.0 OUTLIER -74.97 -26.92 59.93 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 123.324 0.39 . . . . 73.33 111.763 -173.073 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.568 ' HB3' ' HE3' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -82.04 -27.92 32.75 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.594 0.758 . . . . 74.0 112.014 -179.405 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -56.99 -52.48 73.77 Favored Pre-proline 0 CA--C 1.562 1.438 0 N-CA-C 113.025 0.75 . . . . 73.32 113.025 -173.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.412 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 41.9 Cg_endo -64.24 -30.99 64.31 Favored 'Trans proline' 0 C--N 1.385 2.453 0 C-N-CA 121.775 1.65 . . . . 74.0 111.793 176.191 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.519 HG13 HD11 ' A' ' 12' ' ' ILE . 44.8 mm -74.9 -33.34 29.77 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.046 0 C-N-CA 123.999 0.919 . . . . 75.22 111.003 -174.408 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.568 ' HE3' ' HB3' ' A' ' 45' ' ' MET . 98.9 mttt -70.17 -34.36 72.89 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.39 0.676 . . . . 73.51 109.743 175.429 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -72.87 -29.22 63.01 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.884 0.874 . . . . 73.34 110.901 175.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 73.6 mt -71.81 -29.74 64.76 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 109.317 -0.623 . . . . 74.43 109.317 173.642 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 71.52 54.11 9.14 Favored Glycine 0 C--N 1.351 1.4 0 O-C-N 123.791 0.682 . . . . 74.32 111.982 176.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.482 ' SG ' HG22 ' A' ' 48' ' ' ILE . 12.7 m -73.35 122.0 21.34 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 122.98 0.512 . . . . 74.31 110.391 -179.321 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -67.4 -25.1 65.78 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.763 0.825 . . . . 75.13 110.807 177.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 16.8 tpp180 -140.38 129.15 23.11 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.132 0.973 . . . . 72.14 108.931 175.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 19.7 m -118.22 143.53 28.78 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 123.298 0.639 . . . . 74.54 109.601 170.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.489 ' HG3' ' HG2' ' A' ' 105' ' ' GLU . 52.0 ttt-85 -131.52 106.43 8.21 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 108.814 -0.81 . . . . 74.33 108.814 172.381 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.42 ' HB ' ' HB ' ' A' ' 104' ' ' VAL . 39.3 mt -99.6 129.42 50.18 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 C-N-CA 124.922 1.289 . . . . 74.0 107.539 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.2 m -120.68 103.3 9.02 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 107.464 -1.309 . . . . 70.32 107.464 179.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.43 HD11 HD21 ' A' ' 41' ' ' LEU . 73.2 mt -98.77 104.95 16.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 N-CA-C 108.884 -0.784 . . . . 72.33 108.884 -177.409 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.446 ' HB3' ' NE2' ' A' ' 9' ' ' GLN . 0.0 OUTLIER -96.23 109.99 22.36 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 108.4 -0.963 . . . . 73.11 108.4 -176.339 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 21.9 t -95.03 127.0 47.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 C-N-CA 124.468 1.107 . . . . 63.1 110.089 -174.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.403 ' HB3' ' H ' ' A' ' 7' ' ' GLU . 3.9 tppp? -87.6 102.52 14.69 Favored 'General case' 0 C--O 1.24 0.565 0 N-CA-C 108.717 -0.845 . . . . 72.43 108.717 177.627 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 36.7 m80 -71.61 140.92 49.96 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 123.402 0.439 . . . . 75.31 110.114 178.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 17.2 m -62.39 -46.57 88.01 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.698 1.199 . . . . 74.52 112.532 -166.339 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -141.71 153.24 44.51 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 122.723 0.409 . . . . 74.21 110.992 -172.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -74.57 -15.44 60.84 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 124.196 0.999 . . . . 74.44 112.803 -175.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -86.14 -44.93 11.82 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 122.763 0.425 . . . . 64.32 109.887 171.43 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -66.28 -35.14 79.63 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-N 115.575 -0.738 . . . . 75.22 112.551 -177.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -43.59 -38.43 2.99 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 115.038 1.496 . . . . 64.02 115.038 -167.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -67.11 -41.97 85.31 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.412 0.685 . . . . 74.3 111.039 -177.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 18.2 tppt? -77.53 -35.74 53.04 Favored 'General case' 0 C--O 1.241 0.642 0 C-N-CA 123.72 0.808 . . . . 75.35 109.837 174.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.661 ' HG3' ' HD2' ' A' ' 76' ' ' LYS . 34.9 tt0 -74.29 -15.19 60.97 Favored 'General case' 0 C--N 1.351 0.673 0 CA-C-N 115.533 -0.758 . . . . 73.33 111.345 -175.124 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.77 -62.2 1.64 Allowed 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 108.685 -0.857 . . . . 65.24 108.685 171.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 57.8 tttm -65.1 -24.56 67.47 Favored 'General case' 0 N--CA 1.481 1.1 0 O-C-N 123.514 0.508 . . . . 75.4 111.715 -179.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.661 ' HD2' ' HG3' ' A' ' 73' ' ' GLU . 3.4 ttmp? -59.54 -60.45 3.83 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.93 0.892 . . . . 73.34 110.685 172.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -77.31 -21.73 53.05 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 115.549 -0.75 . . . . 73.04 109.961 -174.565 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.416 ' HA ' ' CE2' ' A' ' 97' ' ' TRP . . . -64.11 -43.47 95.24 Favored 'General case' 0 C--N 1.345 0.406 0 C-N-CA 123.488 0.715 . . . . 64.35 110.142 172.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.88 -48.26 79.75 Favored 'General case' 0 C--N 1.349 0.561 0 O-C-N 124.142 0.901 . . . . 54.03 110.752 175.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.4 ' O ' HG21 ' A' ' 84' ' ' VAL . 38.1 mm -62.54 -50.59 79.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 O-C-N 123.944 0.778 . . . . 71.43 111.41 -175.204 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 10.7 mt -67.03 -39.11 86.92 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-O 119.253 -0.403 . . . . 74.11 111.035 -179.312 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -61.09 -36.87 80.81 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 122.967 0.507 . . . . 73.01 110.65 -179.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.485 ' O ' ' HG2' ' A' ' 87' ' ' GLU . 33.2 mmtp -71.31 -37.33 71.81 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 115.482 -0.781 . . . . 72.15 111.04 175.907 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.4 HG21 ' O ' ' A' ' 80' ' ' ILE . 53.8 t -64.64 -38.57 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 123.539 0.736 . . . . 74.12 110.402 178.576 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.546 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 22.0 m-85 -64.34 -36.02 82.78 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 114.955 -1.021 . . . . 73.42 110.431 174.907 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -73.77 -23.5 59.72 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 123.683 0.793 . . . . 75.32 111.652 175.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.485 ' HG2' ' O ' ' A' ' 83' ' ' LYS . 37.6 mm-40 -74.71 -29.72 61.29 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.024 0.53 . . . . 73.23 111.718 176.35 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 82.1 mt -108.35 -18.87 13.64 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.174 0.59 . . . . 74.23 111.781 -168.44 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 107.18 11.44 25.81 Favored Glycine 0 C--N 1.347 1.174 0 N-CA-C 114.6 0.6 . . . . 62.34 114.6 174.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.546 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 87.7 m-85 -72.1 120.21 17.39 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 108.807 -0.812 . . . . 74.43 108.807 171.682 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -77.6 165.07 24.75 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.671 0.788 . . . . 70.22 110.329 -173.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -53.06 -44.42 67.46 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.771 0.828 . . . . 72.41 111.701 173.023 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 34.5 t -66.56 -8.51 27.4 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.231 1.012 . . . . 72.13 112.215 179.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . 0.433 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 12.8 m120 -104.26 -11.03 17.44 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.409 0.684 . . . . 73.41 111.176 178.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 57.6 t -109.87 113.46 44.28 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 C-N-CA 123.483 0.713 . . . . 74.11 109.925 -175.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 7.9 m -123.13 97.58 5.49 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.303 0.641 . . . . 73.41 110.159 175.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.416 ' CE2' ' HA ' ' A' ' 78' ' ' ALA . 5.1 m95 -74.17 150.08 40.59 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 122.892 0.477 . . . . 75.22 110.967 178.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -159.4 81.76 0.75 Allowed 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.361 0.664 . . . . 73.22 110.29 -178.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 70.08 -101.06 0.83 Allowed Glycine 0 CA--C 1.533 1.194 0 CA-C-N 115.237 -0.892 . . . . 72.25 113.581 174.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -90.77 -20.97 21.78 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.678 0.791 . . . . 62.5 111.093 177.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 17.0 m -114.64 128.81 56.52 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.198 0.599 . . . . 73.02 110.74 -169.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . 0.423 HG12 ' HB ' ' A' ' 60' ' ' ILE . 10.3 p -99.91 130.87 48.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 N-CA-C 108.048 -1.093 . . . . 73.4 108.048 166.476 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 15.1 m -108.1 102.54 11.69 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.495 -0.928 . . . . 73.51 108.495 179.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.433 ' HA ' ' O ' ' A' ' 94' ' ' ASN . 41.0 t -92.91 109.01 21.06 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 N-CA-C 108.008 -1.108 . . . . 71.44 108.008 -179.184 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . 0.489 ' HG2' ' HG3' ' A' ' 57' ' ' ARG . 42.1 mt-10 -121.55 112.43 18.47 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 107.21 -1.404 . . . . 72.42 107.21 -176.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -164.75 -167.23 24.99 Favored Glycine 0 C--O 1.246 0.88 0 C-N-CA 120.93 -0.652 . . . . 72.34 113.254 -173.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 27.4 pt20 . . . . . 0 C--O 1.24 0.575 0 C-N-CA 124.499 1.12 . . . . 74.34 109.833 -178.545 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.528 ' HA ' ' HE2' ' A' ' 4' ' ' LYS . 8.1 mmpt? . . . . . 0 N--CA 1.474 0.758 0 CA-C-O 121.111 0.481 . . . . 74.31 111.503 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -88.35 98.43 11.6 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 108.163 -1.051 . . . . 74.51 108.163 178.075 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.425 ' CG2' HG21 ' A' ' 62' ' ' VAL . 0.2 OUTLIER -98.42 137.4 26.04 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 CA-C-N 114.104 -1.407 . . . . 74.44 107.516 177.69 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -107.29 114.06 27.85 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 108.412 -0.958 . . . . 75.52 108.412 176.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.428 HG13 HG21 ' A' ' 60' ' ' ILE . 93.5 t -98.98 107.73 21.04 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 C-N-CA 125.628 1.571 . . . . 70.32 108.987 -171.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.534 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 63.6 mt-30 -95.27 100.89 12.61 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 108.277 -1.008 . . . . 75.31 108.277 -174.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.526 HG12 HG23 ' A' ' 58' ' ' ILE . 88.4 t -93.02 104.66 15.95 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 C-N-CA 123.579 0.751 . . . . 72.41 109.382 -175.373 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.4 ttmm -102.91 102.27 12.34 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 107.714 -1.217 . . . . 74.32 107.714 178.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.487 ' HA ' ' O ' ' A' ' 57' ' ' ARG . 12.4 tt -115.9 118.5 58.99 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 CA-C-O 121.157 0.503 . . . . 74.35 110.889 -174.606 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 19.8 m -97.09 102.97 14.86 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 108.879 -0.785 . . . . 75.45 108.879 178.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.589 ' SG ' HG22 ' A' ' 48' ' ' ILE . 42.2 t -120.0 125.75 49.13 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.876 1.27 . . . . 75.31 109.46 178.81 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.512 ' ND2' ' HB3' ' A' ' 51' ' ' LEU . 88.1 m-20 61.43 25.56 15.48 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 125.051 1.341 . . . . 71.41 112.115 -177.008 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.98 10.96 85.7 Favored Glycine 0 C--N 1.348 1.195 0 CA-C-N 115.718 -0.674 . . . . 72.45 113.467 -177.777 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -108.23 133.33 52.61 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.245 1.018 . . . . 71.34 108.982 176.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 49.6 m -106.24 118.03 35.58 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.072 0.549 . . . . 64.32 110.032 -173.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -111.56 101.96 10.33 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 107.243 -1.391 . . . . 75.25 107.243 179.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.424 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 14.1 pt-20 -116.95 134.51 54.66 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 122.038 -0.414 . . . . 74.32 110.46 179.249 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.8 ttt180 -155.35 141.05 18.02 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.657 -0.701 . . . . 74.13 110.075 -178.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 42.9 m -92.28 118.55 31.0 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 124.555 1.142 . . . . 63.01 110.151 178.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 89.6 m-85 -103.91 131.98 50.61 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.937 0.895 . . . . 64.43 110.332 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -91.49 110.13 21.44 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 108.814 -0.81 . . . . 71.14 108.814 -179.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 80.6 mt -118.98 112.89 20.16 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.674 0.79 . . . . 72.11 109.843 -179.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 88.0 t80 -110.2 138.79 46.1 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.619 0.767 . . . . 74.12 109.133 172.248 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.51 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -135.96 172.08 13.53 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.726 0.81 . . . . 74.35 110.075 177.644 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 24.0 t -98.01 -44.14 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 N-CA-C 108.749 -0.834 . . . . 74.34 108.749 168.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.574 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 92.9 mtt180 -116.71 158.3 24.05 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 115.464 -0.789 . . . . 73.1 110.501 178.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.415 ' HB2' HD11 ' A' ' 80' ' ' ILE . 15.9 p-10 -68.6 -29.14 67.59 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.909 0.883 . . . . 62.41 110.772 178.357 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.529 ' HA ' ' HD3' ' A' ' 34' ' ' LYS . 60.5 mm-40 -60.37 -40.87 92.35 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.488 0.715 . . . . 75.12 110.925 170.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.574 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 34.6 mm-40 -65.81 -28.16 68.79 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 116.082 -0.508 . . . . 75.11 110.601 178.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.43 -33.16 60.89 Favored 'General case' 0 CA--C 1.56 1.341 0 C-N-CA 122.917 0.487 . . . . 75.42 110.272 -179.108 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.529 ' HD3' ' HA ' ' A' ' 31' ' ' GLU . 53.3 mtpt -54.08 -55.47 27.18 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.924 0.89 . . . . 64.43 111.867 179.614 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.499 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 11.6 pt-20 -60.85 -35.98 77.98 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 115.293 -0.867 . . . . 73.3 111.384 -179.418 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 64.7 mttm -66.64 -41.05 88.91 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.259 0.624 . . . . 75.24 111.127 -178.314 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.537 HD11 HD22 ' A' ' 81' ' ' LEU . 94.3 mt -62.81 -40.93 98.91 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 123.746 0.654 . . . . 63.03 110.767 174.55 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -62.12 -41.71 98.5 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 122.765 0.426 . . . . 71.42 111.02 175.304 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.499 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 72.8 mmtt -63.94 -55.45 22.46 Favored 'General case' 0 N--CA 1.478 0.961 0 O-C-N 123.415 0.447 . . . . 75.3 110.275 178.607 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 51.7 t -54.56 -46.66 72.12 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.391 0 C-N-CA 124.541 1.136 . . . . 65.43 111.524 -178.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.418 ' O ' ' HG2' ' A' ' 45' ' ' MET . 67.1 mt -68.34 -41.0 81.36 Favored 'General case' 0 C--O 1.207 -1.14 0 CA-C-O 118.751 -0.643 . . . . 74.35 110.926 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -61.91 -43.02 99.7 Favored 'General case' 0 N--CA 1.492 1.662 0 CA-C-N 118.531 0.605 . . . . 65.1 111.857 176.171 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 21.6 mm-40 -61.32 -46.32 90.75 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 109.526 -0.546 . . . . 73.43 109.526 177.586 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -67.66 -41.1 84.3 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 114.989 -1.005 . . . . 74.14 111.481 -176.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.589 ' SD ' HD12 ' A' ' 58' ' ' ILE . 92.1 mmm -79.02 -21.36 47.07 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.025 0.53 . . . . 75.14 111.183 -175.715 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.498 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 13.9 t70 -57.67 -52.4 74.65 Favored Pre-proline 0 CA--C 1.565 1.556 0 N-CA-C 112.929 0.715 . . . . 73.41 112.929 -171.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.423 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 73.3 Cg_endo -71.75 -22.97 23.16 Favored 'Trans proline' 0 C--N 1.39 2.712 0 C-N-CA 121.805 1.67 . . . . 72.34 112.204 175.089 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.589 HG22 ' SG ' ' A' ' 14' ' ' CYS . 46.9 mm -74.21 -31.67 29.87 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 C-N-CA 124.58 1.152 . . . . 74.21 110.784 -175.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.498 ' HE2' ' HA ' ' A' ' 46' ' ' ASP . 49.2 mtmt -73.77 -34.58 64.75 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.216 0.606 . . . . 75.13 110.021 175.003 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -65.83 -27.21 68.08 Favored 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 124.343 1.057 . . . . 64.22 109.575 174.024 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.512 ' HB3' ' ND2' ' A' ' 15' ' ' ASN . 83.7 mt -75.27 -39.5 59.69 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 109.617 -0.512 . . . . 74.1 109.617 173.183 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 77.63 36.49 33.23 Favored Glycine 0 C--N 1.346 1.135 0 CA-C-N 115.237 -0.892 . . . . 65.12 114.076 174.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 2.0 p -71.65 119.69 16.17 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 109.55 -0.537 . . . . 75.45 109.55 171.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.9 mptt -70.36 -25.02 63.08 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 124.105 0.962 . . . . 75.03 110.804 -170.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 33.0 ttp-105 -129.07 125.74 37.9 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.173 0.989 . . . . 74.21 108.354 178.148 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 15.3 m -122.17 137.08 56.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 123.419 0.687 . . . . 75.54 109.44 177.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.487 ' O ' ' HA ' ' A' ' 12' ' ' ILE . 18.3 ttm180 -111.19 104.1 12.58 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 108.532 -0.914 . . . . 74.12 108.532 172.98 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.589 HD12 ' SD ' ' A' ' 45' ' ' MET . 59.4 mt -98.45 105.2 16.96 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 N-CA-C 108.029 -1.1 . . . . 73.15 108.029 174.259 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 27.1 m -101.85 104.34 15.07 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 107.713 -1.217 . . . . 61.22 107.713 179.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.428 HG21 HG13 ' A' ' 8' ' ' VAL . 50.7 mt -95.14 116.03 35.53 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 C-N-CA 123.641 0.776 . . . . 72.34 109.369 -177.13 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.534 ' HB2' ' HB2' ' A' ' 9' ' ' GLN . 33.1 mtm180 -100.87 113.94 27.34 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 107.395 -1.335 . . . . 74.42 107.395 174.941 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.425 HG21 ' CG2' ' A' ' 6' ' ' VAL . 3.2 p -92.43 126.92 44.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 N-CA-C 108.129 -1.063 . . . . 75.44 108.129 -178.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.8 ttpp -81.94 109.36 16.22 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 109.021 -0.733 . . . . 75.21 109.021 -177.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . 0.481 ' ND1' ' HB2' ' A' ' 70' ' ' GLU . 31.6 m170 -86.0 108.52 18.26 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 124.073 0.949 . . . . 74.24 109.055 -178.629 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 13.4 m -74.98 -25.87 59.16 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.181 0.992 . . . . 71.11 112.798 -169.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -146.15 128.01 15.39 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.041 0.536 . . . . 70.3 109.695 -175.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.29 -27.51 68.67 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 113.813 1.042 . . . . 65.35 113.813 -172.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -84.86 -36.58 21.46 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 122.658 0.383 . . . . 74.34 110.822 -179.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -77.51 -28.08 51.97 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 116.093 -0.503 . . . . 63.23 112.061 -178.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.6 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 0.1 OUTLIER -70.27 -13.11 62.02 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 113.865 1.061 . . . . 72.51 113.865 -169.301 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 49.0 mtmt -67.68 -51.75 46.01 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-O 121.735 0.779 . . . . 75.23 109.162 171.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -74.9 -31.36 61.54 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.414 1.486 . . . . 75.2 110.857 -179.011 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.6 ' HB3' ' HA ' ' A' ' 70' ' ' GLU . 0.1 OUTLIER -73.65 -49.23 27.01 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.77 0.828 . . . . 73.21 110.435 -177.678 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.61 -34.24 77.8 Favored 'General case' 0 N--CA 1.483 1.223 0 O-C-N 123.591 0.557 . . . . 73.11 111.571 177.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 54.8 tptt -58.79 -50.9 72.21 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 124.37 1.044 . . . . 74.35 109.346 174.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.491 ' O ' HG12 ' A' ' 80' ' ' ILE . 39.3 ttmt -68.28 -39.68 82.05 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 114.377 -1.283 . . . . 71.24 110.838 -178.68 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -75.02 -22.39 58.51 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.314 1.045 . . . . 74.43 110.071 -171.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -67.13 -43.3 82.73 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.483 0.713 . . . . 63.24 110.616 172.423 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.15 -37.35 85.46 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 115.667 -0.697 . . . . 74.33 110.763 175.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.491 HG12 ' O ' ' A' ' 76' ' ' LYS . 43.4 mm -62.7 -47.86 90.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 123.893 0.877 . . . . 75.23 110.188 177.481 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.537 HD22 HD11 ' A' ' 37' ' ' LEU . 39.8 mt -67.71 -33.78 75.58 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.692 0.797 . . . . 74.01 111.618 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -60.88 -40.84 94.51 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.01 0.524 . . . . 74.42 110.155 -178.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 49.0 mmtm -64.95 -45.02 87.48 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.672 -0.694 . . . . 73.14 110.957 176.229 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.494 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 77.4 t -64.81 -59.75 3.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 C-N-CA 123.342 0.657 . . . . 74.44 110.302 -172.459 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.523 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 30.4 m-85 -57.79 -42.67 84.64 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.116 0.967 . . . . 73.03 112.342 -177.506 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.02 -34.61 77.94 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.21 0.604 . . . . 72.11 111.323 179.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -89.1 1.14 56.04 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.05 0.94 . . . . 70.14 111.672 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 37.8 mt -106.11 -26.08 11.76 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.226 0.611 . . . . 74.34 110.73 175.043 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 124.49 -9.99 8.16 Favored Glycine 0 C--N 1.345 1.072 0 CA-C-O 119.913 -0.382 . . . . 64.33 112.989 -179.253 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.523 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 70.9 m-85 -79.12 127.8 32.47 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 122.774 0.43 . . . . 71.24 110.011 177.062 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . 0.421 ' N ' HD21 ' A' ' 91' ' ' ASN . 0.8 OUTLIER -84.36 171.02 13.02 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.796 0.838 . . . . 72.44 109.877 -179.502 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -56.77 -42.54 79.56 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.031 0.932 . . . . 74.35 111.642 178.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 30.9 t -56.23 -31.64 63.71 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.277 1.031 . . . . 72.51 112.949 178.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . 0.463 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 14.1 m120 -65.24 -32.21 73.76 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 122.662 0.385 . . . . 74.12 111.653 179.492 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 58.9 t -88.86 127.35 41.7 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 C-N-CA 124.02 0.928 . . . . 70.22 110.427 -172.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 63.5 m -143.72 122.38 12.56 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.468 0.707 . . . . 74.45 110.665 172.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 75.2 m95 -87.89 124.47 33.71 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 123.522 0.729 . . . . 73.24 111.349 177.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -120.81 91.89 3.64 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 107.955 -1.128 . . . . 71.51 107.955 169.195 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 70.69 -125.81 13.89 Favored Glycine 0 C--N 1.346 1.086 0 CA-C-N 115.79 -0.641 . . . . 64.4 112.095 -177.72 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -81.96 -6.73 59.36 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.76 0.824 . . . . 72.02 111.389 178.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 76.6 m -103.07 149.73 24.3 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.816 0.846 . . . . 73.51 109.564 -179.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.8 p -130.38 116.73 37.07 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.942 0 C-N-CA 123.975 0.91 . . . . 64.41 108.604 169.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 57.0 m -93.71 117.3 29.92 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 108.219 -1.03 . . . . 75.45 108.219 176.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.463 ' HA ' ' O ' ' A' ' 94' ' ' ASN . 89.9 t -114.57 110.97 33.99 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 C-N-CA 124.258 1.023 . . . . 73.23 108.261 177.615 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -123.59 116.16 22.68 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 109.118 -0.697 . . . . 72.13 109.118 178.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -141.15 173.74 23.14 Favored Glycine 0 C--N 1.342 0.873 0 O-C-N 123.477 0.485 . . . . 74.11 112.425 -177.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 . . . . . 0 N--CA 1.469 0.504 0 C-N-CA 122.592 0.357 . . . . 73.23 110.101 177.872 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.513 ' HZ3' ' HB2' ' A' ' 65' ' ' SER . 33.3 mmtp . . . . . 0 N--CA 1.475 0.819 0 CA-C-O 120.517 0.198 . . . . 72.14 110.741 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.411 ' HA ' ' HA ' ' A' ' 26' ' ' TYR . 0.9 OUTLIER -90.42 103.32 16.02 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 107.598 -1.26 . . . . 73.22 107.598 167.06 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.5 p -99.68 142.09 15.81 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 123.987 0.915 . . . . 72.33 109.238 177.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.499 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 34.1 mt-10 -109.67 113.85 26.96 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 108.034 -1.099 . . . . 74.44 108.034 176.043 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 90.1 t -99.25 110.6 26.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 C-N-CA 124.516 1.126 . . . . 62.23 109.998 -171.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.527 ' O ' ' HA ' ' A' ' 60' ' ' ILE . 77.8 mt-30 -82.43 99.74 9.61 Favored 'General case' 0 C--N 1.347 0.474 0 N-CA-C 107.67 -1.233 . . . . 72.51 107.67 178.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 64.0 t -93.38 114.48 30.18 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 N-CA-C 107.237 -1.394 . . . . 74.41 107.237 173.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.486 ' HB3' ' HZ3' ' A' ' 11' ' ' LYS . 7.7 ttpm? -122.35 103.89 9.04 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 107.818 -1.178 . . . . 74.42 107.818 179.666 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.409 ' HA ' ' O ' ' A' ' 57' ' ' ARG . 14.1 tt -122.33 125.69 73.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 122.759 0.424 . . . . 75.35 110.542 -174.333 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 51.4 m -102.2 116.54 32.87 Favored 'General case' 0 C--O 1.241 0.657 0 C-N-CA 123.83 0.852 . . . . 75.15 109.569 176.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 54.1 t -138.89 135.15 34.17 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 124.16 0.984 . . . . 74.43 109.5 175.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.469 ' HB2' ' HB3' ' A' ' 51' ' ' LEU . 67.0 t30 70.22 30.29 3.46 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 124.836 1.254 . . . . 73.42 110.959 175.079 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 83.65 -7.27 69.98 Favored Glycine 0 C--N 1.353 1.487 0 CA-C-N 115.588 -0.733 . . . . 74.14 113.231 -178.053 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 44.9 mtpt -105.4 131.08 53.28 Favored 'General case' 0 C--N 1.348 0.516 0 C-N-CA 123.954 0.902 . . . . 72.52 110.252 -173.085 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 85.8 m -95.34 131.45 41.42 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 108.696 -0.853 . . . . 71.23 108.696 174.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.59 ' HH ' HD13 ' A' ' 51' ' ' LEU . 81.7 m-85 -115.93 144.58 43.86 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 107.046 -1.465 . . . . 75.31 107.046 171.739 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -148.81 130.89 15.36 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 123.105 0.562 . . . . 75.51 109.798 175.358 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 69.9 ttt180 -154.33 134.85 13.46 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 108.471 -0.936 . . . . 72.41 108.471 178.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.422 HG21 ' HB3' ' A' ' 7' ' ' GLU . 16.6 m -101.47 116.82 33.64 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 123.66 0.784 . . . . 75.45 109.808 179.109 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 -97.65 128.71 44.55 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.22 1.008 . . . . 72.45 110.477 -173.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.499 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 25.2 mp0 -90.12 108.35 19.68 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 108.029 -1.1 . . . . 73.42 108.029 -178.136 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.476 HD13 HG23 ' A' ' 40' ' ' VAL . 89.8 mt -121.92 110.11 15.45 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.623 1.169 . . . . 74.43 108.921 -174.104 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.429 ' O ' ' HE3' ' A' ' 36' ' ' LYS . 82.3 t80 -92.53 134.58 34.84 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 122.732 0.413 . . . . 72.32 109.977 173.896 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.525 ' HB2' ' HB2' ' A' ' 32' ' ' GLU . . . -146.65 148.66 32.29 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.415 0.686 . . . . 75.11 110.65 177.686 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 88.5 t -76.38 -56.83 7.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 123.884 0.873 . . . . 75.3 109.56 175.346 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.542 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 94.5 mtt180 -102.32 164.97 11.38 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 115.534 -0.757 . . . . 73.51 110.012 175.618 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -69.72 -27.07 64.67 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 123.147 0.579 . . . . 72.42 110.636 170.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -62.34 -35.2 78.37 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.242 1.017 . . . . 65.44 111.147 176.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.542 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 13.5 mm-40 -70.51 -29.92 66.56 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.358 -0.837 . . . . 74.14 110.135 -178.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.732 HD23 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -75.69 -22.01 57.05 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.107 0.563 . . . . 72.45 110.741 -178.032 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.476 ' HG2' HG22 ' A' ' 80' ' ' ILE . 53.8 mtpt -57.19 -55.83 29.64 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 122.979 0.512 . . . . 71.14 111.13 179.807 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.502 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 2.4 pp20? -61.96 -30.11 70.7 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 115.648 -0.705 . . . . 74.12 112.14 179.7 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.732 ' HD2' HD23 ' A' ' 33' ' ' LEU . 64.3 mttm -70.39 -40.35 74.0 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.197 0.599 . . . . 75.33 110.857 179.454 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.551 HD13 HD21 ' A' ' 81' ' ' LEU . 95.7 mt -62.11 -39.69 93.37 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 123.73 0.643 . . . . 73.1 110.803 174.157 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -64.26 -37.68 88.36 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 122.997 0.519 . . . . 72.34 111.479 175.238 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.502 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 45.0 mmtm -62.88 -55.66 24.18 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 110.054 -0.35 . . . . 73.31 110.054 174.69 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.476 HG23 HD13 ' A' ' 25' ' ' LEU . 55.2 t -54.66 -49.22 69.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 124.808 1.243 . . . . 75.03 111.711 -178.542 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.403 HD22 HD12 ' A' ' 60' ' ' ILE . 40.5 mt -66.32 -45.59 79.78 Favored 'General case' 0 C--O 1.215 -0.712 0 C-N-CA 123.293 0.637 . . . . 75.0 111.601 -176.551 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -65.91 -42.16 90.54 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 112.247 0.462 . . . . 72.43 112.247 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.7 mm-40 -63.13 -50.82 68.94 Favored 'General case' 0 N--CA 1.486 1.344 0 CA-C-O 121.28 0.562 . . . . 62.33 110.634 177.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 15.4 tpt180 -63.7 -41.84 98.06 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.512 1.125 . . . . 75.51 111.37 -177.796 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.49 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 58.0 mtp -92.23 8.21 39.18 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.682 0.623 . . . . 74.41 112.682 -174.733 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.425 ' HA ' ' HZ1' ' A' ' 49' ' ' LYS . 20.4 t70 -73.42 -51.2 5.76 Favored Pre-proline 0 CA--C 1.559 1.295 0 CA-C-O 118.447 -0.787 . . . . 75.44 111.565 174.262 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -69.4 -16.6 39.19 Favored 'Trans proline' 0 C--N 1.389 2.674 0 C-N-CA 121.452 1.435 . . . . 75.11 111.894 174.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 48.7 mm -72.58 -32.69 42.35 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.132 0 C-N-CA 124.42 1.088 . . . . 73.11 110.309 176.087 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.49 ' HG3' ' O ' ' A' ' 45' ' ' MET . 55.1 mttp -62.3 -41.33 98.41 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 109.387 -0.597 . . . . 73.44 109.387 171.304 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.7 tmmm? -65.58 -32.55 74.2 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.175 0.99 . . . . 73.42 110.993 178.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.59 HD13 ' HH ' ' A' ' 19' ' ' TYR . 83.6 mt -70.47 -30.73 67.61 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 110.106 -0.331 . . . . 74.22 110.106 175.352 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 71.81 56.75 6.31 Favored Glycine 0 C--N 1.348 1.24 0 O-C-N 124.014 0.821 . . . . 75.51 113.448 170.055 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.435 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 89.4 m -88.72 125.54 34.91 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 122.674 0.39 . . . . 62.02 111.303 177.637 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 53.5 tptt -59.91 -39.38 85.23 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.475 1.11 . . . . 75.41 110.256 170.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 25.3 ttm180 -139.85 136.44 33.98 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 109.303 -0.629 . . . . 75.0 109.303 174.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 15.5 m -114.3 144.2 22.39 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 C-N-CA 124.087 0.955 . . . . 74.23 109.241 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.529 ' NH1' ' HG2' ' A' ' 105' ' ' GLU . 23.3 tpp180 -100.25 103.64 15.09 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 107.52 -1.289 . . . . 74.23 107.52 175.04 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 59.6 mt -100.06 133.26 43.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 N-CA-C 107.718 -1.215 . . . . 74.23 107.718 177.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 36.5 t -137.5 102.72 4.85 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 107.529 -1.285 . . . . 72.13 107.529 -176.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.527 ' HA ' ' O ' ' A' ' 9' ' ' GLN . 45.0 mt -115.86 114.28 45.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 C-N-CA 123.214 0.606 . . . . 72.43 111.061 -172.299 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 80.0 ttt180 -105.74 140.44 38.79 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 109.079 -0.712 . . . . 73.51 109.079 176.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.1 p -94.86 141.41 15.07 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 N-CA-C 109.227 -0.657 . . . . 73.24 109.227 178.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.458 ' HB3' ' H ' ' A' ' 7' ' ' GLU . 5.3 tppp? -90.09 123.57 34.07 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 107.045 -1.465 . . . . 74.55 107.045 165.781 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 16.4 p80 -92.02 146.01 24.08 Favored 'General case' 0 C--O 1.238 0.498 0 O-C-N 123.722 0.639 . . . . 71.11 110.963 -179.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.513 ' HB2' ' HZ3' ' A' ' 4' ' ' LYS . 27.7 m -84.49 -50.03 8.11 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 115.346 -0.843 . . . . 74.24 110.955 -176.348 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -93.06 -175.75 3.96 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.308 0.643 . . . . 73.51 111.266 179.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -114.56 -35.19 4.97 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.07 0.948 . . . . 54.02 111.086 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -89.0 -55.53 3.65 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.134 0.573 . . . . 72.32 111.146 174.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.0 mp0 -64.49 -17.88 64.27 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 125.072 1.349 . . . . 72.43 112.436 -171.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.539 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 0.6 OUTLIER -69.41 -22.34 63.69 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.272 1.029 . . . . 75.12 113.744 -174.701 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -69.01 -30.84 69.31 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.582 0.753 . . . . 75.55 109.513 177.432 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -83.14 -40.32 19.9 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.27 1.028 . . . . 73.11 110.102 172.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.539 ' HB3' ' HA ' ' A' ' 70' ' ' GLU . 44.2 tt0 -65.77 -30.26 70.88 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.955 0.902 . . . . 74.13 111.853 -176.164 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.56 -45.3 75.99 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.041 0.536 . . . . 75.34 110.314 176.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.479 ' HZ1' ' HB2' ' A' ' 75' ' ' LYS . 0.0 OUTLIER -69.91 -30.27 67.64 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 123.907 0.754 . . . . 75.2 111.958 176.386 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.406 ' O ' HG12 ' A' ' 80' ' ' ILE . 34.9 ttmt -65.88 -47.14 75.88 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.693 0.797 . . . . 74.31 109.383 174.624 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -73.66 -21.91 60.13 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 114.633 -1.167 . . . . 73.44 109.914 -179.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -66.55 -42.93 86.39 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 123.928 0.891 . . . . 74.43 110.639 173.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.18 -38.43 91.02 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 123.798 0.686 . . . . 72.4 110.382 175.454 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.476 HG22 ' HG2' ' A' ' 34' ' ' LYS . 36.7 mm -65.5 -44.14 94.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 124.272 1.029 . . . . 74.5 111.055 177.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.551 HD21 HD13 ' A' ' 37' ' ' LEU . 35.9 mt -64.54 -45.0 89.04 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.181 0.592 . . . . 74.4 110.088 177.399 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -59.88 -42.29 93.42 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.681 0.792 . . . . 74.23 110.694 -176.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -61.02 -49.57 76.88 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 124.081 0.863 . . . . 74.41 111.073 176.419 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 55.9 t -61.69 -51.01 77.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 123.539 0.736 . . . . 75.41 110.916 -175.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.433 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 35.4 m-85 -59.04 -44.04 91.73 Favored 'General case' 0 N--CA 1.477 0.882 0 O-C-N 124.021 0.825 . . . . 73.5 111.217 179.171 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.53 -32.56 74.26 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.049 0.54 . . . . 75.34 111.681 179.162 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -85.04 -6.46 59.32 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.748 0.819 . . . . 73.52 111.755 -179.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 86.1 mt -104.03 -15.54 15.56 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.388 0.675 . . . . 72.45 110.517 176.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 106.98 20.9 8.44 Favored Glycine 0 C--N 1.345 1.052 0 CA-C-N 116.111 -0.495 . . . . 41.01 113.676 175.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.433 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 95.8 m-85 -88.37 129.05 35.5 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 109.277 -0.638 . . . . 75.45 109.277 169.688 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -77.23 161.29 28.26 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.435 1.094 . . . . 74.14 109.653 -178.048 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -59.06 -38.95 80.62 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 124.18 0.992 . . . . 72.4 111.458 175.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 8.1 t -77.87 9.36 3.62 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 124.089 0.956 . . . . 72.14 112.503 176.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -101.94 -23.33 14.15 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.275 0.63 . . . . 64.21 110.701 168.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 59.6 t -108.78 121.37 61.74 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 C-N-CA 124.038 0.935 . . . . 73.52 110.433 -172.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.9 m -146.06 128.85 16.29 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.996 0.918 . . . . 74.25 109.552 171.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.416 ' HA ' ' HA ' ' A' ' 102' ' ' VAL . 33.7 m95 -73.09 152.73 41.1 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-O 121.468 0.651 . . . . 75.31 111.804 177.214 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -139.45 78.31 1.66 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.953 1.301 . . . . 71.45 107.555 176.241 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 63.92 -98.98 0.27 Allowed Glycine 0 C--N 1.345 1.074 0 CA-C-N 114.974 -1.012 . . . . 73.45 113.602 179.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -84.24 -25.72 29.22 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.648 0.779 . . . . 72.33 112.006 -177.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 28.7 m -125.33 138.04 54.06 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.504 0.722 . . . . 73.31 110.282 -168.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . 0.416 ' HA ' ' HA ' ' A' ' 97' ' ' TRP . 12.2 p -91.59 137.04 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.009 0 N-CA-C 109.489 -0.56 . . . . 74.25 109.489 176.676 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 27.1 m -102.18 106.45 17.29 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.616 1.166 . . . . 74.31 108.266 177.227 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 70.2 t -118.08 112.23 37.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 N-CA-C 108.323 -0.992 . . . . 70.44 108.323 -179.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . 0.529 ' HG2' ' NH1' ' A' ' 57' ' ' ARG . 0.1 OUTLIER -140.92 140.11 34.43 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 122.695 0.398 . . . . 75.24 110.087 178.82 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 160.88 -150.07 19.66 Favored Glycine 0 C--O 1.241 0.59 0 N-CA-C 111.098 -0.801 . . . . 72.12 111.098 -172.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 . . . . . 0 CA--C 1.552 1.042 0 C-N-CA 123.587 0.755 . . . . 71.1 112.262 -175.659 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 33.6 tptt . . . . . 0 N--CA 1.472 0.67 0 CA-C-O 120.549 0.214 . . . . 74.34 111.378 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.429 ' HB2' ' HD1' ' A' ' 26' ' ' TYR . 34.8 ttpt -127.27 107.32 9.89 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 109.072 -0.714 . . . . 72.12 109.072 174.795 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.1 p -100.69 143.97 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 N-CA-C 108.993 -0.743 . . . . 65.21 108.993 173.363 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -113.63 115.09 27.35 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 109.332 -0.618 . . . . 75.4 109.332 177.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 73.1 t -105.59 115.71 47.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 124.944 1.298 . . . . 73.32 110.062 -168.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.415 ' O ' ' HA ' ' A' ' 60' ' ' ILE . 38.7 mt-30 -97.08 99.59 11.09 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 108.576 -0.898 . . . . 73.42 108.576 -177.043 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.427 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 67.1 t -95.48 109.08 21.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 N-CA-C 109.092 -0.707 . . . . 63.05 109.092 -177.594 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.508 ' HE2' ' HB2' ' A' ' 59' ' ' SER . 35.6 ttpt -110.15 105.28 14.3 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 108.436 -0.95 . . . . 74.14 108.436 177.732 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 10.9 tt -118.15 123.71 72.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 122.983 0.513 . . . . 72.45 111.015 -174.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 41.8 m -95.99 110.82 22.98 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 123.259 0.624 . . . . 75.01 109.425 176.216 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.625 ' SG ' HG22 ' A' ' 48' ' ' ILE . 8.9 t -145.78 132.63 20.1 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.504 1.122 . . . . 75.41 110.185 179.655 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 62.78 35.22 13.96 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 124.479 1.111 . . . . 73.54 110.499 174.024 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.88 12.12 78.6 Favored Glycine 0 C--N 1.351 1.37 0 CA-C-N 115.255 -0.884 . . . . 72.52 114.234 177.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.481 ' HE2' ' HA ' ' A' ' 17' ' ' LYS . 8.0 mmpt? -125.23 142.23 51.62 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.567 0.747 . . . . 64.11 109.847 175.096 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 88.3 m -110.89 118.53 36.37 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 109.007 -0.738 . . . . 72.12 109.007 178.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.409 ' HB3' ' NH1' ' A' ' 44' ' ' ARG . 13.5 m-85 -108.06 109.76 21.28 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.525 1.13 . . . . 73.42 108.026 -172.681 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.477 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 1.7 pp20? -127.52 142.02 51.5 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 122.455 0.302 . . . . 72.35 111.46 -178.8 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 58.2 ttt180 -168.32 143.17 3.48 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.868 0.867 . . . . 75.45 109.553 178.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 23.9 m -89.79 118.16 29.18 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.347 1.059 . . . . 74.14 109.391 173.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -101.87 135.49 43.33 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.813 0.845 . . . . 65.21 109.729 -179.043 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -91.68 107.63 19.35 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 107.514 -1.291 . . . . 74.33 107.514 179.233 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.487 HD23 HG22 ' A' ' 40' ' ' VAL . 70.6 mt -111.14 99.4 8.25 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 109.076 -0.713 . . . . 73.34 109.076 -178.789 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.429 ' HD1' ' HB2' ' A' ' 5' ' ' LYS . 52.7 t80 -93.28 144.3 25.44 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.652 0.781 . . . . 75.52 109.571 177.343 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.548 ' HB2' ' HB2' ' A' ' 32' ' ' GLU . . . -158.26 160.62 37.28 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.186 0.995 . . . . 70.31 109.316 -179.012 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 56.4 t -75.85 -65.78 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 N-CA-C 108.308 -0.997 . . . . 75.22 108.308 170.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.519 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 97.8 mtt180 -96.03 162.18 13.66 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-O 121.064 0.459 . . . . 74.21 110.556 175.258 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 18.6 p-10 -69.96 -26.74 64.25 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.114 0.966 . . . . 60.04 111.222 174.229 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -69.1 -25.22 64.3 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 122.915 0.486 . . . . 72.33 111.438 175.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.548 ' HB2' ' HB2' ' A' ' 27' ' ' ALA . 11.5 mm-40 -70.77 -30.84 67.43 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.226 0.611 . . . . 75.54 109.997 177.319 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.455 HD23 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -66.19 -23.84 66.52 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 124.388 1.075 . . . . 75.3 110.97 -178.887 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.62 ' HZ3' ' HB3' ' A' ' 34' ' ' LYS . 8.5 mtpm? -54.95 -58.66 6.7 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.661 0.784 . . . . 75.33 111.906 -178.796 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.8 pp20? -65.69 -25.94 67.55 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 122.52 0.328 . . . . 71.53 111.783 -178.122 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.455 ' HD2' HD23 ' A' ' 33' ' ' LEU . 59.5 mttm -69.42 -41.91 75.73 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.331 0.652 . . . . 75.51 110.637 177.175 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.507 HD11 HD21 ' A' ' 81' ' ' LEU . 84.8 mt -61.79 -44.07 97.6 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 123.909 0.755 . . . . 74.12 110.578 173.443 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -56.79 -42.14 78.95 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 122.931 0.493 . . . . 75.01 110.822 176.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -62.78 -61.78 2.17 Favored 'General case' 0 C--O 1.218 -0.593 0 O-C-N 123.98 0.8 . . . . 74.22 110.743 177.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.487 HG22 HD23 ' A' ' 25' ' ' LEU . 99.1 t -60.04 -37.84 74.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 123.363 0.665 . . . . 74.43 111.763 -173.416 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 48.9 mt -71.63 -47.71 52.7 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.326 0.65 . . . . 73.55 111.362 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -70.01 -32.24 70.31 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 122.906 0.482 . . . . 74.34 110.923 -177.18 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -82.38 -34.58 28.32 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.112 0.965 . . . . 75.32 110.686 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.409 ' NH1' ' HB3' ' A' ' 19' ' ' TYR . 5.4 tpm_? -60.09 -44.52 94.75 Favored 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 108.956 -0.757 . . . . 72.33 108.956 169.276 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.512 ' HA ' ' HB ' ' A' ' 48' ' ' ILE . 68.7 mtp -88.67 1.04 55.8 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-N 114.465 -1.243 . . . . 75.34 112.531 -178.469 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -65.54 -50.5 56.51 Favored Pre-proline 0 N--CA 1.483 1.199 0 CA-C-N 119.191 0.905 . . . . 72.35 111.15 178.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.516 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 57.5 Cg_endo -68.28 -23.15 39.02 Favored 'Trans proline' 0 C--N 1.388 2.613 0 C-N-CA 121.634 1.556 . . . . 72.32 111.707 172.198 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.625 HG22 ' SG ' ' A' ' 14' ' ' CYS . 47.5 mm -75.5 -34.92 30.87 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.034 0 C-N-CA 124.379 1.072 . . . . 73.4 110.509 -177.03 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.454 ' HG3' ' O ' ' A' ' 45' ' ' MET . 35.7 mtmm -82.8 -12.17 57.69 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.494 0.717 . . . . 73.23 109.951 177.59 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -80.57 -33.06 36.41 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.24 1.016 . . . . 73.35 109.586 164.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 95.7 mt -73.26 -28.45 62.14 Favored 'General case' 0 N--CA 1.484 1.245 0 N-CA-C 109.759 -0.46 . . . . 74.44 109.759 178.566 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 67.65 32.58 78.67 Favored Glycine 0 C--N 1.354 1.529 0 CA-C-N 115.645 -0.707 . . . . 75.44 113.514 173.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 1.6 p -67.8 110.32 3.75 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 109.471 -0.566 . . . . 74.31 109.471 176.137 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 6.9 mtpm? -62.38 -20.42 64.4 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.527 1.131 . . . . 75.45 112.788 -171.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 43.4 ttp180 -136.4 131.08 33.7 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 108.585 -0.894 . . . . 74.42 108.585 173.033 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 35.6 m -124.49 136.88 59.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 109.11 -0.7 . . . . 71.41 109.11 173.222 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 54.9 ttt180 -106.69 105.38 15.38 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 108.184 -1.043 . . . . 73.44 108.184 177.057 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 32.8 mt -107.43 104.15 16.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 123.259 0.623 . . . . 71.34 109.435 -175.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.508 ' HB2' ' HE2' ' A' ' 11' ' ' LYS . 20.3 m -97.78 104.6 16.64 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 108.347 -0.983 . . . . 64.22 108.347 175.545 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.478 ' HB ' HG11 ' A' ' 102' ' ' VAL . 85.8 mt -97.71 110.24 25.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 123.831 0.852 . . . . 64.5 109.719 -179.782 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 27.7 mtm105 -98.38 107.72 20.25 Favored 'General case' 0 C--O 1.237 0.442 0 N-CA-C 107.05 -1.463 . . . . 74.13 107.05 175.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.1 p -94.61 137.18 23.76 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 N-CA-C 109.125 -0.695 . . . . 72.13 109.125 -171.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -82.37 118.74 23.4 Favored 'General case' 0 C--N 1.35 0.624 0 N-CA-C 109.527 -0.546 . . . . 74.31 109.527 -176.216 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 50.9 m80 -83.74 150.49 25.78 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 124.634 1.174 . . . . 73.45 108.922 177.497 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 29.7 t -65.68 -52.66 49.79 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 123.525 0.516 . . . . 74.32 112.05 -172.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.507 ' H ' ' HB2' ' A' ' 69' ' ' GLU . 15.2 m-20 -140.84 -175.9 4.47 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 124.242 1.017 . . . . 74.21 108.949 -174.11 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.8 -54.13 15.03 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.646 0.778 . . . . 73.32 111.687 -178.044 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.21 -23.36 62.0 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 122.926 0.49 . . . . 73.34 110.406 175.086 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.507 ' HB2' ' H ' ' A' ' 66' ' ' ASP . 24.9 mm-40 -76.56 -11.02 59.8 Favored 'General case' 0 C--O 1.211 -0.922 0 CA-C-O 118.755 -0.641 . . . . 73.45 112.51 174.49 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -57.17 -51.63 68.54 Favored 'General case' 0 N--CA 1.488 1.46 0 CA-C-N 119.241 0.928 . . . . 74.3 110.971 173.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -71.89 -30.74 65.71 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.087 0.555 . . . . 75.02 111.244 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 4.5 tppp? -67.32 -60.61 2.45 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.324 0.65 . . . . 71.33 109.581 178.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -67.0 -15.2 63.58 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.573 1.149 . . . . 74.34 112.164 178.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.36 -62.45 1.67 Allowed 'General case' 0 C--N 1.351 0.671 0 CA-C-N 118.882 0.764 . . . . 74.02 109.856 172.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -69.04 -40.11 78.78 Favored 'General case' 0 CA--C 1.55 0.963 0 O-C-N 124.171 0.919 . . . . 74.34 111.68 -179.318 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 48.3 tttm -67.29 -50.8 58.88 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.907 0.883 . . . . 73.44 111.95 -176.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -75.45 -20.27 58.94 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 110.127 -0.323 . . . . 74.35 110.127 177.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.92 -37.93 74.98 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 122.588 0.355 . . . . 63.35 111.168 171.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.479 ' O ' ' HG2' ' A' ' 83' ' ' LYS . . . -63.77 -45.87 87.84 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.227 0.611 . . . . 71.22 110.665 175.762 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.421 ' O ' HG22 ' A' ' 84' ' ' VAL . 49.4 mm -61.35 -45.61 98.26 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 C-N-CA 123.914 0.885 . . . . 73.53 110.325 -178.748 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.541 HD11 HG13 ' A' ' 102' ' ' VAL . 35.8 mt -69.58 -41.82 75.32 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.66 0.784 . . . . 75.25 111.39 178.881 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -56.31 -43.22 78.74 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 124.331 1.052 . . . . 61.41 110.624 -176.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.479 ' HG2' ' O ' ' A' ' 79' ' ' ALA . 33.6 mmtp -68.14 -42.23 80.47 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 114.67 -1.15 . . . . 73.31 110.758 179.734 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.421 HG22 ' O ' ' A' ' 80' ' ' ILE . 51.1 t -64.34 -47.95 87.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 C-N-CA 123.544 0.738 . . . . 73.53 110.468 -176.097 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.542 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 25.6 m-85 -61.13 -41.36 96.58 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.28 -0.873 . . . . 74.04 110.437 177.224 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.66 -25.39 66.54 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.494 0.718 . . . . 71.4 111.825 176.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -86.11 -9.69 56.22 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 124.018 0.927 . . . . 75.35 111.2 176.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 94.5 mt -106.1 -25.17 12.15 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.221 0.608 . . . . 74.42 111.023 -178.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 116.34 17.09 6.29 Favored Glycine 0 N--CA 1.475 1.29 0 C-N-CA 122.945 0.307 . . . . 71.31 113.696 177.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.542 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 10.3 m-85 -104.14 125.72 50.68 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 107.986 -1.116 . . . . 74.21 107.986 173.159 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -123.71 97.89 5.58 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 122.929 0.491 . . . . 75.12 110.833 -170.308 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 64.19 -72.09 0.06 Allowed 'General case' 0 N--CA 1.494 1.765 0 C-N-CA 125.254 1.422 . . . . 55.33 114.176 164.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 14.6 m -57.08 -30.45 64.32 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 125.068 1.347 . . . . 73.31 112.502 -178.051 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . 0.413 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 10.7 m120 -66.1 -39.73 90.2 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.483 0.713 . . . . 75.22 111.008 176.476 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.42 ' HA ' HG23 ' A' ' 104' ' ' VAL . 47.6 t -93.02 106.99 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 124.999 1.32 . . . . 75.24 110.276 -167.619 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 44.5 m -123.93 126.66 46.73 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 122.996 0.518 . . . . 75.44 110.22 178.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 55.1 m95 -89.84 147.16 23.94 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 122.968 0.507 . . . . 74.42 110.491 174.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -156.86 98.15 1.75 Allowed 'General case' 0 CA--C 1.554 1.109 0 C-N-CA 124.658 1.183 . . . . 65.03 109.166 -177.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 77.54 -99.78 1.5 Allowed Glycine 0 C--N 1.35 1.324 0 CA-C-N 115.36 -0.836 . . . . 64.15 112.979 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -110.86 -7.3 14.6 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 124.409 1.084 . . . . 71.31 110.153 177.052 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 22.0 m -103.45 153.68 20.25 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.188 1.395 . . . . 74.42 110.659 -168.417 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . 0.541 HG13 HD11 ' A' ' 81' ' ' LEU . 2.7 p -128.9 104.62 11.63 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.877 0 C-N-CA 124.323 1.049 . . . . 75.52 108.627 167.238 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.414 HG22 ' HG ' ' A' ' 59' ' ' SER . 24.3 m -91.97 104.92 17.28 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.646 0.778 . . . . 73.34 108.937 -178.897 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.42 HG23 ' HA ' ' A' ' 95' ' ' VAL . 53.1 t -102.01 121.99 53.68 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 C-N-CA 124.825 1.25 . . . . 74.44 109.485 179.573 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -89.03 126.27 35.36 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 108.77 -0.826 . . . . 63.52 108.77 172.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -106.27 154.83 16.81 Favored Glycine 0 N--CA 1.468 0.789 0 N-CA-C 111.131 -0.788 . . . . 75.53 111.131 173.612 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 . . . . . 0 N--CA 1.477 0.925 0 C-N-CA 123.431 0.692 . . . . 75.42 109.584 178.262 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.737 0 N-CA-C 108.698 -0.853 . . . . 71.42 108.698 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.409 ' HD2' ' HB3' ' A' ' 24' ' ' GLN . 38.4 ttpt -89.78 111.88 23.02 Favored 'General case' 0 C--O 1.241 0.655 0 N-CA-C 109.406 -0.59 . . . . 75.14 109.406 179.321 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.668 HG21 HG11 ' A' ' 62' ' ' VAL . 3.9 p -98.34 142.87 13.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 N-CA-C 107.927 -1.138 . . . . 74.21 107.927 174.149 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.418 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 44.6 mt-10 -105.52 109.95 22.1 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 107.427 -1.323 . . . . 73.14 107.427 176.265 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 73.2 t -99.16 113.26 33.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 114.355 -1.293 . . . . 75.0 108.705 -173.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.455 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 46.8 mt-30 -104.35 99.92 9.63 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 108.57 -0.9 . . . . 64.51 108.57 -176.159 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.426 HG22 HG12 ' A' ' 60' ' ' ILE . 74.9 t -95.18 108.48 20.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 N-CA-C 108.591 -0.892 . . . . 75.13 108.591 -178.227 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.414 ' HE2' ' HB2' ' A' ' 59' ' ' SER . 36.2 ttpt -109.9 107.27 17.15 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.278 -0.874 . . . . 75.31 108.984 -174.17 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.438 HD12 HG13 ' A' ' 48' ' ' ILE . 14.8 tt -123.55 116.52 48.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 123.086 0.554 . . . . 75.01 110.126 -177.136 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 93.1 m -94.15 124.28 38.07 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 109.568 -0.53 . . . . 72.0 109.568 178.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.415 ' SG ' HG23 ' A' ' 48' ' ' ILE . 47.6 t -150.6 151.56 32.75 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.626 1.17 . . . . 65.31 109.138 -178.171 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 36.1 t30 69.97 -78.23 0.05 OUTLIER 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 124.89 1.276 . . . . 74.55 109.798 -176.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -165.19 11.69 0.08 OUTLIER Glycine 0 N--CA 1.462 0.431 0 CA-C-N 115.487 -0.779 . . . . 63.21 111.293 174.176 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -123.19 156.79 34.39 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.231 1.012 . . . . 74.2 110.45 -173.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 93.6 m -103.22 111.9 24.5 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.318 1.047 . . . . 63.01 109.023 175.101 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 52.8 m-85 -100.46 101.14 12.01 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 108.078 -1.082 . . . . 75.53 108.078 -177.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -134.32 156.16 48.96 Favored 'General case' 0 C--O 1.239 0.519 0 C-N-CA 123.276 0.63 . . . . 74.31 110.695 -177.267 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.3 ttm180 -159.76 146.8 16.53 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.401 -0.818 . . . . 73.5 108.866 175.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 31.8 m -89.09 105.75 17.99 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 108.265 -1.013 . . . . 72.51 108.265 171.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 81.9 m-85 -95.9 119.77 34.97 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.8 0.84 . . . . 74.11 108.859 -177.003 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.418 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 26.6 mp0 -88.2 108.08 19.11 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 107.987 -1.116 . . . . 75.1 107.987 -179.676 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.432 HD21 ' HB3' ' A' ' 36' ' ' LYS . 78.6 mt -115.17 99.63 7.56 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.745 0.818 . . . . 74.34 109.189 -175.058 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.407 ' O ' ' HE3' ' A' ' 36' ' ' LYS . 87.8 t80 -94.11 133.61 37.42 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 108.932 -0.766 . . . . 75.14 108.932 172.614 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.512 ' HB3' ' HB2' ' A' ' 32' ' ' GLU . . . -130.47 171.81 12.58 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.479 0.711 . . . . 73.44 109.663 175.785 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 26.4 t -95.66 -32.27 4.37 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 N-CA-C 109.319 -0.623 . . . . 75.15 109.319 172.477 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.488 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 35.1 mtt180 -132.39 169.57 16.34 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.903 0.881 . . . . 74.34 109.465 179.369 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -66.59 -41.3 88.7 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.871 0.868 . . . . 74.34 110.976 175.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -65.49 -22.01 66.69 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.514 1.126 . . . . 75.51 111.885 -178.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.512 ' HB2' ' HB3' ' A' ' 27' ' ' ALA . 28.5 mm-40 -78.8 -26.5 44.33 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.377 0.671 . . . . 63.24 111.039 -179.543 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.503 HD21 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -71.4 -23.43 61.87 Favored 'General case' 0 CA--C 1.557 1.24 0 C-N-CA 123.821 0.848 . . . . 72.23 110.434 -176.344 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.506 ' HG2' HG21 ' A' ' 80' ' ' ILE . 7.8 mtmp? -57.42 -54.19 49.68 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.303 0.641 . . . . 73.35 111.713 -175.782 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.56 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 1.9 pp20? -60.6 -31.52 70.68 Favored 'General case' 0 C--N 1.354 0.8 0 CA-C-N 115.814 -0.63 . . . . 74.13 111.115 -176.766 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.503 ' HD2' HD21 ' A' ' 33' ' ' LEU . 58.4 mttm -67.31 -43.58 81.29 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.797 0.839 . . . . 74.15 110.417 178.87 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.422 HD13 HD22 ' A' ' 81' ' ' LEU . 75.5 mt -61.05 -39.43 89.8 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.902 0.881 . . . . 74.33 110.687 175.625 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.41 ' HD3' ' HA ' ' A' ' 35' ' ' GLU . 57.3 mtpt -63.87 -42.61 97.47 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.466 0.707 . . . . 74.22 111.042 175.794 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.56 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 31.7 mmtp -61.03 -48.12 83.26 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 109.698 -0.482 . . . . 74.33 109.698 177.492 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 52.9 t -57.13 -50.4 76.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 124.847 1.259 . . . . 63.35 112.032 178.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 70.3 mt -70.75 -49.24 48.93 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.256 0.622 . . . . 75.34 111.12 -173.383 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -60.92 -39.05 87.94 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 122.887 0.475 . . . . 74.13 111.162 177.221 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -63.54 -55.01 27.28 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.662 0.785 . . . . 75.13 110.951 179.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.4 tpm_? -71.0 -33.19 70.15 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 115.573 -0.74 . . . . 72.52 110.92 -173.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 59.6 mtp -89.02 -6.65 57.02 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 112.773 0.657 . . . . 71.32 112.773 -178.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -61.61 -50.31 82.89 Favored Pre-proline 0 CA--C 1.569 1.683 0 CA-C-O 118.739 -0.648 . . . . 74.42 111.855 178.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -71.95 -21.32 24.55 Favored 'Trans proline' 0 C--N 1.391 2.767 0 C-N-CA 121.87 1.713 . . . . 73.33 112.631 174.245 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.438 HG13 HD12 ' A' ' 12' ' ' ILE . 49.3 mm -68.99 -31.46 50.54 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.262 0 C-N-CA 123.549 0.74 . . . . 70.54 109.91 -178.278 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 60.1 mttm -63.32 -39.93 95.91 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.243 -0.889 . . . . 75.24 110.412 174.131 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.48 -28.99 62.23 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 123.429 0.691 . . . . 75.43 109.798 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 94.6 mt -69.85 -33.13 71.86 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 109.703 -0.481 . . . . 72.34 109.703 176.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 69.94 47.98 43.55 Favored Glycine 0 C--N 1.344 0.999 0 CA-C-N 115.097 -0.956 . . . . 64.21 113.246 173.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 99.3 m -75.98 120.98 22.05 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 109.9 -0.408 . . . . 72.04 109.9 174.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 6.6 ptpp? -60.07 -23.19 63.57 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.435 1.094 . . . . 65.51 112.082 177.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 14.3 ttp180 -159.66 139.54 11.61 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.778 0.831 . . . . 72.43 109.182 175.048 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 17.3 m -129.32 150.57 34.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 124.229 1.012 . . . . 64.15 109.944 177.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 26.6 ttt180 -101.84 115.48 30.63 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 108.353 -0.98 . . . . 73.33 108.353 170.209 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 21.1 mt -108.58 102.31 13.8 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 N-CA-C 108.424 -0.954 . . . . 75.13 108.424 177.431 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.414 ' HB2' ' HE2' ' A' ' 11' ' ' LYS . 57.2 m -102.67 104.97 15.35 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 108.551 -0.907 . . . . 73.22 108.551 178.559 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.448 ' HB ' HG13 ' A' ' 102' ' ' VAL . 63.3 mt -99.13 111.66 29.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 124.227 1.011 . . . . 74.11 109.537 -176.085 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.455 ' HB2' ' HB2' ' A' ' 9' ' ' GLN . 2.6 mpt_? -90.88 133.8 34.95 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 108.481 -0.933 . . . . 75.41 108.481 177.044 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.668 HG11 HG21 ' A' ' 6' ' ' VAL . 39.0 t -107.32 110.78 33.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 N-CA-C 107.581 -1.266 . . . . 75.33 107.581 173.048 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.12 101.96 9.96 Favored 'General case' 0 C--N 1.353 0.751 0 N-CA-C 107.095 -1.446 . . . . 72.32 107.095 -176.018 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . 0.46 ' HD2' HG12 ' A' ' 62' ' ' VAL . 65.0 m170 -68.13 108.73 3.23 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 114.796 -1.093 . . . . 72.25 110.369 -175.204 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 47.8 t -60.22 -58.34 8.92 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 124.147 0.905 . . . . 74.33 111.379 -173.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -106.93 143.17 35.41 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.513 0.725 . . . . 75.41 110.718 -176.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.436 ' O ' ' HG2' ' A' ' 70' ' ' GLU . . . -72.59 -46.41 54.37 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.833 0.853 . . . . 73.13 111.563 -175.898 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -67.81 -31.75 71.83 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.02 0.528 . . . . 75.42 112.004 -179.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -80.51 -32.78 36.84 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 112.47 0.544 . . . . 74.13 112.47 -174.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.568 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 12.8 pt-20 -66.31 -17.63 64.87 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 114.556 1.317 . . . . 62.42 114.556 -165.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -70.59 -44.46 67.3 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 108.899 -0.778 . . . . 74.12 108.899 176.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 16.6 tppt? -71.5 -44.33 64.9 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 114.945 -1.025 . . . . 74.13 110.277 174.598 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.568 ' HB3' ' HA ' ' A' ' 70' ' ' GLU . 0.3 OUTLIER -63.84 -52.49 59.88 Favored 'General case' 0 C--O 1.209 -1.076 0 CA-C-N 114.603 -1.181 . . . . 73.11 110.982 -170.365 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.78 -49.58 74.87 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.526 0.73 . . . . 65.25 112.186 -175.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -56.36 -47.39 78.95 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 114.945 -1.025 . . . . 75.13 111.678 177.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -78.85 -22.53 45.96 Favored 'General case' 0 CA--C 1.556 1.207 0 C-N-CA 123.355 0.662 . . . . 64.51 111.317 -177.095 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -81.79 -21.76 37.53 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.939 0.896 . . . . 72.53 109.204 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -59.73 -36.17 76.05 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.087 0.555 . . . . 73.2 110.006 169.416 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -74.7 -37.02 62.73 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.895 0.878 . . . . 71.42 111.324 176.169 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.506 HG21 ' HG2' ' A' ' 34' ' ' LYS . 31.8 mm -62.42 -43.73 98.53 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 C-N-CA 123.853 0.861 . . . . 73.53 110.456 175.814 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.541 HD13 HG12 ' A' ' 102' ' ' VAL . 47.5 mt -67.34 -39.33 85.76 Favored 'General case' 0 C--O 1.22 -0.486 0 C-N-CA 124.243 1.017 . . . . 75.24 110.289 176.649 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -62.89 -34.9 78.38 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.725 0.81 . . . . 74.15 110.996 179.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 41.6 mmtm -61.56 -51.29 69.19 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 123.511 0.507 . . . . 74.22 110.306 172.007 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.461 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 73.9 t -61.31 -46.9 95.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 124.174 0.99 . . . . 71.22 110.73 -173.789 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.51 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 21.1 m-85 -61.5 -35.46 77.74 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 115.267 -0.879 . . . . 75.32 110.54 179.581 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -76.02 -29.53 58.14 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.999 0.519 . . . . 73.13 111.366 176.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -78.58 -13.7 59.69 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 122.997 0.519 . . . . 72.22 110.249 178.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 57.7 mt -108.86 -25.14 10.93 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.791 0.836 . . . . 74.02 110.725 178.22 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 119.77 -17.63 10.08 Favored Glycine 0 C--N 1.349 1.278 0 N-CA-C 115.207 0.843 . . . . 54.42 115.207 176.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.51 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 36.9 m-85 -59.83 135.76 57.79 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.619 0.768 . . . . 74.1 111.476 -177.241 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -99.05 167.75 10.52 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.965 0.906 . . . . 64.5 111.799 -172.181 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -56.66 -39.43 73.72 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 125.106 1.363 . . . . 73.51 112.516 -179.408 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 51.2 p -59.5 -29.03 67.57 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.299 1.039 . . . . 64.35 111.873 179.135 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -84.16 -26.55 28.74 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.706 0.802 . . . . 72.22 111.72 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 44.7 t -83.52 104.96 12.67 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 N-CA-C 109.364 -0.606 . . . . 74.25 109.364 -175.467 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 97.2 m -133.02 112.88 12.19 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.442 0.697 . . . . 65.13 110.248 178.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 59.8 m95 -76.32 112.3 12.67 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 123.198 0.599 . . . . 74.1 110.481 178.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.509 ' HB3' ' HG1' ' A' ' 103' ' ' THR . 15.5 t70 -121.6 106.08 11.03 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.753 1.221 . . . . 64.21 109.303 179.608 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 72.86 54.75 6.95 Favored Glycine 0 C--N 1.35 1.342 0 O-C-N 123.518 0.511 . . . . 51.24 113.99 172.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 60.03 22.77 11.93 Favored 'General case' 0 N--CA 1.503 2.179 0 C-N-CA 124.755 1.222 . . . . 64.3 111.757 -179.383 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 40.4 m -138.96 141.71 38.41 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.073 1.349 . . . . 74.23 107.685 -171.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . 0.541 HG12 HD13 ' A' ' 81' ' ' LEU . 5.1 p -94.99 107.65 19.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 N-CA-C 108.878 -0.786 . . . . 75.43 108.878 179.271 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.509 ' HG1' ' HB3' ' A' ' 98' ' ' ASP . 89.0 m -98.55 107.72 20.24 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.766 0.826 . . . . 72.54 109.145 -178.752 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 45.2 t -94.73 131.87 40.35 Favored 'Isoleucine or valine' 0 C--O 1.243 0.733 0 C-N-CA 124.818 1.247 . . . . 74.05 109.631 -178.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -85.13 112.92 21.12 Favored 'General case' 0 C--O 1.24 0.556 0 N-CA-C 107.647 -1.242 . . . . 75.45 107.647 170.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -110.29 137.08 14.04 Favored Glycine 0 N--CA 1.465 0.617 0 CA-C-N 117.8 0.273 . . . . 63.45 112.889 -177.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 . . . . . 0 C--O 1.239 0.505 0 N-CA-C 106.126 -1.805 . . . . 70.32 106.126 164.379 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? . . . . . 0 N--CA 1.472 0.657 0 N-CA-C 109.707 -0.479 . . . . 74.3 109.707 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.483 ' HA ' ' HA ' ' A' ' 26' ' ' TYR . 23.7 ttpp -83.81 115.04 22.05 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.18 -1.044 . . . . 75.32 108.18 165.637 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -101.53 152.56 5.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 N-CA-C 106.341 -1.725 . . . . 64.45 106.341 170.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.407 ' H ' ' HB2' ' A' ' 63' ' ' LYS . 42.6 mt-10 -120.0 114.55 22.2 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.676 0.75 . . . . 73.12 109.607 175.59 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.411 HG22 HD12 ' A' ' 25' ' ' LEU . 62.3 t -96.36 113.39 30.61 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 125.105 1.362 . . . . 61.42 109.165 -174.434 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 91.9 mt-30 -96.94 103.03 14.92 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 108.231 -1.026 . . . . 74.23 108.231 -178.125 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 79.9 t -95.98 110.01 23.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 N-CA-C 109.028 -0.73 . . . . 74.1 109.028 -177.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.405 ' HG3' ' HB3' ' A' ' 20' ' ' GLU . 39.5 ttmt -113.21 102.79 10.7 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.905 0.882 . . . . 73.43 108.754 -178.339 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 10.3 tt -118.07 118.07 56.94 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 C-N-CA 123.098 0.559 . . . . 70.13 110.302 -176.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 60.1 m -90.62 110.49 21.64 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 109.079 -0.711 . . . . 72.42 109.079 175.663 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.591 ' SG ' HG21 ' A' ' 48' ' ' ILE . 42.4 t -112.67 124.47 52.63 Favored 'General case' 0 C--O 1.244 0.796 0 N-CA-C 107.631 -1.248 . . . . 70.33 107.631 179.353 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.517 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 43.8 t30 70.19 -80.45 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.021 1.328 . . . . 74.52 109.51 -176.314 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -158.98 18.47 0.27 Allowed Glycine 0 N--CA 1.464 0.536 0 N-CA-C 111.166 -0.774 . . . . 70.22 111.166 176.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.46 ' HE2' ' HA ' ' A' ' 17' ' ' LYS . 11.1 mmpt? -117.46 126.23 52.27 Favored 'General case' 0 C--N 1.348 0.529 0 C-N-CA 124.344 1.058 . . . . 75.32 108.77 -179.562 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 38.2 m -94.68 122.09 36.92 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.646 0.778 . . . . 72.25 109.532 -176.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.665 ' HB3' HH21 ' A' ' 44' ' ' ARG . 67.3 m-85 -113.71 101.21 9.1 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.807 0.843 . . . . 74.53 109.639 -175.172 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.405 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 12.8 pt-20 -118.82 149.24 41.85 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.408 0.683 . . . . 74.33 110.528 -178.476 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 39.8 ttp180 -166.22 137.08 3.52 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.622 0.769 . . . . 75.32 109.904 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 39.4 m -86.24 109.36 18.88 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 109.009 -0.737 . . . . 73.4 109.009 175.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 28.3 m-85 -96.7 134.33 40.1 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 107.985 -1.117 . . . . 72.54 107.985 177.338 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -92.58 108.52 20.04 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 107.661 -1.237 . . . . 63.23 107.661 177.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.421 HD13 HG23 ' A' ' 40' ' ' VAL . 69.7 mt -111.62 96.81 6.31 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 109.187 -0.672 . . . . 74.1 109.187 177.281 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.483 ' HA ' ' HA ' ' A' ' 5' ' ' LYS . 44.6 t80 -93.41 133.92 36.19 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.259 1.024 . . . . 61.04 109.19 173.536 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.547 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -151.67 144.79 24.61 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 122.453 0.301 . . . . 51.44 111.217 179.387 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 94.3 t -65.12 -45.98 92.52 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 O-C-N 124.578 1.174 . . . . 72.21 109.586 173.29 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.561 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 58.4 mtt85 -124.05 155.96 37.38 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.42 0.688 . . . . 74.52 110.118 -179.186 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -65.37 -27.35 68.51 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.58 0.752 . . . . 74.44 110.37 170.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -53.08 -44.88 67.9 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.419 1.088 . . . . 64.33 110.962 168.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.561 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 13.6 mm-40 -73.1 -23.73 60.56 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 115.527 -0.76 . . . . 75.43 111.143 -177.433 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.418 ' HA ' ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -76.15 -26.83 56.67 Favored 'General case' 0 CA--C 1.559 1.292 0 C-N-CA 123.346 0.658 . . . . 73.12 110.133 -178.28 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.479 ' HG2' HG22 ' A' ' 80' ' ' ILE . 55.7 mtpt -60.64 -47.38 86.49 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 123.386 0.674 . . . . 74.33 112.765 -176.037 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -62.33 -35.39 78.94 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.527 0.731 . . . . 75.12 111.511 175.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.418 ' HD2' ' HA ' ' A' ' 33' ' ' LEU . 66.7 mttm -67.72 -42.82 81.34 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.655 0.782 . . . . 75.42 110.54 -179.069 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.455 HD11 HD22 ' A' ' 81' ' ' LEU . 88.8 mt -59.27 -45.95 89.85 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 124.15 0.906 . . . . 73.21 110.216 176.029 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -54.76 -48.47 72.58 Favored 'General case' 0 N--CA 1.482 1.144 0 O-C-N 123.741 0.651 . . . . 73.0 110.964 174.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.476 ' HB3' ' HZ1' ' A' ' 39' ' ' LYS . 4.5 mmmp? -60.81 -59.51 5.27 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.233 0.613 . . . . 74.51 110.98 -178.23 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.421 HG23 HD13 ' A' ' 25' ' ' LEU . 60.7 t -48.65 -44.49 14.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 C-N-CA 125.196 1.398 . . . . 73.21 111.894 -178.822 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.449 HD22 HD12 ' A' ' 60' ' ' ILE . 58.5 mt -65.88 -51.41 59.0 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.312 -0.858 . . . . 73.44 110.802 177.305 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -68.56 -22.35 64.48 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 113.145 0.794 . . . . 72.55 113.145 -176.438 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.472 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 15.6 mm-40 -74.73 -53.56 8.99 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 108.61 -0.885 . . . . 73.44 108.61 174.453 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . 0.665 HH21 ' HB3' ' A' ' 19' ' ' TYR . 17.7 tpt180 -74.64 -25.86 59.49 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-N 114.888 -1.051 . . . . 74.12 111.695 -171.133 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 55.6 mtp -92.39 -8.39 45.02 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 112.639 0.607 . . . . 54.4 112.639 -179.091 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.554 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 33.9 t70 -59.27 -49.84 90.66 Favored Pre-proline 0 CA--C 1.567 1.609 0 CA-C-O 118.791 -0.623 . . . . 72.41 112.206 177.527 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.425 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 39.5 Cg_endo -65.36 -28.53 54.72 Favored 'Trans proline' 0 C--N 1.39 2.761 0 C-N-CA 121.835 1.69 . . . . 74.44 112.644 173.698 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.591 HG21 ' SG ' ' A' ' 14' ' ' CYS . 50.0 mm -67.91 -36.97 77.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 C-N-CA 124.148 0.979 . . . . 73.3 111.511 -170.749 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.554 ' HE2' ' HA ' ' A' ' 46' ' ' ASP . 44.3 mtmt -66.81 -41.15 88.01 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 115.98 -0.554 . . . . 74.34 109.701 177.167 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -72.52 -24.73 61.19 Favored 'General case' 0 CA--C 1.557 1.233 0 CA-C-N 114.603 -1.18 . . . . 71.01 110.189 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 83.3 mt -75.7 -33.01 60.32 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.265 0.626 . . . . 75.2 110.416 173.654 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 72.59 55.05 6.94 Favored Glycine 0 C--N 1.345 1.073 0 CA-C-N 115.91 -0.586 . . . . 63.12 113.052 178.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.517 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 65.6 m -94.54 113.8 25.68 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 108.525 -0.917 . . . . 61.33 108.525 173.153 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.4 mtpm? -63.73 -78.33 0.05 OUTLIER 'General case' 0 N--CA 1.476 0.851 0 O-C-N 123.601 0.563 . . . . 74.34 110.216 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 15.1 ttm180 -84.3 121.21 27.2 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 109.321 -0.622 . . . . 71.41 109.321 178.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 29.3 m -126.26 138.5 54.43 Favored 'Isoleucine or valine' 0 C--O 1.243 0.738 0 C-N-CA 124.275 1.03 . . . . 73.34 108.589 173.618 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 58.9 ttt180 -103.09 109.43 20.99 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 107.775 -1.195 . . . . 74.31 107.775 169.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 34.0 mt -96.05 102.33 13.4 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 N-CA-C 106.791 -1.559 . . . . 65.34 106.791 173.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.3 m -100.68 102.77 13.96 Favored 'General case' 0 C--O 1.24 0.593 0 N-CA-C 107.597 -1.26 . . . . 75.41 107.597 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.449 HD12 HD22 ' A' ' 41' ' ' LEU . 72.2 mt -102.75 118.62 49.94 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 C-N-CA 123.343 0.657 . . . . 74.44 109.279 -178.136 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 51.9 mtm180 -108.5 118.84 37.83 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 108.55 -0.907 . . . . 74.23 108.55 175.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 7.2 p -92.82 138.25 20.49 Favored 'Isoleucine or valine' 0 C--O 1.242 0.679 0 N-CA-C 108.063 -1.088 . . . . 74.33 108.063 177.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.407 ' HB2' ' H ' ' A' ' 7' ' ' GLU . 10.3 mmpt? -80.12 110.1 15.21 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 107.355 -1.35 . . . . 75.22 107.355 174.134 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 55.6 m80 -75.98 142.65 41.88 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 115.342 -0.844 . . . . 74.11 109.125 -176.192 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.434 ' H ' ' HG2' ' A' ' 73' ' ' GLU . 32.0 m -52.15 -40.46 61.44 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.627 1.171 . . . . 71.41 113.641 -170.627 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -169.28 164.88 10.93 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.155 0.982 . . . . 73.15 108.732 -174.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -74.92 -26.19 59.45 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 112.697 0.629 . . . . 74.44 112.697 -178.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.69 -40.51 25.29 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 109.587 -0.523 . . . . 75.33 109.587 171.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -70.01 -17.58 63.28 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 115.436 -0.802 . . . . 73.14 111.658 175.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -49.72 -44.06 48.12 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 125.472 1.509 . . . . 75.05 112.284 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 24.5 mtpp -61.8 -37.24 83.65 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 114.623 -1.171 . . . . 73.2 111.357 -178.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.482 ' HE3' ' HA ' ' A' ' 72' ' ' LYS . 0.9 OUTLIER -83.65 -39.59 20.06 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 115.474 -0.784 . . . . 71.14 111.206 178.104 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.434 ' HG2' ' H ' ' A' ' 65' ' ' SER . 16.4 tp10 -76.65 -44.4 34.1 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.851 0.861 . . . . 74.44 111.18 -161.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.02 -48.87 74.63 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 123.928 0.767 . . . . 71.11 110.685 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 49.6 tptt -61.44 -43.81 98.21 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.291 1.037 . . . . 71.34 111.584 -179.318 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.9 tmmm? -64.18 -50.86 66.45 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 124.522 1.129 . . . . 72.21 110.137 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -75.21 -24.2 57.71 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 115.445 -0.798 . . . . 74.32 111.023 -171.314 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.72 -42.71 99.79 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.613 0.765 . . . . 74.21 110.769 174.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.28 -37.11 84.68 Favored 'General case' 0 CA--C 1.547 0.865 0 CA-C-N 115.227 -0.897 . . . . 72.21 111.214 177.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.479 HG22 ' HG2' ' A' ' 34' ' ' LYS . 48.2 mm -63.16 -47.12 93.92 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 C-N-CA 124.055 0.942 . . . . 74.54 110.728 177.197 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.665 HD11 HG11 ' A' ' 102' ' ' VAL . 56.1 mt -64.37 -46.2 84.41 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.862 0.865 . . . . 75.5 111.253 -177.178 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -59.59 -32.97 70.88 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.851 0.86 . . . . 75.3 109.907 -174.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -69.15 -48.01 63.46 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.324 0.65 . . . . 73.22 111.222 174.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 77.5 t -64.97 -44.86 96.02 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 C-N-CA 123.03 0.532 . . . . 54.04 111.371 -172.318 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 33.9 m-85 -61.29 -37.32 82.76 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.189 0.596 . . . . 75.43 110.942 175.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.53 -30.64 70.35 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.453 0.701 . . . . 75.53 111.437 175.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -81.18 -2.25 47.88 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.214 1.006 . . . . 75.23 111.138 178.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.7 mt -104.94 -24.56 12.82 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.924 0.89 . . . . 74.23 109.772 173.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 128.15 -17.15 5.98 Favored Glycine 0 C--N 1.346 1.118 0 CA-C-O 119.421 -0.655 . . . . 61.43 113.109 178.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -61.05 138.06 58.21 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-N 117.266 0.533 . . . . 75.54 110.422 178.222 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . 0.436 ' N ' HD21 ' A' ' 91' ' ' ASN . 0.7 OUTLIER -81.01 169.25 17.74 Favored 'General case' 0 C--O 1.243 0.756 0 C-N-CA 123.26 0.624 . . . . 75.13 109.525 176.359 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -61.94 -37.16 83.65 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.009 0.524 . . . . 70.24 111.448 -178.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 40.4 p -63.54 -25.41 68.24 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.367 1.067 . . . . 73.31 113.083 179.203 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . 0.437 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 12.7 m120 -63.56 -39.92 95.64 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 122.687 0.395 . . . . 70.43 110.251 172.548 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 36.3 t -83.74 102.58 9.9 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.93 0 C-N-CA 124.352 1.061 . . . . 75.22 109.8 -171.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' THR . . . . . 0.41 ' O ' ' HA ' ' A' ' 102' ' ' VAL . 5.9 m -111.21 152.86 26.61 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.683 0.793 . . . . 62.33 109.079 -179.258 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 20.6 m95 -128.6 115.7 18.48 Favored 'General case' 0 N--CA 1.484 1.243 0 CA-C-N 118.335 0.516 . . . . 75.2 109.777 176.02 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -157.77 126.78 5.75 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.426 1.09 . . . . 72.31 110.131 -174.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 62.48 46.75 93.15 Favored Glycine 0 C--N 1.352 1.47 0 C-N-CA 123.049 0.356 . . . . 72.42 112.981 179.024 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 59.08 9.3 1.24 Allowed 'General case' 0 N--CA 1.503 2.198 0 C-N-CA 126.632 1.973 . . . . 73.4 113.243 -176.575 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 33.0 m -109.27 145.12 36.46 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.637 1.175 . . . . 73.22 109.199 -174.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . 0.665 HG11 HD11 ' A' ' 81' ' ' LEU . 6.0 p -97.89 108.85 22.51 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.852 0 N-CA-C 107.961 -1.126 . . . . 64.31 107.961 166.006 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 80.0 m -92.64 100.93 13.35 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 108.564 -0.902 . . . . 74.53 108.564 179.205 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.437 ' HA ' ' O ' ' A' ' 94' ' ' ASN . 52.3 t -95.29 108.43 20.92 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 N-CA-C 107.483 -1.303 . . . . 75.23 107.483 175.345 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -119.06 129.47 55.11 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 107.644 -1.243 . . . . 75.42 107.644 179.594 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -160.71 -164.88 16.43 Favored Glycine 0 C--O 1.241 0.54 0 N-CA-C 111.344 -0.702 . . . . 73.44 111.344 -178.529 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 . . . . . 0 C--O 1.243 0.751 0 C-N-CA 123.064 0.546 . . . . 75.42 110.049 177.986 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.465 ' HE3' ' HA ' ' A' ' 4' ' ' LYS . 0.8 OUTLIER . . . . . 0 CA--C 1.544 0.729 0 N-CA-C 110.305 -0.258 . . . . 72.12 110.305 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -97.84 139.81 33.14 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 108.434 -0.95 . . . . 74.13 108.434 168.749 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 5.6 p -143.05 146.68 21.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 123.547 0.739 . . . . 75.45 109.919 177.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.512 ' HG3' ' HG3' ' A' ' 24' ' ' GLN . 3.4 mp0 -106.19 117.85 35.1 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 107.917 -1.142 . . . . 70.22 107.917 174.517 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.547 HG23 HG22 ' A' ' 62' ' ' VAL . 95.0 t -104.48 127.92 58.45 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 124.324 1.05 . . . . 74.13 108.757 -176.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.42 ' O ' ' HA ' ' A' ' 60' ' ' ILE . 45.7 mt-30 -111.1 101.88 10.38 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 109.198 -0.668 . . . . 70.14 109.198 176.126 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 88.0 t -93.84 112.07 26.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 N-CA-C 108.466 -0.939 . . . . 71.03 108.466 -179.533 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.444 ' O ' ' HA ' ' A' ' 58' ' ' ILE . 39.6 ttmt -106.48 104.4 14.08 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 108.455 -0.943 . . . . 74.12 108.455 179.548 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 14.9 tt -116.49 116.91 53.73 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 CA-C-O 121.381 0.61 . . . . 74.54 109.813 -178.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 50.7 m -104.81 135.79 45.53 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 123.372 0.669 . . . . 73.23 111.122 -175.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 39.8 t -163.32 141.21 7.78 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.179 0.992 . . . . 75.35 111.339 174.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.447 ' ND2' ' HB3' ' A' ' 51' ' ' LEU . 91.9 m-20 60.49 32.24 20.46 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 125.279 1.432 . . . . 72.14 112.74 171.885 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 87.97 -1.98 85.33 Favored Glycine 0 C--N 1.345 1.056 0 CA-C-N 115.974 -0.557 . . . . 74.13 113.837 177.084 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 24.4 mmmt -115.21 147.63 40.09 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.243 0.617 . . . . 75.13 110.392 178.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 53.2 m -116.15 130.46 56.81 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 124.102 0.961 . . . . 74.25 108.731 175.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.509 ' HH ' HD12 ' A' ' 51' ' ' LEU . 79.1 m-85 -114.76 100.36 8.18 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 108.407 -0.96 . . . . 72.33 108.407 -179.518 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -127.84 142.05 51.39 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.108 0.563 . . . . 74.43 110.254 -177.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.431 ' HB3' ' HH ' ' A' ' 23' ' ' TYR . 23.3 tpt180 -159.4 145.27 16.14 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 115.87 -0.605 . . . . 73.41 109.939 -173.243 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 22.6 m -98.33 109.08 21.89 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 124.307 1.043 . . . . 74.52 109.706 178.028 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.431 ' HH ' ' HB3' ' A' ' 21' ' ' ARG . 5.8 m-85 -100.83 137.87 38.64 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.555 1.142 . . . . 74.53 108.67 -179.107 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.512 ' HG3' ' HG3' ' A' ' 7' ' ' GLU . 27.0 mp0 -103.59 108.23 19.42 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 108.349 -0.982 . . . . 74.41 108.349 178.457 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 80.4 mt -112.07 99.29 7.96 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.335 1.054 . . . . 72.52 109.637 -174.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 89.1 t80 -92.93 135.55 34.04 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 108.88 -0.785 . . . . 64.52 108.88 169.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.528 ' HB2' ' HB2' ' A' ' 32' ' ' GLU . . . -141.03 150.22 42.72 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.989 0.916 . . . . 74.21 109.467 179.718 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.0 t -80.87 -38.92 17.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-O 121.263 0.554 . . . . 75.14 110.338 175.285 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.528 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 52.2 mtt180 -119.92 163.34 17.71 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.279 0.631 . . . . 74.45 110.174 175.386 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.408 ' HB2' HD11 ' A' ' 80' ' ' ILE . 7.3 p-10 -65.18 -34.57 78.69 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 115.253 -0.885 . . . . 52.44 109.919 170.869 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.506 ' HA ' ' HD3' ' A' ' 34' ' ' LYS . 25.4 mm-40 -56.99 -39.66 75.08 Favored 'General case' 0 C--N 1.359 1.015 0 C-N-CA 124.297 1.039 . . . . 74.24 111.573 173.255 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.528 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 29.9 mm-40 -68.04 -40.85 82.76 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 116.005 -0.543 . . . . 74.22 110.274 178.599 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.49 -33.92 76.64 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.637 0.775 . . . . 74.41 110.368 -179.305 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.506 ' HD3' ' HA ' ' A' ' 31' ' ' GLU . 59.6 mtpt -59.43 -51.79 68.4 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.629 0.772 . . . . 72.42 112.21 -178.649 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.513 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 1.2 pp20? -67.86 -28.04 67.19 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-O 119.467 -0.301 . . . . 63.02 111.33 179.659 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -64.89 -40.99 95.96 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.137 0.575 . . . . 75.04 111.054 174.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.471 HD12 HD23 ' A' ' 81' ' ' LEU . 70.3 mt -61.18 -44.17 97.72 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 123.747 0.655 . . . . 74.14 110.729 173.736 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -61.23 -39.35 89.95 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 122.834 0.453 . . . . 72.4 111.474 176.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.513 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 33.7 mmtp -61.39 -54.42 43.9 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.45 0.7 . . . . 74.04 110.691 176.828 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 47.1 t -58.43 -51.52 70.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 124.549 1.139 . . . . 71.5 112.169 -177.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 70.3 mt -65.72 -48.79 70.79 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 124.054 0.846 . . . . 70.42 111.384 -174.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 31.0 t-20 -60.79 -46.52 90.19 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.256 0.622 . . . . 72.42 110.419 -178.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -60.7 -43.87 97.25 Favored 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 123.622 0.769 . . . . 75.2 112.177 177.371 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 17.1 tpp180 -66.45 -24.89 66.51 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 123.504 0.722 . . . . 75.0 111.298 -178.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.485 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 65.3 mtp -85.43 -14.03 47.43 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-O 118.205 -0.902 . . . . 65.23 112.877 176.774 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.471 ' HA ' ' HD2' ' A' ' 49' ' ' LYS . 0.8 OUTLIER -60.34 -43.98 94.73 Favored Pre-proline 0 N--CA 1.503 2.21 0 CA-C-N 119.861 1.209 . . . . 73.33 113.42 -179.746 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.459 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 12.3 Cg_endo -56.71 -37.19 98.35 Favored 'Trans proline' 0 C--N 1.394 2.956 0 C-N-CA 121.715 1.61 . . . . 73.44 111.802 167.556 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.426 HG23 ' SG ' ' A' ' 53' ' ' CYS . 35.1 mm -72.78 -29.2 29.09 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.211 0 C-N-CA 124.77 1.228 . . . . 75.35 110.844 -174.06 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.485 ' HG3' ' O ' ' A' ' 45' ' ' MET . 80.9 mttt -75.1 -39.25 60.82 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.288 0.635 . . . . 75.4 109.681 179.401 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.6 ttpm? -69.44 -26.05 64.41 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 115.185 -0.916 . . . . 73.35 111.233 173.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.509 HD12 ' HH ' ' A' ' 19' ' ' TYR . 69.8 mt -72.3 -32.48 66.62 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 109.311 -0.626 . . . . 75.53 109.311 171.839 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 82.59 38.31 12.45 Favored Glycine 0 C--N 1.348 1.212 0 CA-C-N 115.897 -0.592 . . . . 73.44 112.297 178.497 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.426 ' SG ' HG23 ' A' ' 48' ' ' ILE . 33.1 m -73.51 118.98 17.11 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.563 0.745 . . . . 74.21 110.541 -179.076 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.495 ' HZ1' ' HB2' ' A' ' 54' ' ' LYS . 0.2 OUTLIER -65.95 -55.47 16.66 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 122.909 0.484 . . . . 72.12 110.349 177.417 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.1 ttm180 -121.51 144.57 48.64 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.984 0.913 . . . . 75.2 109.05 178.479 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 35.2 m -125.78 145.0 33.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 124.191 0.996 . . . . 75.52 109.326 179.165 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 38.6 ttm180 -109.37 109.61 20.53 Favored 'General case' 0 C--O 1.238 0.5 0 N-CA-C 107.948 -1.13 . . . . 74.53 107.948 173.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.444 ' HA ' ' O ' ' A' ' 11' ' ' LYS . 36.6 mt -105.95 134.85 46.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 C-N-CA 123.82 0.848 . . . . 70.13 108.933 179.329 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 50.9 m -129.35 106.97 9.15 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 107.45 -1.315 . . . . 72.52 107.45 173.372 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.465 ' HB ' HG12 ' A' ' 102' ' ' VAL . 76.3 mt -98.88 122.21 50.33 Favored 'Isoleucine or valine' 0 C--O 1.24 0.563 0 C-N-CA 123.513 0.725 . . . . 75.51 110.066 -177.784 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -104.28 103.4 13.15 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 107.078 -1.453 . . . . 75.32 107.078 172.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.547 HG22 HG23 ' A' ' 8' ' ' VAL . 6.7 p -95.98 146.09 7.63 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 N-CA-C 108.776 -0.824 . . . . 74.33 108.776 -177.774 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.425 ' HG3' ' HB2' ' A' ' 7' ' ' GLU . 12.7 mmmm -81.35 109.26 15.68 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.123 0.487 . . . . 71.15 110.236 177.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . 0.43 ' HB3' ' HA ' ' A' ' 70' ' ' GLU . 53.4 m-70 -80.88 111.66 17.55 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 107.501 -1.296 . . . . 74.41 107.501 178.592 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 38.8 t -20.29 -68.35 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 C-N-CA 127.249 2.22 . . . . 54.4 115.281 -166.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.496 ' H ' ' HB2' ' A' ' 69' ' ' GLU . 6.6 m-20 -137.1 173.17 11.98 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 108.057 -1.09 . . . . 74.44 108.057 174.81 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.8 -41.91 97.81 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.431 0.693 . . . . 75.22 111.479 -173.682 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -73.57 -26.87 61.02 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.097 0.559 . . . . 72.0 111.372 176.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.496 ' HB2' ' H ' ' A' ' 66' ' ' ASP . 18.4 mm-40 -74.97 -27.55 60.21 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-O 118.697 -0.668 . . . . 72.23 111.707 179.74 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.43 ' HA ' ' HB3' ' A' ' 64' ' ' HIS . 48.5 mt-10 -46.98 -40.03 13.63 Favored 'General case' 0 N--CA 1.498 1.959 0 N-CA-C 114.449 1.277 . . . . 75.14 114.449 -166.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 58.2 mttp -65.99 -58.21 6.05 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.23 0.612 . . . . 74.34 111.088 -176.65 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.9 tptt -66.19 -35.71 81.17 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.192 0.997 . . . . 73.33 111.048 -178.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -64.61 -48.02 76.43 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.433 1.093 . . . . 71.33 109.438 -179.371 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.48 -39.84 92.41 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 124.129 0.893 . . . . 45.22 111.631 -177.233 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -62.01 -43.64 98.4 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.495 0.718 . . . . 73.03 110.949 175.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.16 -44.55 83.76 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 124.109 0.964 . . . . 74.35 110.351 178.394 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -76.15 -20.27 57.73 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 115.55 -0.75 . . . . 74.11 110.523 -174.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.83 -43.07 94.29 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.344 0.657 . . . . 72.53 109.915 171.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.4 -41.03 85.6 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 123.439 0.696 . . . . 70.34 111.092 176.392 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.408 HD11 ' HB2' ' A' ' 30' ' ' ASP . 31.8 mm -57.71 -53.45 44.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 124.514 1.126 . . . . 71.4 110.914 177.125 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.471 HD23 HD12 ' A' ' 37' ' ' LEU . 43.8 mt -69.24 -33.25 72.99 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.779 0.832 . . . . 63.41 112.294 -178.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 62.3 t30 -59.32 -38.22 79.75 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.318 0.647 . . . . 65.24 110.394 -178.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -71.11 -46.08 62.4 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 114.575 -1.193 . . . . 75.45 111.756 175.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 54.6 t -62.34 -54.33 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 C-N-CA 123.949 0.9 . . . . 75.23 110.801 -173.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.55 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 22.2 m-85 -59.5 -37.08 77.34 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 115.017 -0.992 . . . . 72.44 111.93 -179.609 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.69 -26.64 67.12 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.306 0.643 . . . . 74.3 112.015 179.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -85.85 -12.76 49.94 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.023 0.929 . . . . 72.33 110.683 177.582 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.7 mt -107.21 0.51 23.32 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.608 0.763 . . . . 74.33 111.751 -174.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 103.18 -7.13 51.51 Favored Glycine 0 C--N 1.345 1.061 0 N-CA-C 114.252 0.461 . . . . 71.24 114.252 176.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.55 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 46.6 m-85 -84.44 131.82 34.63 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.469 0.708 . . . . 74.12 110.059 178.389 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -116.44 -166.06 1.12 Allowed 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 124.509 1.124 . . . . 63.54 109.874 -177.479 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -50.65 -51.13 51.94 Favored 'General case' 0 N--CA 1.492 1.668 0 C-N-CA 124.024 0.929 . . . . 72.51 112.278 -179.216 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 20.1 m -63.17 -17.69 62.66 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 124.205 1.002 . . . . 74.23 112.838 -176.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . 0.422 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 18.4 m120 -94.12 -38.98 10.82 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.511 0.725 . . . . 72.34 110.827 -175.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 42.1 t -89.82 127.32 42.5 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 122.708 0.403 . . . . 74.22 109.98 -176.154 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 27.1 m -145.74 113.68 6.49 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.314 0.646 . . . . 75.2 109.862 178.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 68.2 m95 -82.07 142.34 32.39 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 122.778 0.431 . . . . 73.44 110.411 174.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -144.22 94.62 2.6 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.344 1.057 . . . . 73.31 108.93 -177.039 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 67.5 -92.98 0.23 Allowed Glycine 0 C--N 1.348 1.204 0 CA-C-N 115.531 -0.758 . . . . 74.32 113.686 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -114.72 -19.45 11.05 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.348 1.059 . . . . 74.25 110.395 -175.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 89.0 m -100.14 149.65 23.3 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.998 1.319 . . . . 72.45 110.541 -177.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . 0.465 HG12 ' HB ' ' A' ' 60' ' ' ILE . 3.3 p -110.99 113.39 44.14 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 N-CA-C 108.523 -0.917 . . . . 75.2 108.523 169.863 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 48.7 m -100.54 111.19 23.41 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 108.957 -0.757 . . . . 72.31 108.957 178.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.422 ' HA ' ' O ' ' A' ' 94' ' ' ASN . 86.1 t -110.37 109.93 30.29 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 N-CA-C 109.297 -0.631 . . . . 64.43 109.297 177.419 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -110.46 111.49 22.78 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 107.463 -1.31 . . . . 73.43 107.463 177.059 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -157.85 172.87 35.12 Favored Glycine 0 C--N 1.342 0.903 0 C-N-CA 121.802 -0.237 . . . . 70.53 112.718 -174.405 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 . . . . . 0 C--O 1.241 0.651 0 CA-C-O 121.906 0.86 . . . . 73.42 112.142 -172.591 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.24 0.603 0 CA-C-O 121.247 0.546 . . . . 74.22 110.218 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.497 ' HZ1' ' HB3' ' A' ' 5' ' ' LYS . 4.7 ttpm? -98.05 113.32 25.15 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 107.884 -1.154 . . . . 73.12 107.884 170.052 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -100.42 127.74 53.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 N-CA-C 107.396 -1.335 . . . . 63.41 107.396 172.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -102.34 113.76 27.35 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 108.303 -0.999 . . . . 74.41 108.303 177.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 75.0 t -95.05 106.14 17.83 Favored 'Isoleucine or valine' 0 C--O 1.239 0.522 0 C-N-CA 125.147 1.379 . . . . 74.24 108.606 -174.274 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.504 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 65.5 mt-30 -99.84 98.84 9.59 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 108.373 -0.973 . . . . 52.51 108.373 -172.51 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.416 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 57.3 t -93.67 107.37 19.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 N-CA-C 108.919 -0.771 . . . . 73.44 108.919 -173.609 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.417 ' HG3' ' HB3' ' A' ' 20' ' ' GLU . 40.1 ttmt -106.19 101.65 11.11 Favored 'General case' 0 C--N 1.346 0.416 0 N-CA-C 107.817 -1.179 . . . . 75.23 107.817 178.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.491 ' HA ' ' O ' ' A' ' 57' ' ' ARG . 14.6 tt -119.09 122.08 68.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 122.965 0.506 . . . . 73.45 110.301 -174.062 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 30.0 m -90.33 123.16 33.86 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 109.178 -0.675 . . . . 75.31 109.178 178.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.627 ' SG ' HG21 ' A' ' 48' ' ' ILE . 16.2 t -156.66 126.27 6.23 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.142 0.977 . . . . 74.35 109.01 -173.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.492 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 6.3 t-20 66.33 25.22 10.45 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 125.218 1.407 . . . . 74.4 110.975 175.569 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.19 1.51 86.34 Favored Glycine 0 C--N 1.352 1.443 0 CA-C-N 115.585 -0.734 . . . . 72.22 113.843 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm -109.85 153.07 24.95 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.937 0.895 . . . . 75.13 110.023 -179.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 28.0 m -113.26 107.5 15.98 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.266 0.627 . . . . 73.54 109.415 -179.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -100.89 99.2 9.65 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 107.586 -1.265 . . . . 72.54 107.586 -175.135 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.417 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 8.4 pt-20 -115.4 122.61 46.34 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 109.578 -0.527 . . . . 73.1 109.578 -179.533 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.5 tpm_? -140.76 127.36 20.18 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.554 -0.748 . . . . 71.44 110.243 -169.699 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 27.3 m -86.67 111.35 20.59 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 123.661 0.784 . . . . 73.54 109.891 176.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -97.66 119.81 36.9 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.724 0.81 . . . . 74.22 109.374 177.29 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 26.8 mp0 -86.69 109.26 19.08 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 108.135 -1.061 . . . . 74.41 108.135 -179.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.463 HD11 HG23 ' A' ' 40' ' ' VAL . 86.1 mt -120.26 132.58 55.39 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.922 0.889 . . . . 74.2 109.286 -178.069 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 39.8 t80 -126.4 135.97 52.09 Favored 'General case' 0 C--O 1.24 0.577 0 N-CA-C 108.673 -0.862 . . . . 72.0 108.673 177.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.449 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -156.15 152.55 28.04 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.245 0.618 . . . . 70.34 109.439 173.157 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 95.8 t -67.99 -60.05 2.99 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 O-C-N 124.158 0.911 . . . . 65.3 109.294 174.031 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.56 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 97.4 mtt180 -96.57 162.87 13.27 Favored 'General case' 0 C--O 1.242 0.665 0 CA-C-O 121.837 0.827 . . . . 74.41 111.61 -178.267 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 18.2 p-10 -67.29 -37.16 82.95 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 113.598 -1.637 . . . . 65.14 111.055 174.057 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -67.68 -31.83 72.08 Favored 'General case' 0 C--N 1.353 0.747 0 C-N-CA 124.244 1.017 . . . . 71.25 111.58 -175.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.56 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 26.1 mm-40 -66.4 -35.63 80.8 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.861 -0.609 . . . . 74.23 109.926 177.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.86 -25.85 63.92 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 123.893 0.877 . . . . 74.41 110.784 -176.243 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.456 ' HG2' HG21 ' A' ' 80' ' ' ILE . 53.2 mtmt -55.19 -62.13 1.87 Allowed 'General case' 0 C--N 1.365 1.28 0 C-N-CA 122.944 0.498 . . . . 75.54 111.556 -178.71 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.531 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 3.1 pp20? -61.29 -29.99 70.21 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 115.979 -0.555 . . . . 73.04 111.857 -176.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 56.4 mttm -67.08 -43.38 82.75 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.231 0.612 . . . . 75.52 110.423 177.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.49 HD13 HD21 ' A' ' 81' ' ' LEU . 88.8 mt -59.7 -40.55 88.27 Favored 'General case' 0 N--CA 1.474 0.746 0 O-C-N 123.989 0.806 . . . . 74.22 110.496 176.269 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -58.91 -46.51 87.73 Favored 'General case' 0 C--N 1.359 0.995 0 C-N-CA 123.025 0.53 . . . . 74.25 110.971 175.65 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.531 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 14.2 mmmm -60.58 -52.0 67.02 Favored 'General case' 0 N--CA 1.48 1.046 0 O-C-N 123.586 0.554 . . . . 75.44 110.04 179.183 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.463 HG23 HD11 ' A' ' 25' ' ' LEU . 46.5 t -55.16 -42.87 67.84 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 125.127 1.371 . . . . 70.24 111.996 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 67.0 mt -71.95 -36.64 69.93 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 122.869 0.468 . . . . 73.51 110.611 -179.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.3 m-80 -65.52 -30.95 71.77 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 122.78 0.432 . . . . 74.12 111.643 173.182 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.442 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 13.6 mm-40 -75.18 -54.54 6.94 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 122.501 0.32 . . . . 64.25 110.624 179.158 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.7 tpp180 -66.58 -36.38 82.5 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.29 0.636 . . . . 73.31 111.113 -175.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.497 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 69.9 mtp -86.41 -10.8 53.54 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 118.728 -0.653 . . . . 75.02 112.613 -178.159 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.528 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 22.4 t70 -58.79 -53.22 68.57 Favored Pre-proline 0 CA--C 1.564 1.49 0 CA-C-O 118.41 -0.805 . . . . 73.53 111.479 178.705 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -61.59 -29.67 84.65 Favored 'Trans proline' 0 C--N 1.395 2.988 0 C-N-CA 121.877 1.718 . . . . 75.21 111.912 174.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.627 HG21 ' SG ' ' A' ' 14' ' ' CYS . 49.4 mm -70.25 -34.0 56.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 123.893 0.877 . . . . 73.02 110.804 -173.158 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.528 ' HE2' ' HA ' ' A' ' 46' ' ' ASP . 45.6 mtmt -71.01 -38.97 72.64 Favored 'General case' 0 C--N 1.353 0.722 0 N-CA-C 109.667 -0.494 . . . . 75.02 109.667 178.195 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.1 tmmt? -73.85 -26.05 60.38 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 116.046 -0.524 . . . . 74.31 110.34 177.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.6 mt -70.9 -27.79 64.06 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 108.726 -0.842 . . . . 74.02 108.726 170.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 69.43 37.73 79.45 Favored Glycine 0 C--N 1.353 1.473 0 O-C-N 124.275 0.985 . . . . 70.32 112.933 172.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.492 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 71.4 m -70.74 111.25 6.06 Favored 'General case' 0 C--O 1.241 0.635 0 O-C-N 124.282 0.637 . . . . 55.1 109.917 177.881 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -58.01 -55.01 40.41 Favored 'General case' 0 C--O 1.215 -0.746 0 O-C-N 124.804 1.315 . . . . 75.54 110.465 -173.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 73.9 ttt180 -108.62 136.06 48.83 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 108.641 -0.874 . . . . 73.31 108.641 172.207 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 30.1 m -124.75 139.76 49.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 123.546 0.739 . . . . 73.24 109.623 175.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.491 ' O ' ' HA ' ' A' ' 12' ' ' ILE . 48.8 ttt180 -109.05 106.92 17.05 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 108.569 -0.9 . . . . 73.3 108.569 171.654 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 41.9 mt -102.31 106.16 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 N-CA-C 108.383 -0.969 . . . . 74.4 108.383 -179.67 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 17.5 m -109.22 102.5 11.44 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 107.963 -1.125 . . . . 72.24 107.963 -177.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 71.2 mt -99.67 113.83 36.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 123.496 0.718 . . . . 74.42 109.884 -174.261 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.504 ' HB2' ' HB2' ' A' ' 9' ' ' GLN . 58.5 mtm180 -98.96 122.72 42.59 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 107.705 -1.22 . . . . 75.22 107.705 -179.042 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.2 p -93.59 129.01 44.6 Favored 'Isoleucine or valine' 0 C--O 1.242 0.673 0 N-CA-C 108.932 -0.766 . . . . 61.45 108.932 -177.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.3 tmtt? -97.1 121.97 39.58 Favored 'General case' 0 C--O 1.239 0.532 0 N-CA-C 107.524 -1.287 . . . . 72.41 107.524 176.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 5.9 p80 -113.12 131.51 55.81 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.765 1.226 . . . . 75.43 109.369 -179.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 16.9 m -89.32 -59.22 2.27 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.611 0.765 . . . . 73.32 111.227 -173.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -87.53 131.81 34.25 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 116.276 -0.42 . . . . 74.41 110.244 -175.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -75.3 -24.27 57.45 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 123.653 0.781 . . . . 50.24 112.815 -173.223 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -81.33 -40.19 23.96 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 122.918 0.487 . . . . 63.41 110.417 178.356 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 -68.81 -49.19 60.55 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.017 0.527 . . . . 75.2 111.983 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -49.84 -30.02 9.09 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 124.911 1.382 . . . . 73.23 114.692 -166.07 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.541 ' HZ1' ' HB3' ' A' ' 71' ' ' LYS . 7.9 ttpm? -64.96 -48.26 74.67 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.018 0.927 . . . . 53.35 110.725 -176.322 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.484 ' HZ3' ' HB2' ' A' ' 72' ' ' LYS . 4.6 ttmp? -79.39 -40.98 28.78 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.123 0.569 . . . . 64.12 110.26 173.619 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -63.15 -37.97 89.32 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.321 1.049 . . . . 73.53 111.524 -166.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.71 -36.78 62.72 Favored 'General case' 0 C--N 1.356 0.871 0 C-N-CA 123.494 0.718 . . . . 70.32 111.623 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -66.41 -36.83 83.81 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 122.997 0.519 . . . . 73.22 111.179 174.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.44 ' O ' HG12 ' A' ' 80' ' ' ILE . 79.3 tttt -76.19 -31.71 58.61 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.719 -0.673 . . . . 72.12 109.456 177.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -75.96 -21.97 56.43 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.811 0.845 . . . . 71.05 109.605 176.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.37 -40.3 93.37 Favored 'General case' 0 C--N 1.35 0.615 0 C-N-CA 123.574 0.75 . . . . 72.03 109.757 172.137 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.94 -43.25 93.32 Favored 'General case' 0 C--N 1.351 0.632 0 O-C-N 123.969 0.793 . . . . 63.05 110.38 174.138 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.456 HG21 ' HG2' ' A' ' 34' ' ' LYS . 29.3 mm -62.4 -46.27 96.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 124.306 1.042 . . . . 73.12 111.267 -179.396 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.52 HD13 HG11 ' A' ' 102' ' ' VAL . 39.2 mt -63.05 -46.9 85.31 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.839 0.856 . . . . 74.03 110.013 178.606 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -62.47 -36.94 84.05 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 123.999 0.812 . . . . 74.51 109.819 -175.022 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.423 ' O ' ' HG2' ' A' ' 87' ' ' GLU . 30.2 mmmt -65.54 -41.63 92.83 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 122.902 0.481 . . . . 73.21 111.115 175.916 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.421 HG22 ' O ' ' A' ' 80' ' ' ILE . 53.6 t -65.69 -43.16 93.78 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 123.428 0.691 . . . . 72.21 110.919 -178.453 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.447 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 26.4 m-85 -60.31 -41.62 93.83 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 115.308 -0.86 . . . . 74.15 109.808 175.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.75 -31.75 73.11 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.588 0.755 . . . . 44.03 111.711 177.275 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.423 ' HG2' ' O ' ' A' ' 83' ' ' LYS . 23.5 mm-40 -76.2 -19.6 58.26 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.65 0.78 . . . . 73.05 111.336 178.819 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 78.5 mt -109.32 14.32 23.78 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.551 0.74 . . . . 75.04 110.999 -177.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 81.17 28.5 44.71 Favored Glycine 0 C--N 1.35 1.356 0 N-CA-C 114.488 0.555 . . . . 63.03 114.488 171.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.579 ' HB3' HD22 ' A' ' 94' ' ' ASN . 13.7 m-85 -111.04 146.7 36.26 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 107.856 -1.164 . . . . 72.33 107.856 171.744 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -101.18 172.11 7.21 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.064 0.546 . . . . 72.35 111.402 -178.115 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -65.64 -36.93 85.1 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.372 1.069 . . . . 70.53 111.594 -173.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 18.3 m -62.51 -36.01 81.2 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 124.029 0.931 . . . . 61.52 112.776 -175.527 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ASN . . . . . 0.579 HD22 ' HB3' ' A' ' 90' ' ' TYR . 2.1 p-10 -86.08 -0.53 55.84 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 111.936 0.347 . . . . 64.11 111.936 178.124 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.533 ' HA ' HG23 ' A' ' 104' ' ' VAL . 57.9 t -101.07 106.59 19.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 N-CA-C 107.908 -1.145 . . . . 74.1 107.908 174.789 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 26.2 m -136.74 133.41 36.01 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.195 0.598 . . . . 74.23 109.622 -175.18 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 40.5 m95 -87.77 152.91 21.76 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-O 121.703 0.763 . . . . 74.22 111.826 -179.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -149.89 79.2 1.37 Allowed 'General case' 0 C--O 1.242 0.688 0 C-N-CA 126.254 1.821 . . . . 74.11 106.57 -175.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 72.99 -117.38 5.96 Favored Glycine 0 CA--C 1.531 1.091 0 CA-C-N 115.149 -0.932 . . . . 74.31 112.173 -173.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -97.43 11.16 37.68 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.764 0.825 . . . . 75.41 110.912 175.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 61.6 m -119.58 125.87 49.83 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.663 0.785 . . . . 62.12 109.976 -178.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . 0.52 HG11 HD13 ' A' ' 81' ' ' LEU . 8.9 p -96.02 116.78 38.72 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.763 0 N-CA-C 107.866 -1.161 . . . . 65.11 107.866 170.879 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 4.3 m -99.64 108.14 20.44 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 108.337 -0.986 . . . . 62.54 108.337 -177.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.533 HG13 HD21 ' A' ' 94' ' ' ASN . 83.6 t -115.12 112.28 39.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 C-N-CA 124.819 1.248 . . . . 73.54 108.549 -177.609 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . 0.413 ' HG2' ' HA ' ' A' ' 57' ' ' ARG . 28.1 mt-10 -111.22 152.23 27.35 Favored 'General case' 0 C--O 1.241 0.631 0 N-CA-C 109.484 -0.562 . . . . 73.53 109.484 177.561 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -170.39 145.87 9.41 Favored Glycine 0 N--CA 1.449 -0.436 0 CA-C-N 115.748 -0.66 . . . . 74.51 112.189 177.799 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 57.8 tt0 . . . . . 0 CA--C 1.536 0.423 0 N-CA-C 109.025 -0.731 . . . . 75.44 109.025 168.238 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.427 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.0 OUTLIER . . . . . 0 N--CA 1.485 1.276 0 CA-C-O 120.775 0.321 . . . . 73.34 110.202 . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.7 t -78.42 163.01 25.99 Favored 'General case' 0 C--O 1.245 0.827 0 CA-C-N 115.339 -0.846 . . . . 34.33 109.798 175.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.485 ' HA2' ' HA ' ' A' ' 28' ' ' VAL . . . -68.5 89.29 0.22 Allowed Glycine 0 C--N 1.343 0.97 0 N-CA-C 110.487 -1.045 . . . . 74.51 110.487 171.503 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.5 tppt? -81.59 100.71 9.55 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.013 0.525 . . . . 72.24 110.973 -171.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -84.83 93.5 8.51 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 106.792 -1.559 . . . . 74.13 106.792 169.383 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.426 HG21 HG22 ' A' ' 62' ' ' VAL . 5.9 p -106.36 152.82 7.87 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 C-N-CA 123.982 0.913 . . . . 74.11 110.395 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.418 ' OE2' ' HG3' ' A' ' 24' ' ' GLN . 11.1 mp0 -100.32 114.32 27.73 Favored 'General case' 0 C--N 1.351 0.631 0 N-CA-C 107.935 -1.135 . . . . 72.13 107.935 173.546 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.432 HG21 HG21 ' A' ' 62' ' ' VAL . 78.1 t -112.63 113.62 44.66 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 C-N-CA 124.617 1.167 . . . . 73.34 108.314 -177.424 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -101.0 108.45 20.17 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 108.906 -0.776 . . . . 75.41 108.906 -175.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 91.8 t -93.53 108.25 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 N-CA-C 108.062 -1.088 . . . . 70.3 108.062 179.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -112.72 103.47 11.5 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.269 1.028 . . . . 75.31 108.422 -174.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 11.7 tt -120.61 125.92 74.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 CA-C-O 121.337 0.589 . . . . 65.41 111.156 -171.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 19.9 m -98.34 121.38 40.2 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.974 0.909 . . . . 70.0 109.193 -177.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 5.4 t -148.06 131.78 16.94 Favored 'General case' 0 C--O 1.242 0.696 0 N-CA-C 109.579 -0.526 . . . . 72.34 109.579 179.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.648 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 2.8 t-20 78.49 -65.31 0.24 Allowed 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 125.93 1.692 . . . . 73.44 110.56 172.548 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -170.44 6.82 0.04 OUTLIER Glycine 0 N--CA 1.465 0.586 0 CA-C-N 116.474 -0.33 . . . . 63.41 112.624 172.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -119.72 154.55 33.96 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.126 0.971 . . . . 74.1 109.782 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 7.3 m -115.58 122.16 44.81 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 108.073 -1.084 . . . . 75.43 108.073 175.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -106.77 99.9 9.44 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 108.283 -1.006 . . . . 73.31 108.283 -174.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -114.77 146.1 41.36 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 121.063 0.459 . . . . 73.31 110.014 175.627 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -155.55 132.41 10.61 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 107.812 -1.181 . . . . 73.21 107.812 -176.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 51.7 m -87.47 111.25 20.96 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 109.536 -0.542 . . . . 74.35 109.536 177.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -98.71 140.66 32.58 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.48 0.712 . . . . 72.31 109.621 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.418 ' HG3' ' OE2' ' A' ' 7' ' ' GLU . 21.5 mp0 -97.21 105.91 18.14 Favored 'General case' 0 C--O 1.24 0.578 0 N-CA-C 107.151 -1.426 . . . . 73.12 107.151 174.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 45.7 mt -107.09 115.28 29.91 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 109.051 -0.722 . . . . 73.41 109.051 -179.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -107.12 123.63 48.52 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 109.21 -0.663 . . . . 75.42 109.21 177.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -145.9 122.05 10.81 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 122.738 0.415 . . . . 73.42 110.02 175.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.485 ' HA ' ' HA2' ' A' ' 3' ' ' GLY . 60.3 t -73.29 -30.86 31.96 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 C-N-CA 123.815 0.846 . . . . 62.53 109.774 171.491 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.431 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 58.4 mtt-85 -112.78 150.37 31.72 Favored 'General case' 0 CA--C 1.552 1.033 0 CA-C-N 114.96 -1.018 . . . . 74.32 110.043 -174.589 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -67.23 -44.85 78.44 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 123.939 0.896 . . . . 74.03 110.937 -178.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -61.77 -30.9 71.1 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.801 0.84 . . . . 74.52 111.633 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.431 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 35.0 mm-40 -61.7 -46.14 90.97 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 122.705 0.402 . . . . 61.14 111.293 177.142 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.7 -33.88 75.77 Favored 'General case' 0 CA--C 1.553 1.063 0 N-CA-C 109.871 -0.418 . . . . 64.3 109.871 -177.842 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -54.31 -58.2 8.3 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.131 0.572 . . . . 74.22 111.395 176.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.8 pp20? -66.91 -26.89 67.08 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 115.92 -0.582 . . . . 71.43 112.354 -177.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 40.2 mttp -71.59 -35.17 70.43 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.129 0.571 . . . . 72.24 111.048 176.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.58 HD11 HD22 ' A' ' 81' ' ' LEU . 81.5 mt -64.23 -45.31 88.77 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 123.334 0.397 . . . . 73.24 110.058 171.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.412 ' HG2' HG12 ' A' ' 84' ' ' VAL . 50.1 mtpt -58.88 -38.11 78.1 Favored 'General case' 0 C--N 1.357 0.917 0 C-N-CA 122.782 0.433 . . . . 74.32 111.086 174.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 43.3 mmtm -60.32 -62.83 1.58 Allowed 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 122.865 0.466 . . . . 72.52 110.515 175.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 93.9 t -59.7 -45.94 93.92 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 123.583 0.753 . . . . 74.21 111.695 -172.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.558 HD22 HD11 ' A' ' 60' ' ' ILE . 68.9 mt -64.95 -58.33 6.4 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.382 0.673 . . . . 74.45 111.271 -179.252 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -60.32 -38.4 83.59 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 123.357 0.663 . . . . 71.33 112.054 -176.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -67.67 -48.24 67.2 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 122.577 0.351 . . . . 74.44 111.027 178.207 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -73.55 -32.96 64.47 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 116.342 -0.39 . . . . 72.32 111.287 -172.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.42 ' HE3' ' HB3' ' A' ' 45' ' ' MET . 43.3 mtp -83.62 -11.53 57.18 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 122.972 0.509 . . . . 74.41 112.059 -177.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -61.02 -53.34 64.76 Favored Pre-proline 0 CA--C 1.564 1.484 0 CA-C-O 118.577 -0.725 . . . . 71.51 111.684 178.116 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.512 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 56.8 Cg_endo -68.47 -25.23 35.53 Favored 'Trans proline' 0 C--N 1.387 2.581 0 CA-C-N 121.169 1.453 . . . . 72.42 112.435 173.258 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 32.1 mm -63.52 -43.66 98.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 123.434 0.694 . . . . 73.32 111.398 -178.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.611 ' HA ' HD12 ' A' ' 108' ' ' LEU . 48.4 mtmt -67.12 -32.51 73.69 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 121.035 0.445 . . . . 73.13 110.098 178.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -71.57 -29.04 64.27 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.616 1.166 . . . . 74.13 111.101 176.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 86.9 mt -70.5 -33.86 71.69 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 109.312 -0.625 . . . . 73.31 109.312 175.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 89.58 119.99 1.91 Allowed Glycine 0 C--N 1.344 0.987 0 CA-C-N 115.448 -0.796 . . . . 64.43 113.315 168.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.648 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 72.3 m -153.24 156.11 37.88 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.322 1.049 . . . . 73.12 108.755 -179.33 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.414 ' HD2' ' H ' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -74.8 -37.2 62.42 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 109.152 -0.685 . . . . 74.21 109.152 171.377 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.53 ' HA ' ' H ' ' A' ' 108' ' ' LEU . 29.0 ttm180 -157.81 148.47 20.9 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 123.951 0.901 . . . . 73.33 109.102 -175.02 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 15.7 m -114.68 140.47 35.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 123.527 0.731 . . . . 73.12 109.97 177.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 45.5 ttm105 -104.96 103.36 12.91 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 108.25 -1.018 . . . . 73.34 108.25 173.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 40.5 mt -94.76 146.11 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 N-CA-C 107.886 -1.153 . . . . 74.34 107.886 178.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 28.8 m -144.15 103.37 3.99 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 106.836 -1.542 . . . . 74.31 106.836 177.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.558 HD11 HD22 ' A' ' 41' ' ' LEU . 72.7 mt -101.92 107.44 21.64 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 N-CA-C 108.827 -0.805 . . . . 71.4 108.827 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 38.1 ttp85 -97.53 121.16 39.11 Favored 'General case' 0 C--O 1.238 0.468 0 N-CA-C 108.036 -1.098 . . . . 74.02 108.036 176.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.432 HG21 HG21 ' A' ' 8' ' ' VAL . 4.1 p -94.85 140.29 17.04 Favored 'Isoleucine or valine' 0 C--O 1.243 0.744 0 N-CA-C 107.49 -1.3 . . . . 74.31 107.49 178.178 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 19.6 ttpp -81.52 136.39 35.61 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 109.262 -0.644 . . . . 73.34 109.262 178.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . 0.568 ' HE1' ' HB2' ' A' ' 100' ' ' ASP . 37.6 m80 -85.89 117.3 24.66 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 108.663 -0.865 . . . . 71.25 108.663 178.444 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 30.7 p -65.79 -62.13 1.68 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.742 0.817 . . . . 64.32 111.79 -173.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -148.29 140.39 24.07 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 107.969 -1.123 . . . . 75.42 107.969 -177.199 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -53.67 -34.53 58.99 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.939 0.895 . . . . 72.13 113.379 -172.046 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.6 -42.16 74.79 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 122.783 0.433 . . . . 62.52 111.272 178.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -74.97 -47.63 28.41 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.372 0.669 . . . . 71.11 111.494 -176.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.3 pp20? -68.16 -20.61 64.9 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 114.458 1.281 . . . . 63.01 114.458 -159.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 64.6 mttm -65.48 -42.46 92.2 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-O 121.407 0.623 . . . . 75.4 109.848 173.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -79.71 -40.79 28.15 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 114.858 -1.064 . . . . 72.34 110.566 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -74.03 -33.4 63.74 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 112.429 0.529 . . . . 75.05 112.429 -172.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.91 -35.93 64.67 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 117.795 0.271 . . . . 64.22 110.694 177.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 65.1 tttp -65.65 -39.85 91.86 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.101 0.56 . . . . 75.22 110.243 175.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 5.6 tmmm? -67.15 -40.06 86.61 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.974 0.909 . . . . 75.42 109.825 175.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -72.76 -23.72 60.86 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.788 0.835 . . . . 73.33 110.702 -175.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.56 -46.15 89.69 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 123.576 0.547 . . . . 74.2 109.913 173.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.43 ' O ' ' HG2' ' A' ' 83' ' ' LYS . . . -65.98 -40.73 91.48 Favored 'General case' 0 CA--C 1.545 0.75 0 CA-C-N 115.531 -0.759 . . . . 73.0 111.223 177.389 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 37.5 mm -56.09 -47.43 80.47 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 C-N-CA 124.287 1.035 . . . . 74.45 110.773 176.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.594 HD11 HG12 ' A' ' 102' ' ' VAL . 45.8 mt -67.09 -40.02 86.89 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.865 0.866 . . . . 75.1 111.762 -179.685 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 -60.13 -33.15 71.74 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.259 0.624 . . . . 64.4 111.433 -178.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.43 ' HG2' ' O ' ' A' ' 79' ' ' ALA . 32.9 mmtp -67.2 -49.54 64.18 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 123.697 0.623 . . . . 74.33 110.706 173.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.412 HG12 ' HG2' ' A' ' 38' ' ' LYS . 71.1 t -65.13 -49.26 80.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 123.988 0.915 . . . . 61.31 111.456 -171.273 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.485 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 26.4 m-85 -63.24 -33.71 76.08 Favored 'General case' 0 N--CA 1.477 0.902 0 O-C-N 123.582 0.552 . . . . 65.34 111.326 179.062 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -68.06 -30.06 69.18 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.104 0.562 . . . . 73.2 111.389 175.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -85.47 -13.51 48.94 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.905 0.882 . . . . 75.41 111.89 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 94.3 mt -107.49 -16.04 14.46 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 122.984 0.513 . . . . 65.03 111.385 -175.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 97.57 49.23 1.85 Allowed Glycine 0 C--N 1.345 1.079 0 CA-C-O 120.857 0.143 . . . . 63.3 113.373 176.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.485 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 40.6 m-85 -126.31 134.66 51.06 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 107.889 -1.152 . . . . 75.24 107.889 174.441 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -78.1 159.27 28.77 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.297 0.639 . . . . 73.54 111.528 -174.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -62.38 -46.06 90.32 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.859 0.864 . . . . 72.15 112.173 -175.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 63.9 p -58.53 -34.82 71.42 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 124.05 0.94 . . . . 74.23 112.16 177.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . 0.417 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 2.5 m-20 -65.19 -25.66 67.81 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 115.412 -0.813 . . . . 75.04 110.932 -179.098 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 45.4 t -91.74 114.71 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.87 0 C-N-CA 124.333 1.053 . . . . 74.01 108.897 178.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 32.9 m -144.41 129.62 18.71 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 122.879 0.472 . . . . 74.51 110.389 178.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 66.3 m95 -86.05 137.97 32.3 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.403 0.681 . . . . 72.52 110.509 177.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -169.17 123.52 0.83 Allowed 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.481 1.112 . . . . 72.0 109.245 179.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 69.76 51.97 22.34 Favored Glycine 0 C--N 1.349 1.26 0 O-C-N 123.883 0.739 . . . . 73.25 113.193 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . 0.568 ' HB2' ' HE1' ' A' ' 64' ' ' HIS . 4.4 p-10 46.67 26.09 0.5 Allowed 'General case' 0 N--CA 1.499 2.018 0 C-N-CA 126.444 1.898 . . . . 73.4 113.537 -176.359 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 50.0 m -135.54 148.01 48.99 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 125.313 1.445 . . . . 72.23 107.931 -177.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.594 HG12 HD11 ' A' ' 81' ' ' LEU . 13.4 p -103.35 121.58 54.83 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 N-CA-C 108.709 -0.849 . . . . 71.14 108.709 171.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 24.7 m -97.79 111.31 23.65 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 107.532 -1.284 . . . . 72.43 107.532 178.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.417 ' HA ' ' O ' ' A' ' 94' ' ' ASN . 55.1 t -119.35 125.0 74.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 N-CA-C 108.533 -0.914 . . . . 72.44 108.533 -178.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -107.95 153.83 22.49 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 109.578 -0.527 . . . . 73.35 109.578 174.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -148.51 136.98 6.15 Favored Glycine 0 C--O 1.238 0.368 0 N-CA-C 110.643 -0.983 . . . . 73.54 110.643 173.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 58.9 tp60 -68.35 102.34 1.38 Allowed 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 108.081 -1.081 . . . . 74.31 108.081 179.046 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.611 HD12 ' HA ' ' A' ' 49' ' ' LYS . 2.5 tm? -67.3 148.09 52.14 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.93 0.892 . . . . 62.53 109.759 -172.136 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.431 ' N ' HD13 ' A' ' 108' ' ' LEU . 31.8 tt0 74.6 -73.21 0.1 Allowed 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 124.762 1.225 . . . . 70.4 109.72 -176.139 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -82.67 67.4 3.73 Favored Glycine 0 C--N 1.346 1.136 0 N-CA-C 111.412 -0.675 . . . . 70.11 111.412 173.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 15.4 m -75.8 74.37 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.03 0 CA-C-O 121.911 0.863 . . . . 61.42 111.826 -173.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -171.82 144.6 1.8 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.783 1.233 . . . . 72.11 108.684 176.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 97.7 mt -126.33 -31.57 2.78 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.529 0.731 . . . . 74.31 109.944 173.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.403 ' HB3' ' CD2' ' A' ' 116' ' ' HIS . 47.7 mt-10 -86.1 85.66 7.36 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.655 0.782 . . . . 74.23 111.674 -174.625 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 21.2 p80 -99.43 69.33 1.66 Allowed 'General case' 0 CA--C 1.549 0.904 0 CA-C-O 121.723 0.773 . . . . 75.31 109.726 173.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . 0.403 ' CD2' ' HB3' ' A' ' 114' ' ' GLU . 99.0 m-70 -75.04 129.75 38.13 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-N 115.531 -0.759 . . . . 70.22 112.087 -173.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 42.6 m-70 -119.65 92.04 3.69 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.141 0.977 . . . . 74.2 108.534 169.189 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 18.5 p80 -107.57 122.06 45.92 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.602 0.761 . . . . 70.54 109.873 -176.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 32.5 p-80 -78.22 119.68 21.94 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 109.512 -0.551 . . . . 75.32 109.512 177.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 49.9 t-80 . . . . . 0 CA--C 1.565 1.536 0 C-N-CA 124.357 1.063 . . . . 73.12 109.491 -174.191 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.8 mtm . . . . . 0 N--CA 1.485 1.323 0 N-CA-C 108.903 -0.777 . . . . 73.51 108.903 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.3 t -92.75 -170.17 2.38 Favored 'General case' 0 CA--C 1.554 1.12 0 N-CA-C 108.504 -0.925 . . . . 64.54 108.504 171.521 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -56.55 114.01 4.77 Favored Glycine 0 C--N 1.356 1.655 0 C-N-CA 122.716 0.198 . . . . 54.41 112.805 -179.331 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.33 134.53 38.01 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.503 0.721 . . . . 74.14 110.225 -171.143 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 33.6 ttpt -100.57 117.02 33.86 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.51 0.724 . . . . 72.41 110.593 -178.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.433 HG21 HG12 ' A' ' 62' ' ' VAL . 3.7 p -101.06 138.83 23.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 107.673 -1.232 . . . . 74.31 107.673 164.634 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -104.32 111.66 24.38 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 108.07 -1.085 . . . . 72.05 108.07 174.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.613 HG12 HG21 ' A' ' 60' ' ' ILE . 56.7 t -98.98 107.36 20.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 CA-C-N 113.593 -1.639 . . . . 74.24 108.841 -174.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.433 ' HB2' ' HB3' ' A' ' 61' ' ' ARG . 42.1 mt-30 -97.16 101.57 13.16 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 108.16 -1.052 . . . . 75.23 108.16 -176.537 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.407 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 67.0 t -93.23 111.95 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 108.848 -0.797 . . . . 72.21 108.848 -176.696 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -119.46 103.5 9.51 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.416 1.086 . . . . 65.32 108.259 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.476 HD12 HG13 ' A' ' 48' ' ' ILE . 12.3 tt -118.53 122.02 68.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 CA-C-O 121.036 0.446 . . . . 75.2 111.436 -173.648 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 31.9 m -97.39 112.08 24.06 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 108.361 -0.978 . . . . 75.12 108.361 178.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.627 ' SG ' HG23 ' A' ' 48' ' ' ILE . 14.6 t -122.24 115.92 23.22 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.464 1.106 . . . . 62.32 108.253 179.694 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 40.4 t-20 71.57 -73.1 0.1 Allowed 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 125.222 1.409 . . . . 74.34 110.29 178.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -161.48 10.18 0.12 Allowed Glycine 0 N--CA 1.469 0.894 0 N-CA-C 111.465 -0.654 . . . . 62.43 111.465 175.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.425 ' HA ' ' HE3' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -110.98 123.89 51.06 Favored 'General case' 0 C--N 1.349 0.559 0 C-N-CA 124.197 0.999 . . . . 75.02 109.264 177.207 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 91.5 m -106.81 123.89 48.81 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.688 0.795 . . . . 75.32 109.62 -179.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.663 ' HH ' HD13 ' A' ' 51' ' ' LEU . 5.4 m-85 -109.64 101.84 10.72 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.487 1.115 . . . . 75.52 108.316 -176.309 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.407 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 0.3 OUTLIER -114.58 142.42 46.46 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.05 0.54 . . . . 74.53 110.043 -177.898 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 52.6 ttm-85 -168.05 140.74 3.1 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 122.863 0.465 . . . . 65.14 111.393 175.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 24.7 m -86.68 109.24 19.06 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.661 1.185 . . . . 71.01 109.549 174.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -97.36 135.44 39.25 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.618 0.767 . . . . 75.44 109.41 177.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -94.48 109.46 21.34 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 107.85 -1.167 . . . . 73.15 107.85 177.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 58.0 mt -113.7 116.48 29.5 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.561 0.744 . . . . 70.31 109.344 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -114.79 120.53 40.33 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.438 1.095 . . . . 75.24 108.969 -176.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.491 ' HB2' ' HB2' ' A' ' 32' ' ' GLU . . . -150.98 150.88 31.31 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 122.946 0.499 . . . . 74.41 110.425 176.776 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.2 t -78.81 -42.94 25.08 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.773 0 CA-C-N 114.957 -1.019 . . . . 70.33 109.459 174.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.51 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 59.5 mtt-85 -116.83 164.33 14.83 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.846 0.858 . . . . 65.22 111.451 -169.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -62.39 -48.65 78.78 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 124.467 1.107 . . . . 65.24 111.662 178.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.421 ' HA ' ' HD3' ' A' ' 34' ' ' LYS . 49.4 mm-40 -64.29 -28.75 69.93 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 115.586 -0.733 . . . . 74.34 111.453 -176.543 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.51 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 29.1 mm-40 -74.52 -26.2 59.83 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.026 0.53 . . . . 60.14 111.123 177.719 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.425 HD23 ' HB3' ' A' ' 27' ' ' ALA . 0.2 OUTLIER -81.69 -37.87 26.72 Favored 'General case' 0 CA--C 1.555 1.147 0 N-CA-C 109.788 -0.449 . . . . 71.11 109.788 178.885 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.43 ' HG2' HG21 ' A' ' 80' ' ' ILE . 56.8 mtpt -56.12 -52.13 65.45 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 124.094 0.958 . . . . 73.24 112.452 -176.57 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -54.67 -37.87 66.27 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.667 0.787 . . . . 73.4 111.868 177.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 54.2 mttm -70.63 -38.0 73.85 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.232 0.613 . . . . 74.23 110.811 -178.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 57.6 mt -62.35 -40.86 97.79 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.571 0.748 . . . . 75.31 110.984 175.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.478 ' HG2' HG12 ' A' ' 84' ' ' VAL . 57.2 mtpt -63.71 -41.11 98.13 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.544 0.738 . . . . 62.33 111.326 175.236 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.504 ' HB3' ' HZ3' ' A' ' 39' ' ' LYS . 4.6 mmmp? -61.61 -53.09 60.85 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.332 0.653 . . . . 75.43 110.638 176.499 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 46.4 t -60.05 -38.95 78.88 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 124.826 1.25 . . . . 74.33 111.988 -179.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.419 HD21 HD12 ' A' ' 60' ' ' ILE . 23.3 mt -71.28 -50.11 35.97 Favored 'General case' 0 C--O 1.212 -0.877 0 CA-C-O 118.948 -0.549 . . . . 72.02 110.943 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 56.5 m-80 -66.4 -21.8 66.23 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-N 118.513 0.597 . . . . 75.21 111.594 177.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -74.87 -55.65 5.58 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.048 0.539 . . . . 72.24 110.252 176.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.408 ' HA ' ' CZ ' ' A' ' 44' ' ' ARG . 0.3 OUTLIER -72.94 -26.28 61.33 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.437 0.695 . . . . 74.35 111.312 -176.666 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 57.0 mtp -96.43 2.58 52.72 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.191 0.596 . . . . 63.4 112.326 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -59.37 -55.8 42.44 Favored Pre-proline 0 CA--C 1.566 1.579 0 CA-C-O 118.697 -0.668 . . . . 73.43 110.973 170.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -66.79 -20.93 51.75 Favored 'Trans proline' 0 C--N 1.39 2.718 0 C-N-CA 121.788 1.659 . . . . 75.43 112.429 176.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.627 HG23 ' SG ' ' A' ' 14' ' ' CYS . 48.2 mm -74.46 -40.19 48.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 124.434 1.094 . . . . 75.22 111.513 -174.446 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -68.44 -32.53 72.61 Favored 'General case' 0 N--CA 1.48 1.028 0 N-CA-C 109.424 -0.584 . . . . 74.4 109.424 176.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -69.45 -28.09 65.82 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 124.357 1.063 . . . . 73.14 110.959 175.343 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.663 HD13 ' HH ' ' A' ' 19' ' ' TYR . 83.9 mt -72.31 -39.37 68.3 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 109.004 -0.739 . . . . 74.33 109.004 172.736 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 62.42 62.27 5.76 Favored Glycine 0 C--N 1.352 1.433 0 CA-C-N 115.269 -0.878 . . . . 71.01 111.833 179.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 63.6 m -84.96 152.44 23.49 Favored 'General case' 0 C--O 1.242 0.686 0 C-N-CA 123.069 0.547 . . . . 64.14 112.145 -174.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -67.53 -39.5 85.04 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 115.073 -0.967 . . . . 72.34 110.018 178.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 11.4 ttm180 -142.53 140.77 31.91 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.387 1.075 . . . . 75.12 109.582 176.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 27.0 m -123.76 136.89 58.73 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 C-N-CA 124.471 1.109 . . . . 64.13 109.0 171.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.472 ' O ' ' HA ' ' A' ' 12' ' ' ILE . 47.1 mtt180 -112.09 106.63 15.31 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 108.749 -0.834 . . . . 74.32 108.749 172.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.454 HG12 HD13 ' A' ' 12' ' ' ILE . 17.8 mt -94.86 106.96 18.8 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 N-CA-C 108.014 -1.106 . . . . 75.5 108.014 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.9 m -99.64 102.45 13.94 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 107.045 -1.465 . . . . 75.32 107.045 179.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.613 HG21 HG12 ' A' ' 8' ' ' VAL . 72.2 mt -96.59 107.99 20.65 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 N-CA-C 108.314 -0.995 . . . . 73.34 108.314 179.22 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.433 ' HB3' ' HB2' ' A' ' 9' ' ' GLN . 0.2 OUTLIER -93.17 106.71 18.64 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 107.204 -1.406 . . . . 73.54 107.204 -178.713 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.433 HG12 HG21 ' A' ' 6' ' ' VAL . 22.6 t -92.57 114.27 29.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 N-CA-C 107.966 -1.124 . . . . 74.52 107.966 177.557 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -84.92 105.7 15.88 Favored 'General case' 0 C--O 1.239 0.507 0 N-CA-C 108.118 -1.068 . . . . 75.1 108.118 177.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 25.6 p80 -64.64 139.36 58.76 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 109.336 -0.616 . . . . 75.22 109.336 177.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 30.4 t -80.46 -36.79 33.01 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.208 0.603 . . . . 74.01 111.389 -174.078 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.525 ' HB2' ' HB2' ' A' ' 69' ' ' GLU . 7.2 m-20 -125.07 137.94 54.2 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.606 0.763 . . . . 74.24 110.232 -174.555 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -79.68 -15.52 57.41 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.715 0.806 . . . . 61.22 112.502 -174.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -86.22 -44.54 12.08 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.168 0.587 . . . . 74.53 109.538 171.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.525 ' HB2' ' HB2' ' A' ' 66' ' ' ASP . 11.2 mm-40 -76.81 -14.3 59.93 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 114.711 -1.131 . . . . 72.44 112.821 -175.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.596 ' HG3' ' HD2' ' A' ' 71' ' ' LYS . 9.4 pt-20 -50.55 -31.42 15.61 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 114.554 1.316 . . . . 62.34 114.554 -176.44 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.596 ' HD2' ' HG3' ' A' ' 70' ' ' GLU . 3.7 mptp? -67.15 -42.09 84.93 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 109.418 -0.586 . . . . 73.15 109.418 176.187 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -71.3 -36.35 71.61 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.421 1.088 . . . . 74.14 110.664 177.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -77.7 -42.81 33.18 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.88 0.872 . . . . 75.5 112.159 -172.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.82 -41.81 67.76 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-O 120.806 0.336 . . . . 73.11 110.272 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -63.59 -33.46 75.66 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.134 0.974 . . . . 75.31 111.465 172.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 20.8 ttmm -60.97 -53.25 59.53 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.675 0.79 . . . . 73.42 109.703 173.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.562 ' HA ' ' HB ' ' A' ' 80' ' ' ILE . 19.1 m-85 -69.67 -20.11 63.58 Favored 'General case' 0 C--O 1.221 -0.443 0 C-N-CA 123.57 0.748 . . . . 74.23 111.943 -178.076 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.457 ' O ' ' HB2' ' A' ' 82' ' ' ASN . . . -55.55 -55.17 35.08 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 109.765 -0.458 . . . . 72.42 109.765 171.123 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.427 ' O ' ' HG2' ' A' ' 83' ' ' LYS . . . -69.86 -45.7 67.17 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.503 0.721 . . . . 72.4 111.389 178.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.562 ' HB ' ' HA ' ' A' ' 77' ' ' PHE . 21.6 mm -60.81 -52.38 62.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 C-N-CA 124.624 1.17 . . . . 73.11 111.823 -175.454 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 37.5 mt -67.09 -36.25 81.58 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 118.97 -0.538 . . . . 74.33 111.202 177.237 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.554 HD22 ' HB3' ' A' ' 92' ' ' ASP . 0.2 OUTLIER -60.55 -36.74 79.19 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 123.413 0.445 . . . . 73.53 109.892 178.655 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.427 ' HG2' ' O ' ' A' ' 79' ' ' ALA . 75.0 mmtt -61.74 -47.19 86.32 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.014 0.526 . . . . 74.54 110.261 174.796 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.478 HG12 ' HG2' ' A' ' 38' ' ' LYS . 74.2 t -62.26 -45.44 98.75 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 C-N-CA 124.03 0.932 . . . . 65.14 110.601 -175.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.484 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 20.0 m-85 -62.52 -41.07 98.61 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.617 0.767 . . . . 75.31 110.731 177.235 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -69.87 -24.76 63.47 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.607 0.763 . . . . 73.31 111.516 178.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -84.78 -11.42 55.79 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.614 0.766 . . . . 70.12 111.566 176.213 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.525 ' O ' ' HG3' ' A' ' 109' ' ' GLU . 82.1 mt -99.71 -32.7 10.92 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 109.519 -0.548 . . . . 75.33 109.519 177.143 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 131.32 -19.43 4.84 Favored Glycine 0 C--N 1.349 1.268 0 C-N-CA 123.265 0.46 . . . . 62.44 112.938 -179.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.484 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 23.8 m-85 -68.48 145.93 53.61 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.452 0.701 . . . . 70.1 110.995 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -92.87 159.56 15.3 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.368 0.667 . . . . 75.53 110.142 -177.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . 0.554 ' HB3' HD22 ' A' ' 82' ' ' ASN . 9.2 p-10 -64.85 -25.24 67.82 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.875 0.87 . . . . 72.24 110.969 172.645 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 80.4 p -67.03 -11.02 55.88 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.933 0.893 . . . . 61.43 112.643 176.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -90.91 -19.69 23.05 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.697 0.799 . . . . 64.21 110.723 175.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.497 HG12 HG23 ' A' ' 102' ' ' VAL . 59.3 t -90.71 115.18 29.47 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.975 0 C-N-CA 124.702 1.201 . . . . 74.51 110.757 -166.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 63.7 m -120.89 108.61 14.12 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.603 0.761 . . . . 74.54 110.299 178.234 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 68.2 m95 -87.91 121.86 30.84 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.367 0.667 . . . . 75.43 111.672 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -117.92 81.85 1.74 Allowed 'General case' 0 C--O 1.243 0.748 0 C-N-CA 124.621 1.169 . . . . 75.53 107.895 169.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.05 -115.1 4.38 Favored Glycine 0 C--N 1.345 1.07 0 CA-C-N 114.908 -1.042 . . . . 71.51 112.535 -178.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -96.72 1.88 51.43 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.888 0.875 . . . . 64.32 111.363 -178.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 43.1 m -118.58 140.29 50.13 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 108.911 -0.774 . . . . 72.02 108.911 179.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.497 HG23 HG12 ' A' ' 95' ' ' VAL . 5.9 p -121.19 128.07 75.94 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 C-N-CA 123.22 0.608 . . . . 71.42 110.087 174.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 85.7 m -101.75 104.56 15.36 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 107.375 -1.343 . . . . 73.34 107.375 172.137 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.1 t -94.01 111.84 25.82 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 N-CA-C 107.639 -1.245 . . . . 74.42 107.639 178.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -113.17 118.79 35.69 Favored 'General case' 0 C--O 1.241 0.658 0 N-CA-C 108.297 -1.001 . . . . 75.52 108.297 -177.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -167.78 -173.62 36.0 Favored Glycine 0 CA--C 1.502 -0.772 0 N-CA-C 110.884 -0.887 . . . . 61.24 110.884 -178.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -102.96 161.57 13.65 Favored 'General case' 0 C--O 1.241 0.634 0 N-CA-C 108.579 -0.897 . . . . 74.53 108.579 175.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 82.8 mt -59.0 124.71 20.82 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 123.675 0.609 . . . . 72.32 110.023 175.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.56 ' HG2' HD22 ' A' ' 113' ' ' LEU . 0.4 OUTLIER -58.83 -29.29 66.8 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.376 1.07 . . . . 70.35 110.657 -179.897 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 168.84 142.58 3.55 Favored Glycine 0 C--N 1.34 0.796 0 N-CA-C 110.523 -1.031 . . . . 65.43 110.523 174.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 80.5 t -62.0 -44.27 98.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 N-CA-C 108.159 -1.052 . . . . 72.1 108.159 167.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -133.38 146.28 51.11 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 114.353 -1.294 . . . . 63.25 108.017 170.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.56 HD22 ' HG2' ' A' ' 109' ' ' GLU . 65.5 mt -107.8 176.63 5.08 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.103 0.561 . . . . 74.52 111.432 -170.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 47.7 mm-40 -61.24 -38.4 86.54 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.349 0.66 . . . . 73.3 109.823 170.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 36.5 m80 -84.47 90.37 7.6 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 106.932 -1.507 . . . . 74.14 106.932 163.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 43.4 m-70 -65.96 92.84 0.17 Allowed 'General case' 0 N--CA 1.476 0.873 0 O-C-N 123.854 0.721 . . . . 74.32 109.993 -173.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -139.48 31.59 2.09 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.358 1.063 . . . . 75.42 109.451 -178.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 3.3 p80 -56.88 119.56 6.44 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.146 0.578 . . . . 74.51 110.669 175.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 22.8 t-80 -74.58 -34.73 62.94 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 109.321 -0.622 . . . . 72.31 109.321 -176.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 16.3 m80 . . . . . 0 C--O 1.248 1.013 0 N-CA-C 107.995 -1.113 . . . . 74.31 107.995 161.932 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 ptm . . . . . 0 N--CA 1.488 1.445 0 CA-C-O 121.222 0.534 . . . . 74.21 111.074 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.9 t -152.69 169.0 23.8 Favored 'General case' 0 C--O 1.248 1.018 0 N-CA-C 108.122 -1.066 . . . . 72.24 108.122 172.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -70.08 97.28 0.58 Allowed Glycine 0 C--N 1.337 0.628 0 N-CA-C 109.306 -1.518 . . . . 74.34 109.306 168.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.3 tpmt? -115.3 150.41 36.29 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.374 0.67 . . . . 73.34 110.82 -169.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.8 ttmt -86.54 122.43 30.46 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.654 -0.703 . . . . 74.51 109.147 167.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -103.89 136.56 36.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 107.241 -1.392 . . . . 74.21 107.241 167.539 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.409 ' HB2' ' HD3' ' A' ' 63' ' ' LYS . 53.6 mt-10 -107.83 115.04 29.41 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 108.958 -0.756 . . . . 75.25 108.958 -179.75 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 92.2 t -96.34 114.41 33.08 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.688 0 C-N-CA 124.21 1.004 . . . . 75.55 109.572 -174.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -94.62 98.74 11.02 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 108.312 -0.996 . . . . 52.21 108.312 -177.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 90.7 t -93.76 108.23 20.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 N-CA-C 108.693 -0.854 . . . . 73.44 108.693 -176.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -108.04 103.93 13.26 Favored 'General case' 0 C--O 1.216 -0.709 0 N-CA-C 109.065 -0.717 . . . . 74.14 109.065 179.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.51 HD11 ' SD ' ' A' ' 45' ' ' MET . 12.8 tt -107.38 130.19 59.99 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 CA-C-O 121.085 0.469 . . . . 72.23 111.025 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 11.0 m -99.66 107.66 19.83 Favored 'General case' 0 C--O 1.241 0.61 0 C-N-CA 123.916 0.886 . . . . 75.14 108.652 177.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 37.5 t -130.66 120.31 23.72 Favored 'General case' 0 C--O 1.246 0.899 0 C-N-CA 123.911 0.884 . . . . 75.32 109.966 -179.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 57.9 t30 56.75 53.36 8.39 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.492 1.117 . . . . 71.21 110.986 178.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 68.95 6.87 54.65 Favored Glycine 0 C--N 1.343 0.922 0 CA-C-N 114.85 -1.068 . . . . 71.1 115.055 174.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -117.08 139.67 50.43 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.603 0.761 . . . . 65.44 110.376 -178.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 92.0 m -102.15 118.22 36.43 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.075 0.95 . . . . 65.21 110.17 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.552 ' HB3' ' NH2' ' A' ' 44' ' ' ARG . 50.4 m-85 -114.28 101.01 8.77 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.123 0.969 . . . . 75.33 109.0 -178.518 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -116.47 136.85 52.64 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 120.911 0.386 . . . . 71.32 110.719 178.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 51.8 ttt85 -147.43 139.88 24.63 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 123.518 0.727 . . . . 74.5 109.473 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 27.6 m -98.47 108.95 21.77 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 123.91 0.884 . . . . 64.34 109.671 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -97.37 127.09 43.03 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.094 0.957 . . . . 75.25 109.339 -176.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 26.2 mp0 -87.04 109.33 19.33 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 108.765 -0.828 . . . . 64.43 108.765 -178.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 70.4 mt -113.79 130.45 56.45 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.772 0.829 . . . . 74.14 109.144 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -121.79 119.06 30.58 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 108.473 -0.936 . . . . 74.24 108.473 -177.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.468 ' HB1' HD22 ' A' ' 33' ' ' LEU . . . -149.45 166.07 30.21 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-O 121.576 0.703 . . . . 74.11 110.753 177.478 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 41.6 t -106.33 -57.6 4.28 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 CA-C-N 114.38 -1.282 . . . . 65.23 108.825 176.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.647 ' HB2' ' HG3' ' A' ' 32' ' ' GLU . 66.5 mtp180 -87.97 158.29 18.69 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.805 1.242 . . . . 74.11 109.977 -179.783 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -77.07 -37.12 55.15 Favored 'General case' 0 N--CA 1.493 1.682 0 C-N-CA 124.485 1.114 . . . . 73.41 110.654 -172.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -64.08 -30.64 71.69 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 114.91 -1.041 . . . . 72.25 111.167 174.112 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.647 ' HG3' ' HB2' ' A' ' 29' ' ' ARG . 49.8 mt-10 -69.35 -23.18 63.72 Favored 'General case' 0 C--N 1.358 0.943 0 C-N-CA 122.161 0.184 . . . . 74.33 110.698 175.514 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.468 HD22 ' HB1' ' A' ' 27' ' ' ALA . 0.2 OUTLIER -84.24 -34.56 23.83 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-O 119.152 -0.451 . . . . 75.2 110.1 178.047 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.554 ' HG2' HG22 ' A' ' 80' ' ' ILE . 29.9 mtpt -53.75 -53.52 51.02 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 123.794 0.684 . . . . 74.45 112.033 -177.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.512 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 4.4 pt-20 -50.85 -47.21 60.35 Favored 'General case' 0 N--CA 1.474 0.772 0 O-C-N 124.515 1.135 . . . . 65.22 111.551 176.503 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 55.3 mttm -63.93 -38.05 89.65 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.415 0.686 . . . . 73.44 111.365 -173.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.454 HD13 HD22 ' A' ' 81' ' ' LEU . 79.8 mt -62.24 -50.48 71.56 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 124.098 0.874 . . . . 74.21 110.479 175.33 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.482 ' HB3' ' HZ1' ' A' ' 38' ' ' LYS . 7.1 mtpm? -59.72 -34.69 73.25 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.76 0.824 . . . . 74.25 111.535 177.513 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.512 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 32.5 mmmt -65.49 -61.33 2.16 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 123.527 0.517 . . . . 73.03 110.739 176.152 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 46.4 t -57.6 -39.72 71.2 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.226 0 C-N-CA 124.672 1.189 . . . . 75.32 111.537 -175.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 63.5 mt -63.63 -57.19 10.85 Favored 'General case' 0 C--O 1.217 -0.642 0 CA-C-N 115.732 -0.667 . . . . 75.04 110.27 175.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.5 -26.23 66.68 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 112.58 0.585 . . . . 75.31 112.58 -179.399 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.482 ' HA ' ' CE1' ' A' ' 117' ' ' HIS . 38.4 mm-40 -70.89 -51.86 23.64 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 120.879 0.371 . . . . 73.3 110.681 174.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.552 ' NH2' ' HB3' ' A' ' 19' ' ' TYR . 7.9 tpt180 -76.37 -32.29 58.51 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 115.481 -0.781 . . . . 74.13 112.139 -172.614 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.51 ' SD ' HD11 ' A' ' 12' ' ' ILE . 97.2 mmm -80.17 -12.8 59.61 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.161 0.584 . . . . 71.21 111.94 -172.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.75 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 9.5 t70 -70.85 -51.7 10.99 Favored Pre-proline 0 CA--C 1.569 1.707 0 CA-C-O 118.525 -0.75 . . . . 62.3 111.7 -177.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -62.04 -23.95 76.2 Favored 'Trans proline' 0 C--N 1.386 2.549 0 C-N-CA 122.031 1.821 . . . . 75.35 113.927 173.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 46.2 mm -65.27 -37.59 80.51 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 C-N-CA 123.889 0.876 . . . . 74.14 111.858 -178.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.75 ' HE2' ' HA ' ' A' ' 46' ' ' ASP . 45.1 mtmt -62.19 -34.41 76.39 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 122.777 0.431 . . . . 74.45 110.323 175.375 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -74.86 -29.09 60.92 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.767 0.827 . . . . 72.43 111.278 177.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.42 HD13 ' HH ' ' A' ' 19' ' ' TYR . 82.4 mt -68.28 -23.87 64.81 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 109.476 -0.564 . . . . 74.2 109.476 173.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.56 46.96 5.86 Favored Glycine 0 C--N 1.347 1.168 0 CA-C-N 115.163 -0.926 . . . . 63.32 112.481 166.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 20.8 p -117.03 107.35 14.42 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 123.803 0.841 . . . . 74.45 108.799 175.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -78.0 -12.8 60.02 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 110.293 -0.262 . . . . 75.12 110.293 177.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 37.1 ttt180 -116.7 127.71 54.66 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 108.781 -0.822 . . . . 73.33 108.781 170.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 28.7 m -130.8 142.11 44.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 123.825 0.85 . . . . 71.02 109.578 178.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 42.0 ttm180 -118.0 108.29 15.08 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.434 0.694 . . . . 64.3 109.819 173.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 36.6 mt -105.17 105.76 19.25 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 C-N-CA 124.593 1.157 . . . . 72.11 109.944 -177.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.418 ' HA ' ' O ' ' A' ' 102' ' ' VAL . 29.0 m -96.36 105.5 17.59 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 108.414 -0.958 . . . . 75.01 108.414 174.305 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 50.8 mt -97.5 125.11 50.7 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 123.017 0.527 . . . . 75.15 110.428 178.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 1.4 mpp_? -112.79 121.32 44.35 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 107.243 -1.391 . . . . 72.42 107.243 178.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.4 p -94.59 131.12 42.32 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 N-CA-C 109.563 -0.532 . . . . 55.44 109.563 -175.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.409 ' HD3' ' HB2' ' A' ' 7' ' ' GLU . 53.6 mtpt -95.85 133.3 40.16 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 108.29 -1.004 . . . . 73.44 108.29 -178.22 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 94.6 m-70 -101.17 155.89 17.75 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 114.009 1.115 . . . . 75.12 114.009 -161.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 34.0 t -69.47 -49.36 55.52 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 113.184 -1.825 . . . . 62.44 110.863 176.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -160.19 162.21 33.77 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 122.682 0.393 . . . . 74.41 110.688 -177.242 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.32 -37.5 83.49 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.171 0.989 . . . . 74.41 111.858 177.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.17 -39.05 78.96 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.921 -0.581 . . . . 72.21 111.421 177.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -83.01 -25.94 31.7 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 115.322 -0.854 . . . . 75.3 112.362 -173.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -62.58 -36.84 83.98 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 113.204 0.816 . . . . 75.24 113.204 -167.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.495 ' O ' ' HD3' ' A' ' 75' ' ' LYS . 21.3 pttp -67.11 -19.89 65.7 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.941 0.896 . . . . 75.42 112.139 178.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -86.24 -50.42 6.97 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.029 0.532 . . . . 71.22 110.69 169.312 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -52.44 -48.58 65.69 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 124.427 1.091 . . . . 63.01 112.132 -173.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.88 -49.56 75.74 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.877 0.871 . . . . 62.32 112.541 -176.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.495 ' HD3' ' O ' ' A' ' 71' ' ' LYS . 3.3 mptp? -69.8 -34.12 73.27 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 115.575 -0.738 . . . . 74.04 111.035 -175.58 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -64.67 -48.04 76.24 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.165 0.586 . . . . 72.0 110.106 171.16 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -70.18 -21.27 63.07 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.481 1.112 . . . . 75.33 110.111 -173.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.486 ' HA ' ' NE1' ' A' ' 97' ' ' TRP . . . -63.72 -48.77 75.71 Favored 'General case' 0 C--N 1.343 0.324 0 C-N-CA 123.955 0.902 . . . . 64.54 110.722 172.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.09 -42.21 85.01 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.573 -0.739 . . . . 63.23 111.021 176.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.554 HG22 ' HG2' ' A' ' 34' ' ' LYS . 44.0 mm -58.73 -50.33 79.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 123.966 0.907 . . . . 72.5 110.797 179.633 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.454 HD22 HD13 ' A' ' 37' ' ' LEU . 23.3 mt -68.12 -36.85 80.4 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 122.928 0.491 . . . . 75.14 111.883 179.027 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -59.74 -36.96 77.67 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.295 0.638 . . . . 75.32 110.21 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -71.98 -48.55 44.12 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 115.332 -0.849 . . . . 75.04 111.119 175.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.472 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 23.2 t -58.76 -55.33 23.82 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 C-N-CA 123.989 0.916 . . . . 74.51 111.323 -174.307 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.431 ' CE2' HG21 ' A' ' 104' ' ' VAL . 55.3 m-85 -59.89 -36.43 76.94 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 123.929 0.768 . . . . 70.02 112.231 179.257 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -71.19 -24.18 62.18 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 122.941 0.496 . . . . 75.11 111.858 178.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -84.8 -5.78 59.34 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.824 0.85 . . . . 70.31 111.004 175.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 68.4 mt -105.41 -31.06 9.2 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 122.701 0.4 . . . . 75.14 110.873 -179.578 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 143.6 -10.77 2.17 Favored Glycine 0 C--N 1.348 1.234 0 CA-C-O 119.404 -0.665 . . . . 72.12 114.287 177.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.42 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 97.1 m-85 -74.75 126.56 31.16 Favored 'General case' 0 N--CA 1.484 1.229 0 CA-C-N 118.271 1.036 . . . . 73.14 110.682 176.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -95.62 91.72 6.27 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.494 0.718 . . . . 75.11 111.333 -174.023 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 20.8 t70 54.8 -81.19 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 124.819 1.247 . . . . 73.04 113.989 165.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 20.1 m -66.73 -13.8 61.8 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 124.172 0.989 . . . . 72.02 113.144 -175.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . 0.468 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 10.6 m120 -55.37 -37.44 67.53 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.175 0.59 . . . . 73.51 110.671 168.506 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 45.1 t -99.03 118.32 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 125.137 1.375 . . . . 73.52 110.092 -174.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 45.5 m -144.69 128.05 16.87 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-N 118.442 0.565 . . . . 73.51 110.568 173.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.486 ' NE1' ' HA ' ' A' ' 78' ' ' ALA . 27.7 m95 -87.17 152.49 22.28 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 124.129 0.971 . . . . 73.41 111.513 -179.317 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -159.72 92.76 1.05 Allowed 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.139 0.975 . . . . 73.03 109.036 177.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 59.25 58.54 13.92 Favored Glycine 0 C--N 1.346 1.105 0 CA-C-N 115.887 -0.597 . . . . 73.25 113.501 177.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 71.03 3.41 4.64 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 124.88 1.272 . . . . 64.23 113.055 179.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 37.7 m -119.59 110.75 17.23 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 108.916 -0.772 . . . . 74.24 108.916 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.418 ' O ' ' HA ' ' A' ' 59' ' ' SER . 6.9 p -99.76 119.8 48.3 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 N-CA-C 109.471 -0.566 . . . . 72.23 109.471 179.842 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 87.0 m -92.35 104.4 16.75 Favored 'General case' 0 C--O 1.241 0.634 0 N-CA-C 108.221 -1.029 . . . . 73.15 108.221 176.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.468 ' HA ' ' O ' ' A' ' 94' ' ' ASN . 48.8 t -108.48 109.49 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 C-N-CA 124.234 1.013 . . . . 72.35 108.37 179.056 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -135.76 147.24 48.32 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 122.465 0.306 . . . . 71.4 110.269 -176.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . 0.403 ' HA3' ' ND2' ' A' ' 94' ' ' ASN . . . 168.27 -160.39 33.9 Favored Glycine 0 C--O 1.245 0.782 0 CA-C-N 115.825 -0.625 . . . . 72.12 112.338 -177.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 27.2 pt20 -88.4 117.67 27.49 Favored 'General case' 0 CA--C 1.55 0.964 0 CA-C-O 121.758 0.789 . . . . 70.34 111.623 -174.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 28.0 tp -78.79 172.77 13.27 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 124.502 1.121 . . . . 74.25 109.876 169.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 84.12 -44.33 0.09 Allowed 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 126.313 1.845 . . . . 74.54 109.707 -176.05 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -69.7 -35.66 74.21 Favored Glycine 0 C--N 1.343 0.948 0 N-CA-C 110.887 -0.885 . . . . 73.2 110.887 169.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 65.2 t -80.79 97.25 3.19 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.877 0 N-CA-C 108.545 -0.909 . . . . 72.14 108.545 169.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -168.63 131.09 1.35 Allowed 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.978 0.911 . . . . 74.31 108.974 -174.184 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 79.5 mt -119.48 147.03 44.9 Favored 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 108.893 -0.781 . . . . 74.31 108.893 175.017 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -69.96 80.39 0.48 Allowed 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.506 1.122 . . . . 73.3 111.909 -172.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 3.6 p-80 -169.85 80.33 0.11 Allowed 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.159 1.384 . . . . 74.45 108.121 173.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 83.0 t60 -79.06 73.48 5.61 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-O 122.303 1.049 . . . . 72.41 108.734 177.087 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.482 ' CE1' ' HA ' ' A' ' 43' ' ' GLU . 23.8 p80 -64.33 -33.66 76.35 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 113.508 -1.678 . . . . 72.03 110.88 179.062 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 21.5 t-80 -86.35 111.51 20.55 Favored 'General case' 0 C--O 1.224 -0.255 0 C-N-CA 124.418 1.087 . . . . 74.55 110.05 -176.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 33.4 p-80 -124.15 39.03 4.06 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.37 1.068 . . . . 75.23 109.351 -178.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 59.3 t-80 . . . . . 0 C--O 1.249 1.067 0 C-N-CA 123.717 0.807 . . . . 74.24 109.562 -178.043 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.475 ' N ' ' SD ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 CA--C 1.551 1.009 0 CA-C-O 121.771 0.796 . . . . 73.31 110.13 . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.2 m -75.38 -42.9 52.84 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 121.748 0.785 . . . . 73.22 110.052 173.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -172.64 71.45 0.1 Allowed Glycine 0 C--N 1.338 0.65 0 N-CA-C 109.81 -1.316 . . . . 70.41 109.81 179.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.9 mmmm -72.93 141.69 47.83 Favored 'General case' 0 C--O 1.24 0.604 0 CA-C-O 121.221 0.534 . . . . 74.45 110.975 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.503 ' HA ' ' HA ' ' A' ' 26' ' ' TYR . 40.5 ttpt -83.05 110.9 18.39 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 106.89 -1.522 . . . . 74.44 106.89 166.591 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.503 HG22 HG21 ' A' ' 62' ' ' VAL . 7.2 p -98.21 149.91 5.05 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 N-CA-C 108.87 -0.789 . . . . 74.1 108.87 -176.101 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.443 ' HB3' HG23 ' A' ' 22' ' ' THR . 37.2 mt-10 -109.85 113.19 25.73 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 108.988 -0.745 . . . . 72.41 108.988 -176.002 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 79.5 t -100.71 118.24 47.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 C-N-CA 124.614 1.166 . . . . 73.43 109.333 -176.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -96.84 102.48 14.27 Favored 'General case' 0 C--O 1.24 0.588 0 N-CA-C 108.034 -1.099 . . . . 75.43 108.034 -178.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.428 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 48.2 t -93.67 104.65 15.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 N-CA-C 108.442 -0.947 . . . . 73.25 108.442 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -108.17 105.17 14.78 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.946 0.898 . . . . 71.35 109.009 -175.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.524 HD12 HG13 ' A' ' 48' ' ' ILE . 17.6 tt -123.41 118.4 54.36 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-O 121.256 0.551 . . . . 75.24 110.973 -178.337 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 21.8 m -95.01 121.03 36.21 Favored 'General case' 0 C--O 1.242 0.703 0 N-CA-C 108.676 -0.861 . . . . 74.25 108.676 177.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.412 ' SG ' HG22 ' A' ' 48' ' ' ILE . 26.3 t -145.26 141.92 29.04 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 124.213 1.005 . . . . 65.14 109.756 -178.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 46.6 t-20 72.03 -74.02 0.09 Allowed 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 125.182 1.393 . . . . 72.52 109.471 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -168.2 11.56 0.06 OUTLIER Glycine 0 C--N 1.338 0.662 0 N-CA-C 111.024 -0.83 . . . . 53.04 111.024 172.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 27.8 mmmt -122.3 138.29 54.56 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 124.743 1.217 . . . . 71.41 109.368 -175.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 53.7 m -98.09 122.78 41.65 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 108.819 -0.808 . . . . 63.54 108.819 174.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -106.13 101.47 10.95 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 107.106 -1.442 . . . . 73.33 107.106 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.428 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 12.8 pt-20 -130.7 141.75 50.41 Favored 'General case' 0 C--O 1.241 0.619 0 CA-C-O 121.217 0.532 . . . . 71.21 110.17 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 57.9 ttt85 -155.29 148.01 24.28 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 114.805 -1.089 . . . . 74.52 108.497 174.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.443 HG23 ' HB3' ' A' ' 7' ' ' GLU . 22.4 m -93.38 108.69 20.31 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.88 0.872 . . . . 74.03 108.926 177.694 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 80.3 m-85 -98.76 132.14 44.36 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.121 0.968 . . . . 72.14 110.169 -174.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.418 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 1.9 mp0 -88.96 107.59 19.11 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 108.365 -0.976 . . . . 74.22 108.365 178.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 33.5 mt -112.06 106.82 15.56 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.119 0.967 . . . . 73.32 109.288 179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.503 ' HA ' ' HA ' ' A' ' 5' ' ' LYS . 55.0 t80 -81.07 128.16 33.42 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.165 0.586 . . . . 74.54 109.844 176.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.433 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -141.19 147.88 39.07 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.182 0.593 . . . . 74.04 110.461 174.096 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 58.7 t -84.85 -40.23 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 CA-C-N 115.645 -0.707 . . . . 75.04 109.163 172.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.543 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 40.0 mtt180 -120.16 162.49 19.26 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 115.043 -0.98 . . . . 74.42 109.841 -178.166 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -63.56 -38.01 89.52 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 115.133 -0.939 . . . . 64.21 110.797 171.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -65.91 -27.49 68.23 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.942 0.897 . . . . 65.21 111.781 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.543 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 12.4 mm-40 -68.0 -39.13 83.3 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 122.399 0.28 . . . . 75.25 110.362 177.682 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.558 HD21 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -66.11 -20.19 66.08 Favored 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 123.583 0.753 . . . . 74.41 110.986 -175.136 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.1 mtpp -54.03 -62.97 1.31 Allowed 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.661 0.785 . . . . 73.33 111.994 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.547 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 2.5 pp20? -65.0 -30.37 71.36 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 116.107 -0.497 . . . . 73.53 111.471 -176.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.558 ' HD2' HD21 ' A' ' 33' ' ' LEU . 53.8 mttm -64.42 -41.69 96.47 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.665 0.786 . . . . 74.4 110.495 178.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.43 HD12 HD22 ' A' ' 81' ' ' LEU . 74.4 mt -56.31 -52.75 63.37 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 124.014 0.821 . . . . 74.42 109.746 171.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.2 mtpm? -56.77 -37.79 71.57 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 124.121 0.888 . . . . 73.54 112.004 -178.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.547 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 29.9 mmtp -61.84 -55.29 31.45 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 122.948 0.499 . . . . 74.32 110.137 177.105 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 92.7 t -64.55 -34.11 67.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-N 115.008 -0.997 . . . . 75.04 111.422 -176.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 64.2 mt -72.4 -41.0 66.78 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.358 0.663 . . . . 75.11 111.023 -177.17 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.8 m-80 -64.94 -40.38 94.95 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 122.356 0.262 . . . . 70.31 111.109 174.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 47.7 mm-40 -65.95 -46.81 76.78 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.262 0.625 . . . . 73.44 111.4 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? -69.58 -39.26 77.45 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.35 0.66 . . . . 74.25 111.54 -177.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.471 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 54.3 mtp -88.45 -7.91 55.81 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 113.169 0.803 . . . . 74.33 113.169 -175.63 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -63.27 -51.47 68.59 Favored Pre-proline 0 CA--C 1.569 1.693 0 CA-C-O 118.548 -0.739 . . . . 73.41 111.573 178.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -66.49 -23.28 50.58 Favored 'Trans proline' 0 C--N 1.398 3.181 0 C-N-CA 122.383 2.056 . . . . 74.33 112.801 175.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.524 HG13 HD12 ' A' ' 12' ' ' ILE . 51.2 mm -67.07 -29.98 47.95 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 C-N-CA 124.148 0.979 . . . . 71.44 110.077 179.693 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.471 ' HG3' ' O ' ' A' ' 45' ' ' MET . 92.7 mttt -70.02 -34.5 73.37 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 115.272 -0.877 . . . . 74.44 110.6 175.625 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.541 ' HB2' ' HZ2' ' A' ' 50' ' ' LYS . 4.4 ttmp? -74.24 -26.64 60.35 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.088 0.555 . . . . 74.5 111.319 178.201 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 88.8 mt -70.99 -45.01 64.76 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 108.995 -0.743 . . . . 73.04 108.995 172.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 88.21 17.87 56.64 Favored Glycine 0 C--N 1.342 0.903 0 CA-C-N 115.392 -0.822 . . . . 63.14 114.671 171.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.538 ' SG ' HG11 ' A' ' 56' ' ' VAL . 6.6 p -62.04 122.45 15.54 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 123.602 0.761 . . . . 75.13 110.131 175.209 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm -62.65 -57.15 12.06 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.212 0.605 . . . . 75.13 110.445 -177.189 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 33.5 ttp180 -103.48 128.23 50.71 Favored 'General case' 0 C--N 1.345 0.384 0 CA-C-N 115.504 -0.771 . . . . 72.22 109.11 176.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.538 HG11 ' SG ' ' A' ' 53' ' ' CYS . 34.5 m -116.08 142.96 27.32 Favored 'Isoleucine or valine' 0 C--O 1.244 0.785 0 C-N-CA 123.62 0.768 . . . . 75.32 109.437 176.467 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -100.42 103.1 14.46 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 108.52 -0.918 . . . . 73.05 108.52 177.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 36.9 mt -102.09 140.07 21.56 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 N-CA-C 107.994 -1.113 . . . . 75.11 107.994 179.065 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 32.4 t -141.9 104.24 4.47 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 107.327 -1.36 . . . . 62.44 107.327 175.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 78.2 mt -103.26 107.55 22.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 N-CA-C 108.511 -0.922 . . . . 75.31 108.511 -178.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 28.0 ttt180 -102.27 131.79 48.62 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 108.518 -0.919 . . . . 73.42 108.518 173.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.503 HG21 HG22 ' A' ' 6' ' ' VAL . 8.0 p -95.04 139.2 19.16 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 N-CA-C 106.979 -1.489 . . . . 75.15 106.979 174.709 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -82.77 136.99 34.52 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-O 121.134 0.492 . . . . 73.25 109.872 -175.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . 0.561 ' HB3' ' HG3' ' A' ' 70' ' ' GLU . 73.7 m80 -105.43 127.61 53.08 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 124.47 1.108 . . . . 72.54 109.397 -169.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 23.3 t -83.35 -47.81 11.07 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.643 0.777 . . . . 74.42 111.481 -171.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -109.29 -105.04 0.36 Allowed 'General case' 0 CA--C 1.56 1.329 0 C-N-CA 123.439 0.696 . . . . 74.23 109.998 -175.027 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . 176.71 -60.25 0.01 OUTLIER 'General case' 0 C--N 1.362 1.111 0 C-N-CA 125.351 1.46 . . . . 75.54 107.9 -177.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.27 -42.79 68.31 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 115.436 -0.802 . . . . 73.52 110.419 178.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -62.19 -36.04 80.69 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 115.572 -0.74 . . . . 65.55 110.461 173.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.561 ' HG3' ' HB3' ' A' ' 64' ' ' HIS . 41.5 mm-40 -73.2 -22.61 60.42 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.23 0.612 . . . . 73.31 112.137 -175.024 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.541 ' HZ3' ' HB3' ' A' ' 71' ' ' LYS . 3.1 mmmp? -63.39 -33.58 75.85 Favored 'General case' 0 N--CA 1.483 1.187 0 CA-C-O 121.285 0.564 . . . . 73.02 110.128 172.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 34.1 ttpt -84.29 -46.0 12.25 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.764 1.226 . . . . 73.42 110.96 177.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -80.5 -30.81 37.3 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 112.873 0.694 . . . . 74.45 112.873 -168.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -78.62 -30.6 46.58 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 122.594 0.358 . . . . 73.4 110.279 175.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 51.9 tttm -63.39 -40.5 97.39 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.618 0.767 . . . . 72.14 110.201 168.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -67.19 -40.69 86.57 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.693 0.797 . . . . 71.43 110.384 175.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -76.47 -19.04 58.43 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.984 0.914 . . . . 72.12 110.588 -175.215 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.2 -45.74 83.5 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.286 0.634 . . . . 74.43 110.448 173.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.69 -34.17 75.28 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.54 -0.755 . . . . 74.13 111.255 176.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 46.4 mm -67.68 -50.72 58.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 123.86 0.864 . . . . 74.1 110.918 -179.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.43 HD22 HD12 ' A' ' 37' ' ' LEU . 34.4 mt -66.11 -50.72 63.07 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 123.625 0.578 . . . . 74.1 110.174 -176.154 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -56.89 -41.29 77.78 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 124.029 0.932 . . . . 64.35 111.543 -177.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 19.7 mmmt -64.96 -44.71 88.5 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 123.76 0.663 . . . . 75.23 111.255 176.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.409 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 25.0 t -62.61 -44.7 99.62 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 C-N-CA 123.017 0.527 . . . . 64.2 110.124 -176.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.538 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 20.6 m-85 -60.77 -42.3 97.2 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 124.091 0.869 . . . . 74.54 110.273 177.741 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.39 -34.13 77.07 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.529 0.731 . . . . 73.51 111.331 177.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -81.27 -8.02 59.67 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.022 0.929 . . . . 74.25 110.85 -178.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 93.1 mt -107.22 -9.77 16.01 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.821 0.848 . . . . 71.12 110.397 176.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 109.4 -5.73 31.65 Favored Glycine 0 N--CA 1.478 1.485 0 N-CA-C 114.096 0.399 . . . . 51.51 114.096 175.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.575 ' HB3' HD22 ' A' ' 94' ' ' ASN . 9.9 m-85 -79.66 138.85 37.51 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.374 0.67 . . . . 73.53 109.438 179.048 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 28.3 m-80 -96.53 168.77 10.34 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.548 0.739 . . . . 73.11 111.735 -176.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -54.45 -45.46 73.11 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.926 1.29 . . . . 75.43 111.041 177.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 23.9 m -57.48 -46.45 83.69 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 124.71 1.204 . . . . 71.2 113.424 -173.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . 0.575 HD22 ' HB3' ' A' ' 90' ' ' TYR . 3.7 p-10 -83.05 -11.24 58.23 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 122.743 0.417 . . . . 74.35 111.675 -177.111 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 97.0 t -88.6 102.1 12.48 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 N-CA-C 107.956 -1.127 . . . . 75.23 107.956 172.031 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 22.7 m -108.25 103.78 13.03 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.572 0.749 . . . . 72.11 110.458 -173.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 43.0 m95 -79.94 150.48 30.5 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.347 0.659 . . . . 74.11 111.65 178.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -144.28 69.88 1.28 Allowed 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 106.966 -1.494 . . . . 75.21 106.966 170.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 52.37 -82.4 0.01 OUTLIER Glycine 0 C--N 1.361 1.955 0 CA-C-N 114.156 -1.384 . . . . 63.51 114.777 179.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -72.55 -39.1 67.75 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 126.041 1.736 . . . . 71.14 112.776 -174.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 35.6 m -131.4 149.65 52.46 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.754 0.822 . . . . 74.32 110.475 -174.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 7.4 p -116.82 137.98 48.93 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 C-N-CA 123.329 0.652 . . . . 75.04 110.361 176.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 39.4 m -114.28 108.76 17.36 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.864 1.266 . . . . 72.21 109.073 176.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.4 t -101.04 119.69 49.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 C-N-CA 123.406 0.682 . . . . 73.43 109.475 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -86.32 113.07 22.01 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 107.333 -1.358 . . . . 75.22 107.333 171.724 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -105.02 167.31 14.99 Favored Glycine 0 C--N 1.34 0.804 0 N-CA-C 111.815 -0.514 . . . . 60.13 111.815 -176.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -138.36 128.58 25.84 Favored 'General case' 0 C--O 1.241 0.633 0 C-N-CA 123.79 0.836 . . . . 72.35 110.179 -175.29 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.34 123.74 25.17 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.894 0.878 . . . . 72.42 108.8 -178.766 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.44 ' HB3' ' HE2' ' A' ' 118' ' ' HIS . 1.2 pm0 42.56 22.45 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.86 0 C-N-CA 126.165 1.786 . . . . 74.14 114.482 -173.199 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -74.97 -32.33 56.85 Favored Glycine 0 C--N 1.352 1.434 0 N-CA-C 108.796 -1.722 . . . . 54.1 108.796 164.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 30.6 m -69.15 -164.17 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.559 1.311 0 C-N-CA 125.055 1.342 . . . . 73.41 110.293 164.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -51.13 121.11 5.64 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.293 0.637 . . . . 73.01 111.353 -178.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 85.6 mt -64.5 98.17 0.24 Allowed 'General case' 0 C--O 1.242 0.659 0 C-N-CA 123.795 0.838 . . . . 73.43 109.339 176.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -67.09 126.49 29.34 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 115.048 -0.978 . . . . 73.25 111.028 -172.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 59.0 m80 -67.97 -24.16 65.12 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.5 0.72 . . . . 73.1 110.569 177.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 50.3 t60 -61.76 104.91 0.49 Allowed 'General case' 0 C--O 1.244 0.8 0 N-CA-C 107.807 -1.183 . . . . 74.1 107.807 164.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 30.1 m80 -67.28 90.93 0.23 Allowed 'General case' 0 CA--C 1.534 0.334 0 O-C-N 124.074 0.859 . . . . 74.15 111.519 -172.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . 0.44 ' HE2' ' HB3' ' A' ' 109' ' ' GLU . 55.4 p-80 -98.53 -162.75 0.98 Allowed 'General case' 0 C--O 1.248 0.988 0 N-CA-C 107.341 -1.355 . . . . 73.52 107.341 166.255 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -66.19 159.34 26.57 Favored 'General case' 0 CA--C 1.558 1.279 0 CA-C-N 118.424 0.556 . . . . 73.41 111.052 -178.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 4.3 p80 . . . . . 0 CA--C 1.553 1.091 0 C-N-CA 125.112 1.365 . . . . 62.43 108.4 162.509 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.1 ptt? . . . . . 0 N--CA 1.48 1.03 0 N-CA-C 109.934 -0.395 . . . . 72.34 109.934 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.8 m 67.62 167.96 0.25 Allowed 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.69 1.196 . . . . 71.04 111.023 -173.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -69.09 81.68 0.25 Allowed Glycine 0 C--N 1.343 0.941 0 N-CA-C 112.12 -0.392 . . . . 74.53 112.12 178.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.7 tppp? -124.06 128.49 49.4 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 123.494 0.718 . . . . 74.01 110.126 -175.265 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 26.8 ttpt -85.94 111.07 19.9 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-N 115.436 -0.802 . . . . 74.0 109.12 174.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.4 p -99.66 142.38 15.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 N-CA-C 108.122 -1.066 . . . . 61.22 108.122 171.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.539 ' HB3' HG21 ' A' ' 22' ' ' THR . 50.2 mt-10 -113.71 118.91 35.65 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 109.521 -0.548 . . . . 73.01 109.521 177.507 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 59.2 t -106.75 116.02 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 124.429 1.092 . . . . 73.32 109.688 -171.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.413 ' O ' ' HA ' ' A' ' 60' ' ' ILE . 43.4 tt0 -92.26 102.7 15.2 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 107.987 -1.116 . . . . 55.25 107.987 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 98.0 t -96.89 102.71 13.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 N-CA-C 108.317 -0.994 . . . . 73.35 108.317 178.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.48 ' HA ' ' HB3' ' A' ' 20' ' ' GLU . 22.1 ttmm -104.22 103.56 13.34 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 108.573 -0.899 . . . . 72.11 108.573 -178.119 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.499 HD11 HG13 ' A' ' 48' ' ' ILE . 11.8 tt -112.55 124.21 69.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 CA-C-O 121.069 0.462 . . . . 75.45 109.943 179.419 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 11.9 m -98.04 113.5 25.39 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.615 0.766 . . . . 75.34 109.247 178.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.589 ' SG ' HG23 ' A' ' 48' ' ' ILE . 18.4 t -153.81 150.6 28.63 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.914 1.286 . . . . 64.45 108.849 179.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.499 ' HB2' HD11 ' A' ' 51' ' ' LEU . 62.5 t30 69.82 12.77 8.02 Favored 'General case' 0 N--CA 1.504 2.261 0 C-N-CA 124.273 1.029 . . . . 72.05 111.295 178.715 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 77.94 4.86 86.39 Favored Glycine 0 C--N 1.349 1.291 0 CA-C-N 116.414 -0.357 . . . . 54.14 112.319 -171.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.4 mmpt? -113.53 165.78 12.15 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.583 1.153 . . . . 73.21 109.526 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 39.8 m -119.36 115.66 24.59 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 109.281 -0.637 . . . . 72.22 109.281 174.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -103.62 106.22 16.67 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 107.131 -1.433 . . . . 73.21 107.131 -179.4 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.48 ' HB3' ' HA ' ' A' ' 11' ' ' LYS . 16.9 pt-20 -143.29 161.6 37.88 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.523 0.678 . . . . 71.2 112.212 -176.032 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 35.6 ttm180 -167.21 148.24 5.66 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-N 113.764 -1.562 . . . . 74.52 108.063 176.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.539 HG21 ' HB3' ' A' ' 7' ' ' GLU . 27.8 m -92.37 112.99 25.13 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 107.337 -1.357 . . . . 62.41 107.337 169.651 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 -97.51 127.26 43.33 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.062 0.945 . . . . 74.04 109.902 -173.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -83.85 106.07 15.24 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 107.502 -1.296 . . . . 73.54 107.502 178.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 81.5 mt -112.98 119.95 39.69 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.292 1.037 . . . . 73.11 108.337 -179.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -109.1 118.81 37.73 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 109.024 -0.732 . . . . 75.54 109.024 -177.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -124.84 150.91 45.92 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.269 0.628 . . . . 74.31 110.098 178.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 44.9 t -95.01 -26.31 4.39 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 C-N-CA 123.881 0.872 . . . . 75.11 109.489 175.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.589 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 90.3 mtt180 -131.72 157.03 44.86 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 108.158 -1.052 . . . . 73.01 108.158 174.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -67.67 -32.96 74.0 Favored 'General case' 0 N--CA 1.488 1.427 0 CA-C-O 121.239 0.542 . . . . 64.14 111.012 -178.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -70.2 -21.35 63.04 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.138 0.975 . . . . 73.42 111.343 -179.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.589 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 27.6 mm-40 -68.93 -23.7 64.19 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 122.875 0.47 . . . . 73.01 110.813 174.8 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.589 HD21 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -73.18 -19.29 61.14 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 123.238 0.615 . . . . 71.02 111.217 -177.386 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -54.86 -59.19 5.06 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.682 0.793 . . . . 74.33 111.573 178.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -57.5 -36.37 71.45 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.847 0.859 . . . . 64.21 112.487 -177.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.589 ' HD2' HD21 ' A' ' 33' ' ' LEU . 62.0 mttm -67.25 -46.09 74.77 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.298 -0.865 . . . . 73.42 109.912 -177.327 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.474 HD13 HD21 ' A' ' 81' ' ' LEU . 95.9 mt -65.63 -40.04 92.12 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.411 0.684 . . . . 72.11 111.874 177.767 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 60.2 mtpt -59.47 -42.44 92.06 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 122.929 0.492 . . . . 64.23 110.697 177.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 34.1 mmtm -67.64 -57.21 6.82 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 123.506 0.504 . . . . 74.2 111.268 176.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 53.0 t -56.07 -44.51 78.9 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.94 0 C-N-CA 123.213 0.605 . . . . 74.11 111.508 -175.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 83.8 mt -68.99 -59.82 2.79 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.003 0.521 . . . . 70.24 111.311 179.407 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 60.8 t30 -60.69 -38.42 84.92 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 123.415 0.686 . . . . 70.15 112.173 -172.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 -80.17 -32.55 38.77 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.366 0.666 . . . . 72.02 111.921 -177.322 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 4.5 tpt180 -68.74 -33.83 74.57 Favored 'General case' 0 N--CA 1.486 1.358 0 CA-C-O 121.318 0.58 . . . . 74.55 109.506 172.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.527 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 58.2 mtp -86.64 -6.35 58.88 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.295 -0.866 . . . . 72.22 112.058 178.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -63.19 -51.08 72.05 Favored Pre-proline 0 CA--C 1.565 1.549 0 CA-C-O 118.814 -0.612 . . . . 74.01 111.723 178.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -66.72 -22.31 50.23 Favored 'Trans proline' 0 C--N 1.384 2.422 0 C-N-CA 121.423 1.415 . . . . 75.52 112.263 172.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.589 HG23 ' SG ' ' A' ' 14' ' ' CYS . 45.3 mm -71.82 -27.13 26.91 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 123.552 0.741 . . . . 71.44 110.354 179.13 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.536 ' HB3' ' HA2' ' A' ' 110' ' ' GLY . 90.1 mttt -71.08 -36.58 72.29 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.474 0.71 . . . . 72.21 110.348 174.513 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.33 -32.73 70.58 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 123.561 0.744 . . . . 72.14 109.335 175.545 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.499 HD11 ' HB2' ' A' ' 15' ' ' ASN . 92.9 mt -70.07 -34.42 73.17 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 109.655 -0.498 . . . . 72.22 109.655 175.176 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 73.83 45.62 26.72 Favored Glycine 0 C--N 1.342 0.871 0 CA-C-N 115.513 -0.767 . . . . 71.22 113.285 176.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 49.9 m -76.0 112.74 12.75 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 108.918 -0.771 . . . . 73.11 108.918 169.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -58.52 -33.06 69.43 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.254 1.021 . . . . 75.21 111.084 -179.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 43.9 ttp180 -145.7 143.79 29.98 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.452 1.101 . . . . 75.24 108.489 177.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.465 ' O ' ' HA ' ' A' ' 105' ' ' GLU . 28.7 m -131.42 147.88 32.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 123.953 0.901 . . . . 65.54 109.488 179.371 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 52.3 ttt85 -102.7 107.22 18.03 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 108.812 -0.81 . . . . 73.54 108.812 175.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.408 ' HA ' ' O ' ' A' ' 11' ' ' LYS . 37.9 mt -107.6 107.91 23.93 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 C-N-CA 123.371 0.668 . . . . 72.2 109.641 -177.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 18.2 m -98.75 105.67 17.84 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 108.479 -0.934 . . . . 74.43 108.479 174.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.413 ' HA ' ' O ' ' A' ' 9' ' ' GLN . 71.8 mt -100.3 134.27 40.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 123.129 0.572 . . . . 72.03 109.481 177.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 21.9 mtm180 -128.37 136.53 51.06 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.564 0.746 . . . . 75.2 109.544 174.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.7 p -95.78 137.22 24.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 123.542 0.737 . . . . 75.32 109.203 178.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.8 tttm -83.16 114.8 21.58 Favored 'General case' 0 C--O 1.244 0.798 0 N-CA-C 107.602 -1.258 . . . . 72.34 107.602 174.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . 0.591 ' HA ' ' HG2' ' A' ' 73' ' ' GLU . 21.6 m170 -69.71 132.97 46.96 Favored 'General case' 0 C--O 1.234 0.258 0 O-C-N 123.885 0.741 . . . . 73.43 110.132 -172.214 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 19.7 t -57.04 -52.34 65.65 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 123.836 0.854 . . . . 61.45 111.529 -179.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.533 ' H ' ' HB2' ' A' ' 69' ' ' GLU . 21.8 m-20 -144.99 179.69 7.18 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 124.306 1.043 . . . . 71.34 109.576 -178.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.26 -51.28 64.36 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.974 0.91 . . . . 74.44 111.085 176.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.17 -26.27 68.09 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.473 0.709 . . . . 63.52 111.421 177.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.533 ' HB2' ' H ' ' A' ' 66' ' ' ASP . 30.9 mm-40 -73.97 -30.2 62.38 Favored 'General case' 0 C--O 1.204 -1.327 0 CA-C-O 118.136 -0.935 . . . . 74.35 112.516 179.147 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -49.48 -47.89 48.2 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 114.166 1.173 . . . . 74.4 114.166 -168.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 40.9 mtmt -69.2 -39.71 78.47 Favored 'General case' 0 N--CA 1.479 0.975 0 CA-C-N 115.477 -0.783 . . . . 74.33 110.585 -177.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -69.54 -33.66 73.1 Favored 'General case' 0 C--O 1.212 -0.914 0 CA-C-N 114.581 -1.191 . . . . 74.23 110.225 175.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.591 ' HG2' ' HA ' ' A' ' 64' ' ' HIS . 10.1 tp10 -73.16 -39.32 65.74 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.953 1.301 . . . . 73.42 110.376 -166.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.23 -53.46 56.9 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 115.304 -0.862 . . . . 63.13 110.841 173.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 59.0 mttp -66.44 -39.47 88.93 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 124.396 1.078 . . . . 73.22 112.447 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -58.32 -54.58 45.45 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 125.387 1.475 . . . . 75.23 109.815 -179.12 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -73.37 -26.5 61.03 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 113.45 -1.705 . . . . 74.54 110.371 -177.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.4 -44.66 90.61 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.433 0.693 . . . . 73.34 111.076 175.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.51 -43.13 99.42 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.351 0.66 . . . . 53.53 111.219 178.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 49.0 mm -66.45 -44.29 90.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 CA-C-N 115.866 -0.606 . . . . 72.51 110.756 178.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.474 HD21 HD13 ' A' ' 37' ' ' LEU . 32.1 mt -64.7 -36.98 86.02 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.368 0.667 . . . . 65.43 110.975 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -55.53 -44.26 76.51 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.215 1.006 . . . . 60.34 110.233 179.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.426 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 33.7 mmtp -68.05 -45.09 74.89 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 114.841 -1.072 . . . . 75.52 110.961 177.562 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 77.5 t -66.87 -45.75 86.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 123.312 0.645 . . . . 73.22 111.151 -172.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.459 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 24.1 m-85 -60.75 -38.48 85.34 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.214 0.606 . . . . 72.45 110.718 176.145 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.32 -28.22 67.81 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.105 0.562 . . . . 65.24 111.485 176.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 83' ' ' LYS . 45.0 mt-10 -82.07 -14.96 55.06 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.538 0.735 . . . . 75.22 110.645 176.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 97.2 mt -107.34 -2.77 20.31 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.77 0.828 . . . . 75.41 110.846 -178.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 82.01 19.21 65.64 Favored Glycine 0 C--N 1.348 1.245 0 N-CA-C 114.503 0.561 . . . . 71.43 114.503 175.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.459 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 14.6 m-85 -89.39 137.68 32.11 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 109.419 -0.586 . . . . 74.04 109.419 173.084 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -80.51 150.69 29.55 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.57 0.748 . . . . 74.53 110.189 -176.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -67.37 -31.63 72.0 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.903 0.881 . . . . 74.23 112.11 -176.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 16.8 m -58.42 -27.02 63.92 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.123 0.569 . . . . 72.25 112.224 174.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 42.1 m-20 -75.6 -22.34 57.0 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.071 0.549 . . . . 70.42 111.116 178.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.508 ' HA ' HG23 ' A' ' 104' ' ' VAL . 47.9 t -91.16 105.84 16.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 124.335 1.054 . . . . 71.24 109.616 -171.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 19.3 m -129.75 112.84 14.02 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.059 0.544 . . . . 73.44 111.318 -174.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 65.5 m95 -87.34 119.34 27.51 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.683 0.793 . . . . 72.21 111.351 177.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -137.85 115.06 10.97 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.437 1.095 . . . . 71.43 108.64 172.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 64.26 43.7 96.62 Favored Glycine 0 C--N 1.351 1.404 0 O-C-N 124.05 0.844 . . . . 71.34 113.63 175.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 63.07 17.55 10.23 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 124.97 1.308 . . . . 74.52 111.672 179.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 25.4 m -118.56 119.78 35.53 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 107.087 -1.449 . . . . 71.03 107.087 175.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.412 HG13 HD11 ' A' ' 81' ' ' LEU . 7.7 p -99.04 115.65 40.13 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 N-CA-C 109.013 -0.736 . . . . 75.32 109.013 178.188 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 41.7 m -94.52 118.52 31.79 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 107.913 -1.143 . . . . 70.43 107.913 177.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.508 HG23 ' HA ' ' A' ' 95' ' ' VAL . 55.9 t -128.54 114.97 35.73 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 C-N-CA 123.994 0.917 . . . . 74.31 108.609 -178.236 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . 0.465 ' HA ' ' O ' ' A' ' 56' ' ' VAL . 3.4 mp0 -85.1 110.95 19.33 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 108.007 -1.109 . . . . 73.55 108.007 171.219 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -104.11 148.14 16.77 Favored Glycine 0 C--N 1.337 0.629 0 N-CA-C 109.747 -1.341 . . . . 75.35 109.747 179.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -131.94 143.37 50.07 Favored 'General case' 0 C--O 1.241 0.658 0 CA-C-O 121.216 0.531 . . . . 71.23 110.518 -173.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -147.74 157.76 43.69 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-N 114.702 -1.135 . . . . 75.03 109.486 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -94.98 -25.87 16.33 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.581 0.752 . . . . 70.41 109.408 170.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . 0.536 ' HA2' ' HB3' ' A' ' 49' ' ' LYS . . . 89.27 -60.96 3.68 Favored Glycine 0 C--N 1.341 0.858 0 CA-C-N 115.585 -0.734 . . . . 63.02 111.773 -177.157 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 33.7 m -78.93 156.15 4.85 Favored 'Isoleucine or valine' 0 C--O 1.244 0.8 0 C-N-CA 123.593 0.757 . . . . 70.33 109.986 173.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -66.1 145.06 56.28 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 122.777 0.431 . . . . 73.32 110.538 -177.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 86.2 mt -82.19 -7.1 59.61 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.997 0.919 . . . . 64.11 113.358 -170.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -83.78 -162.61 0.66 Allowed 'General case' 0 N--CA 1.488 1.449 0 CA-C-N 118.142 0.428 . . . . 73.31 110.463 174.186 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 67.1 m-70 -67.33 79.26 0.15 Allowed 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 109.536 -0.542 . . . . 74.35 109.536 177.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 56.9 t-80 -76.04 121.73 23.19 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 121.128 0.489 . . . . 64.43 111.816 -169.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 11.8 m170 -97.35 119.56 36.1 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 108.317 -0.994 . . . . 74.25 108.317 169.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 14.2 t-80 -81.8 94.65 7.08 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 108.452 -0.944 . . . . 72.11 108.452 169.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 23.1 p80 -72.17 159.98 33.2 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 116.021 -0.536 . . . . 74.54 111.25 -175.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 53.4 t-80 . . . . . 0 C--O 1.249 1.028 0 N-CA-C 107.464 -1.31 . . . . 71.41 107.464 174.487 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.48 1.046 0 N-CA-C 109.01 -0.737 . . . . 73.23 109.01 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.3 p -87.02 138.78 31.2 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.209 0.603 . . . . 71.31 110.03 -179.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -165.1 56.91 0.26 Allowed Glycine 0 C--N 1.337 0.61 0 N-CA-C 110.215 -1.154 . . . . 71.43 110.215 179.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.533 ' HE3' ' HA ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -115.33 131.53 56.9 Favored 'General case' 0 C--O 1.239 0.513 0 CA-C-N 114.565 -0.817 . . . . 75.4 110.801 -176.051 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.634 ' HB3' ' HZ2' ' A' ' 5' ' ' LYS . 5.7 ttpm? -88.8 105.35 17.67 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 107.241 -1.392 . . . . 72.32 107.241 162.316 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.8 p -97.1 143.18 12.9 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 N-CA-C 108.901 -0.777 . . . . 74.45 108.901 -178.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.52 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 49.6 mt-10 -106.97 111.71 24.33 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 108.107 -1.072 . . . . 74.22 108.107 176.109 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 95.7 t -101.17 116.27 44.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 C-N-CA 124.773 1.229 . . . . 74.52 108.952 -175.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -96.64 101.34 12.93 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 107.982 -1.118 . . . . 72.3 107.982 -178.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 84.6 t -93.69 108.11 20.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 N-CA-C 108.434 -0.95 . . . . 72.52 108.434 179.127 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -108.07 137.81 45.42 Favored 'General case' 0 C--O 1.224 -0.255 0 C-N-CA 124.748 1.219 . . . . 75.53 107.718 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.485 HD12 HG13 ' A' ' 48' ' ' ILE . 11.9 tt -143.98 136.57 23.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 CA-C-N 118.405 0.548 . . . . 74.51 110.966 176.642 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 28.0 m -101.9 120.48 40.47 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 108.66 -0.867 . . . . 71.12 108.66 173.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.6 ' SG ' HG22 ' A' ' 48' ' ' ILE . 0.9 OUTLIER -157.58 137.96 12.8 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.467 1.107 . . . . 75.32 109.201 -178.99 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.418 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 3.1 t-20 75.89 -46.33 0.55 Allowed 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 126.107 1.763 . . . . 74.52 112.482 179.378 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 155.44 2.02 0.12 Allowed Glycine 0 CA--C 1.522 0.52 0 N-CA-C 110.949 -0.86 . . . . 73.42 110.949 -175.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 49.3 mtpt -119.13 162.63 18.32 Favored 'General case' 0 C--N 1.355 0.822 0 C-N-CA 123.976 0.91 . . . . 75.24 109.621 -178.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.0 m -117.74 114.91 24.01 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 108.605 -0.887 . . . . 74.24 108.605 176.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -101.34 100.16 10.62 Favored 'General case' 0 C--O 1.24 0.563 0 N-CA-C 106.536 -1.653 . . . . 73.43 106.536 -175.039 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -134.48 145.2 48.59 Favored 'General case' 0 C--O 1.243 0.724 0 C-N-CA 123.361 0.665 . . . . 64.43 110.589 -173.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.8 ttm180 -167.71 144.71 4.3 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.619 0.768 . . . . 73.03 109.755 -179.144 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 28.1 m -87.6 108.74 19.21 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.645 0.778 . . . . 62.22 109.484 175.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -97.81 128.45 44.46 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.778 0.831 . . . . 75.22 109.48 -178.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.52 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 26.8 mp0 -93.87 109.15 20.86 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 108.414 -0.958 . . . . 74.44 108.414 -176.34 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 78.5 mt -120.04 106.73 12.27 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.533 1.133 . . . . 74.25 109.469 -175.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.504 ' HA ' ' HA ' ' A' ' 5' ' ' LYS . 61.9 t80 -95.23 142.0 28.17 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 122.745 0.418 . . . . 74.02 110.312 175.087 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.505 ' HB2' ' HB2' ' A' ' 32' ' ' GLU . . . -148.46 149.16 31.19 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 123.43 0.692 . . . . 73.12 110.243 174.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.0 t -86.13 -21.89 7.41 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.043 0 C-N-CA 124.613 1.165 . . . . 63.04 109.463 175.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.61 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 48.2 mtp180 -131.47 141.77 49.85 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 108.025 -1.102 . . . . 72.24 108.025 171.493 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -64.45 -19.39 65.51 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 122.565 0.346 . . . . 70.01 111.027 174.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 -66.78 -33.36 75.46 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.284 0.634 . . . . 71.44 111.621 170.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.61 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 8.4 mm-40 -68.83 -25.81 64.85 Favored 'General case' 0 N--CA 1.49 1.544 0 CA-C-N 117.871 0.305 . . . . 74.34 110.47 177.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.565 HD21 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -71.37 -25.39 62.35 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 123.426 0.691 . . . . 73.44 111.146 -177.901 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.41 ' HG2' HG21 ' A' ' 80' ' ' ILE . 57.3 mtpt -56.97 -52.18 66.27 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.786 0.834 . . . . 75.14 112.28 -176.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -61.46 -35.43 77.58 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.095 0.558 . . . . 72.43 111.645 179.495 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.565 ' HD2' HD21 ' A' ' 33' ' ' LEU . 65.4 mttm -65.88 -45.33 82.45 Favored 'General case' 0 C--N 1.352 0.7 0 C-N-CA 123.573 0.749 . . . . 74.45 109.988 -178.078 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 71.9 mt -58.39 -47.7 83.01 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 124.518 1.136 . . . . 75.5 110.843 176.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -58.41 -43.02 88.47 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 123.903 0.752 . . . . 63.21 111.346 178.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -70.85 -41.38 71.54 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.585 0.754 . . . . 73.41 112.52 -178.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 36' ' ' LYS . 94.5 t -64.66 -42.15 94.23 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 C-N-CA 123.234 0.614 . . . . 73.22 110.46 175.591 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.545 HD21 HD11 ' A' ' 60' ' ' ILE . 35.7 mt -64.74 -48.95 72.69 Favored 'General case' 0 C--O 1.212 -0.874 0 CA-C-N 115.481 -0.781 . . . . 64.42 110.135 179.129 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -63.04 -34.65 78.04 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.18 0.592 . . . . 50.51 111.678 177.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.636 ' HG3' ' H ' ' A' ' 120' ' ' HIS . 4.3 tm-20 -68.86 -40.19 79.47 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.134 0.574 . . . . 63.43 110.079 178.321 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.41 ' HA ' ' CZ ' ' A' ' 44' ' ' ARG . 0.0 OUTLIER -76.14 -30.14 58.05 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 123.729 0.812 . . . . 75.45 111.337 179.166 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.455 ' SD ' HD13 ' A' ' 12' ' ' ILE . 87.7 mmm -91.1 -15.8 28.86 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 124.272 1.029 . . . . 74.13 112.35 -175.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.573 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 14.4 t70 -68.24 -50.77 28.1 Favored Pre-proline 0 CA--C 1.555 1.172 0 CA-C-O 118.247 -0.882 . . . . 73.41 112.038 -175.732 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.478 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 38.8 Cg_endo -63.08 -23.47 73.54 Favored 'Trans proline' 0 C--N 1.391 2.786 0 C-N-CA 121.812 1.675 . . . . 73.31 111.837 176.339 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.6 HG22 ' SG ' ' A' ' 14' ' ' CYS . 49.1 mm -71.12 -30.34 40.38 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 C-N-CA 124.788 1.235 . . . . 61.43 111.149 -177.244 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.573 ' HE2' ' HA ' ' A' ' 46' ' ' ASP . 45.7 mtmt -73.31 -36.99 66.33 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 122.87 0.468 . . . . 75.13 109.994 176.126 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.5 tmmm? -67.03 -31.48 72.05 Favored 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 123.398 0.679 . . . . 75.33 110.476 173.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 81.8 mt -72.6 -36.45 68.11 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 122.671 0.388 . . . . 75.12 110.021 173.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.57 40.51 18.37 Favored Glycine 0 C--N 1.345 1.083 0 CA-C-N 115.672 -0.695 . . . . 74.04 113.421 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.418 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 94.8 m -77.21 109.77 11.36 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 109.493 -0.558 . . . . 60.44 109.493 174.4 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -63.53 -51.46 65.37 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.978 0.911 . . . . 72.31 110.697 -174.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 68.5 ttt180 -111.36 133.5 53.63 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 109.313 -0.625 . . . . 74.42 109.313 174.007 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 31.5 m -126.34 146.11 32.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 124.002 0.921 . . . . 74.11 109.455 178.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.402 ' O ' ' HA ' ' A' ' 12' ' ' ILE . 24.7 ttm180 -110.0 104.8 13.75 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 108.663 -0.866 . . . . 73.1 108.663 173.064 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 38.0 mt -101.34 105.91 18.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 N-CA-C 108.697 -0.853 . . . . 73.23 108.697 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 11.7 t -103.85 104.7 14.74 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 108.928 -0.767 . . . . 61.24 108.928 178.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.545 HD11 HD21 ' A' ' 41' ' ' LEU . 73.9 mt -96.51 112.43 28.63 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 124.266 1.026 . . . . 75.32 108.921 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 70.4 ttt180 -101.08 120.08 39.68 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 108.019 -1.104 . . . . 73.43 108.019 174.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 4.1 p -95.21 144.67 9.46 Favored 'Isoleucine or valine' 0 C--O 1.243 0.729 0 N-CA-C 108.433 -0.951 . . . . 74.14 108.433 -178.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -92.05 144.17 25.72 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 109.137 -0.69 . . . . 75.42 109.137 177.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -117.32 154.87 30.51 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 124.162 0.985 . . . . 75.11 109.112 -167.725 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 36.7 t -64.54 -56.0 16.88 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 124.311 1.007 . . . . 75.14 111.598 -175.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -149.26 159.63 44.09 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 115.474 -0.784 . . . . 74.51 109.867 -167.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.73 -20.26 65.93 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 114.091 1.145 . . . . 73.25 114.091 -174.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -88.05 -31.05 19.48 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.175 0.59 . . . . 72.13 110.247 170.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 46.0 mm-40 -79.72 -11.25 59.85 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 114.913 -1.04 . . . . 74.55 113.298 -177.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -38.5 -51.45 1.59 Allowed 'General case' 0 N--CA 1.5 2.064 0 C-N-CA 124.381 1.072 . . . . 64.12 112.561 -179.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -80.93 -29.63 35.46 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 114.215 -1.357 . . . . 74.1 111.814 -172.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 56.7 tptt -74.46 -35.82 63.33 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.679 0.792 . . . . 72.41 110.458 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -84.94 -29.11 25.39 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.311 0.644 . . . . 72.24 110.157 -179.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.26 -47.67 75.9 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 123.897 0.748 . . . . 75.21 110.602 173.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp -73.79 -30.28 62.66 Favored 'General case' 0 CA--C 1.551 1.005 0 CA-C-N 116.093 -0.503 . . . . 72.32 111.395 179.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.592 ' HB2' ' HZ3' ' A' ' 76' ' ' LYS . 4.6 ttmp? -57.43 -52.24 66.16 Favored 'General case' 0 N--CA 1.487 1.412 0 CA-C-O 121.438 0.637 . . . . 74.44 109.783 168.847 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -70.8 -19.2 62.71 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-N 114.742 -1.117 . . . . 74.32 111.812 179.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.442 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -61.61 -43.72 98.33 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 117.942 0.337 . . . . 60.23 110.665 174.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.83 -44.16 77.86 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.222 0.609 . . . . 72.24 111.569 174.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.41 HG21 ' HG2' ' A' ' 34' ' ' LYS . 35.2 mm -61.68 -46.71 95.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 C-N-CA 124.172 0.989 . . . . 74.43 111.476 -178.048 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.58 HD13 HG12 ' A' ' 102' ' ' VAL . 51.0 mt -76.53 -30.86 57.32 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.835 0.854 . . . . 74.42 111.118 -178.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 61.4 t30 -60.06 -39.27 85.43 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.207 0.603 . . . . 72.21 109.965 176.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -67.35 -43.28 81.92 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 115.104 -0.953 . . . . 75.24 111.336 175.316 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.408 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 42.8 t -64.36 -50.39 76.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 123.676 0.79 . . . . 75.21 110.676 -174.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.515 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 20.0 m-85 -66.22 -27.03 67.67 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.611 0.764 . . . . 71.25 111.239 -179.439 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.9 -35.58 78.73 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.324 0.649 . . . . 61.52 111.199 172.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -84.79 -1.99 57.09 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.73 0.812 . . . . 72.2 110.606 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 96.3 mt -107.21 -29.48 9.31 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.124 0.97 . . . . 73.01 110.415 176.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 103.44 9.28 38.9 Favored Glycine 0 C--N 1.351 1.389 0 C-N-CA 123.179 0.419 . . . . 62.23 114.121 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.515 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 27.0 m-85 -83.49 135.58 34.61 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.38 0.672 . . . . 74.22 110.052 174.777 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -91.71 168.31 11.57 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 123.814 0.846 . . . . 74.25 110.705 -177.172 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -59.43 -30.65 68.64 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 123.982 0.913 . . . . 63.32 111.254 175.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 54.8 p -65.84 -39.56 90.91 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.175 0.99 . . . . 64.54 111.103 177.209 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -72.17 -22.9 61.22 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.558 0.743 . . . . 74.24 111.241 178.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 88.7 t -96.36 128.38 47.61 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 C-N-CA 124.193 0.997 . . . . 62.24 110.203 -175.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 9.0 t -128.36 141.09 51.53 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.08 0.552 . . . . 62.41 109.885 170.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.442 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 59.9 m95 -111.86 136.76 50.74 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.904 0.882 . . . . 70.11 109.847 178.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -143.11 87.4 1.97 Allowed 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.494 1.118 . . . . 72.14 108.076 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 72.45 -83.65 0.55 Allowed Glycine 0 C--N 1.348 1.24 0 CA-C-N 115.28 -0.873 . . . . 73.24 113.613 176.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 29.4 p-10 -126.66 -6.4 6.3 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.145 0.978 . . . . 74.23 111.745 -175.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 25.8 m -116.18 133.08 56.42 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.641 0.776 . . . . 74.32 109.202 -176.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.58 HG12 HD13 ' A' ' 81' ' ' LEU . 4.8 p -115.39 123.05 70.52 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 C-N-CA 124.057 0.943 . . . . 74.51 108.947 176.491 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 61.0 m -107.08 114.83 29.14 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 108.633 -0.877 . . . . 62.13 108.633 176.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 49.1 t -109.11 110.73 33.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 C-N-CA 123.797 0.839 . . . . 75.14 108.786 175.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -95.56 111.95 23.77 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 107.971 -1.122 . . . . 73.01 107.971 173.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -118.72 177.73 16.5 Favored Glycine 0 C--O 1.24 0.526 0 O-C-N 123.801 0.688 . . . . 44.31 112.24 -176.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -122.86 143.49 49.84 Favored 'General case' 0 C--O 1.243 0.721 0 C-N-CA 123.804 0.842 . . . . 75.42 108.946 177.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.474 HD21 ' HA ' ' A' ' 49' ' ' LYS . 10.3 mp -78.46 169.73 17.79 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 115.5 -0.773 . . . . 74.41 110.668 176.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 61.8 26.74 16.26 Favored 'General case' 0 CA--C 1.558 1.281 0 O-C-N 124.294 0.996 . . . . 73.41 110.572 178.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -59.65 -73.94 0.42 Allowed Glycine 0 C--N 1.351 1.411 0 CA-C-N 115.562 -0.745 . . . . 74.4 112.532 -178.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 92.1 t -142.15 -61.95 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 N-CA-C 106.101 -1.815 . . . . 72.12 106.101 168.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 177.23 136.61 0.07 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 126.381 1.872 . . . . 70.21 107.181 176.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 52.3 mt -72.79 -66.47 0.66 Allowed 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 106.733 -1.581 . . . . 72.41 106.733 170.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -158.8 -176.7 6.03 Favored 'General case' 0 CA--C 1.55 0.965 0 CA-C-N 113.58 -1.645 . . . . 71.23 106.923 162.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 64.5 m80 -68.97 158.24 35.1 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 122.709 0.404 . . . . 73.45 110.54 176.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 47.5 t60 -62.61 119.29 8.93 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.367 0.667 . . . . 74.14 110.837 179.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 17.2 t-80 -109.55 139.41 44.59 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 106.076 -1.824 . . . . 74.32 106.076 161.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 58.1 t60 -55.12 -51.65 65.76 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.913 0.885 . . . . 74.22 112.588 -169.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 45.4 t-80 -159.84 161.61 34.52 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 115.352 -0.84 . . . . 74.01 109.383 -176.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . 0.636 ' H ' ' HG3' ' A' ' 43' ' ' GLU . 41.4 t-80 . . . . . 0 C--O 1.248 0.98 0 C-N-CA 123.761 0.824 . . . . 75.12 108.872 173.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.404 ' N ' ' SD ' ' A' ' 1' ' ' MET . 1.5 mpt? . . . . . 0 N--CA 1.482 1.15 0 CA-C-O 120.904 0.383 . . . . 74.41 110.714 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.8 m -75.3 166.41 23.66 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 123.834 0.854 . . . . 73.32 109.861 170.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 69.89 54.38 12.15 Favored Glycine 0 C--N 1.346 1.123 0 N-CA-C 110.784 -0.926 . . . . 75.14 110.784 -173.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.2 tptp -105.73 137.38 43.69 Favored 'General case' 0 C--O 1.24 0.602 0 C-N-CA 123.567 0.747 . . . . 74.32 110.588 -171.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -86.18 121.9 29.42 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 108.455 -0.943 . . . . 72.41 108.455 169.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.424 HG22 HG21 ' A' ' 62' ' ' VAL . 0.9 OUTLIER -113.17 137.62 45.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 C-N-CA 124.662 1.185 . . . . 74.11 108.108 177.795 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -104.25 112.11 25.0 Favored 'General case' 0 C--O 1.242 0.678 0 N-CA-C 108.181 -1.044 . . . . 75.31 108.181 171.295 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 62.3 t -96.16 106.08 17.88 Favored 'Isoleucine or valine' 0 C--N 1.345 0.373 0 C-N-CA 125.141 1.376 . . . . 72.43 107.98 -176.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -96.81 99.81 11.37 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 108.063 -1.088 . . . . 72.33 108.063 -172.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.8 t -99.15 112.0 30.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 124.115 0.966 . . . . 70.21 109.726 -174.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.484 ' HB3' ' HB3' ' A' ' 59' ' ' SER . 26.6 ttpp -118.56 103.85 10.11 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 107.874 -1.158 . . . . 72.14 107.874 177.604 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.443 HD12 HG13 ' A' ' 48' ' ' ILE . 14.6 tt -113.94 129.84 69.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 123.441 0.696 . . . . 74.24 110.319 -173.38 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 84.8 m -97.82 117.8 32.94 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 109.394 -0.595 . . . . 75.43 109.394 174.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.714 ' SG ' HG21 ' A' ' 48' ' ' ILE . 49.1 t -129.48 118.18 21.69 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.332 1.053 . . . . 53.32 109.171 -178.581 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.562 ' HB2' ' SG ' ' A' ' 53' ' ' CYS . 6.4 t-20 74.3 -1.28 3.12 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 125.341 1.456 . . . . 74.45 112.263 170.338 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 123.41 -6.02 9.27 Favored Glycine 0 C--N 1.351 1.368 0 CA-C-O 119.874 -0.404 . . . . 71.05 113.415 -178.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -108.5 147.38 31.79 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.398 0.679 . . . . 75.51 110.242 179.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 40.2 m -112.31 115.45 28.77 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.717 0.807 . . . . 72.1 110.057 -176.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.401 ' HH ' HD13 ' A' ' 51' ' ' LEU . 61.6 m-85 -110.79 112.74 24.82 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.446 1.098 . . . . 74.24 109.066 -175.406 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -112.93 140.51 47.68 Favored 'General case' 0 N--CA 1.485 1.286 0 CA-C-N 118.329 0.513 . . . . 74.43 110.537 -179.517 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 17.3 tpt180 -161.23 120.46 2.54 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.357 0.663 . . . . 75.12 110.059 -175.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 61.8 m -89.27 116.32 27.4 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.551 0.74 . . . . 74.33 110.013 174.201 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -98.27 136.82 37.91 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.124 0.97 . . . . 74.33 108.764 176.138 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 25.6 mp0 -101.78 111.71 24.06 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 108.823 -0.806 . . . . 73.32 108.823 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.422 ' HB2' HG12 ' A' ' 6' ' ' VAL . 89.9 mt -112.52 161.09 17.15 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.061 0.944 . . . . 75.52 109.893 -179.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 86.1 t80 -151.95 129.38 11.36 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 108.752 -0.833 . . . . 72.41 108.752 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.523 ' HB2' ' HB2' ' A' ' 32' ' ' GLU . . . -150.89 146.21 26.15 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 122.611 0.364 . . . . 72.34 111.171 -179.311 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 48.6 t -65.66 -52.41 50.89 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 O-C-N 124.506 1.129 . . . . 74.15 109.802 175.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 -113.56 160.99 17.94 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 115.371 -0.832 . . . . 70.34 110.167 -177.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.476 ' HB2' HG13 ' A' ' 80' ' ' ILE . 21.6 p-10 -69.59 -28.42 65.94 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.489 0.715 . . . . 71.04 109.969 173.518 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -55.09 -39.44 69.3 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.398 1.079 . . . . 74.33 111.387 170.001 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.523 ' HB2' ' HB2' ' A' ' 27' ' ' ALA . 19.5 mm-40 -77.48 -20.86 53.71 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.271 -0.877 . . . . 73.01 111.677 -177.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.01 -27.86 64.0 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 122.682 0.393 . . . . 72.12 110.556 178.214 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 20.7 mtpp -54.14 -60.25 3.58 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.225 1.01 . . . . 75.45 112.823 -177.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -53.22 -33.96 55.1 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 124.392 1.077 . . . . 75.55 112.132 178.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 52.4 mttm -77.93 -37.43 47.77 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.643 0.777 . . . . 73.21 110.819 -175.182 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.555 HD13 HD23 ' A' ' 81' ' ' LEU . 93.7 mt -65.19 -40.6 94.44 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.445 0.698 . . . . 73.23 111.202 172.868 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 58.1 mtpt -59.69 -40.83 89.16 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.203 0.601 . . . . 74.45 110.637 174.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt -65.91 -53.05 44.55 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 123.562 0.539 . . . . 75.5 111.42 175.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 20.8 t -53.49 -45.15 58.0 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 C-N-CA 124.14 0.976 . . . . 74.1 112.134 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.534 HD23 HD11 ' A' ' 60' ' ' ILE . 97.2 mt -72.94 -51.28 19.06 Favored 'General case' 0 CA--C 1.54 0.577 0 O-C-N 123.58 0.55 . . . . 70.31 111.3 -178.479 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -67.1 -40.39 86.91 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 122.924 0.49 . . . . 73.22 112.006 -174.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -62.05 -43.27 99.19 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.576 0.35 . . . . 64.42 110.079 174.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.1 tpp180 -62.12 -41.99 98.78 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.531 0.732 . . . . 75.32 111.078 176.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.489 ' SD ' HD11 ' A' ' 58' ' ' ILE . 83.2 mtp -94.41 6.91 47.31 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 112.822 0.675 . . . . 74.2 112.822 -169.74 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -75.84 -48.82 3.62 Favored Pre-proline 0 CA--C 1.56 1.363 0 CA-C-O 118.741 -0.647 . . . . 75.25 110.444 168.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.455 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 31.4 Cg_exo -51.97 -37.76 67.99 Favored 'Trans proline' 0 C--N 1.396 3.057 0 C-N-CA 122.146 1.897 . . . . 74.24 112.72 166.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.714 HG21 ' SG ' ' A' ' 14' ' ' CYS . 50.6 mm -66.64 -30.47 49.82 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.35 0 C-N-CA 124.286 1.035 . . . . 74.14 111.528 -173.015 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -66.91 -45.28 78.43 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 123.399 0.679 . . . . 64.14 110.191 173.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.4 tmmm? -61.75 -34.74 76.39 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 114.695 -1.138 . . . . 65.14 111.193 176.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.495 HD11 HD13 ' A' ' 48' ' ' ILE . 85.3 mt -72.39 -29.03 63.37 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.192 0.597 . . . . 75.05 110.811 176.669 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 68.93 83.23 0.17 Allowed Glycine 0 C--N 1.353 1.498 0 O-C-N 123.976 0.798 . . . . 65.24 112.188 174.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.562 ' SG ' ' HB2' ' A' ' 15' ' ' ASN . 89.5 m -123.98 134.51 53.46 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.272 0.629 . . . . 62.14 110.701 -174.209 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -63.66 -65.5 0.67 Allowed 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.554 0.741 . . . . 74.12 110.156 177.075 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 31.9 ttt180 -127.99 126.94 42.33 Favored 'General case' 0 C--O 1.241 0.616 0 C-N-CA 124.019 0.928 . . . . 73.2 108.577 -176.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.456 HG23 ' HE2' ' A' ' 45' ' ' MET . 34.0 m -115.91 140.54 37.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 C-N-CA 123.155 0.582 . . . . 71.13 109.664 179.192 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 24.4 ttm180 -105.96 106.89 17.61 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 108.417 -0.957 . . . . 74.41 108.417 177.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.489 HD11 ' SD ' ' A' ' 45' ' ' MET . 50.9 mt -93.9 114.0 29.7 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 N-CA-C 107.993 -1.114 . . . . 64.32 107.993 179.498 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.484 ' HB3' ' HB3' ' A' ' 11' ' ' LYS . 37.2 t -102.86 102.27 12.37 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.21 -1.033 . . . . 74.24 108.21 -177.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.534 HD11 HD23 ' A' ' 41' ' ' LEU . 78.9 mt -104.85 115.83 47.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 123.409 0.684 . . . . 73.15 109.555 -177.751 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -109.77 129.4 55.63 Favored 'General case' 0 C--O 1.238 0.471 0 N-CA-C 108.518 -0.919 . . . . 75.34 108.518 171.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.424 HG21 HG22 ' A' ' 6' ' ' VAL . 12.4 p -94.97 148.32 5.13 Favored 'Isoleucine or valine' 0 C--O 1.246 0.899 0 N-CA-C 108.293 -1.002 . . . . 74.13 108.293 177.106 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 24.2 ttmm -80.49 137.5 36.46 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 108.813 -0.81 . . . . 73.22 108.813 172.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 31.8 m170 -85.38 128.97 34.9 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.069 0.948 . . . . 74.42 110.446 -173.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 28.0 m -66.23 -65.79 0.63 Allowed 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.713 0.805 . . . . 75.32 111.061 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.455 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 29.6 t70 -162.53 151.98 15.66 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.758 0.823 . . . . 74.01 108.887 -178.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.78 -32.33 63.39 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 124.316 1.047 . . . . 51.13 113.282 -174.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.2 -41.9 89.53 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.054 0.541 . . . . 74.42 110.658 174.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -70.71 -50.03 40.73 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-N 115.157 -0.929 . . . . 74.22 111.592 -177.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 58.0 mt-10 -43.53 -34.56 1.41 Allowed 'General case' 0 N--CA 1.501 2.081 0 C-N-CA 126.026 1.73 . . . . 75.21 115.431 -163.503 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -65.44 -51.27 61.38 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.773 0.829 . . . . 74.23 110.77 -178.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -81.93 -29.93 32.04 Favored 'General case' 0 CA--C 1.552 1.054 0 CA-C-N 115.103 -0.953 . . . . 72.4 111.053 177.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -68.84 -39.08 80.13 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 124.509 1.124 . . . . 73.43 110.3 -173.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.08 -49.69 69.06 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 115.517 -0.765 . . . . 72.31 111.098 177.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -59.97 -40.57 89.51 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.424 1.09 . . . . 72.43 111.503 177.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 68.6 tttt -64.6 -50.59 66.6 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.26 1.424 . . . . 75.13 110.543 -179.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -75.28 -23.69 57.44 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 115.812 -0.631 . . . . 72.05 110.266 -177.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.61 -33.41 72.62 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.584 0.753 . . . . 74.32 110.784 174.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.8 -40.93 83.86 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.422 0.689 . . . . 64.52 110.829 173.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.476 HG13 ' HB2' ' A' ' 30' ' ' ASP . 46.2 mm -67.86 -41.82 85.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.023 0.929 . . . . 73.33 110.794 178.614 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.555 HD23 HD13 ' A' ' 37' ' ' LEU . 42.3 mt -63.96 -47.74 79.25 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.54 0.736 . . . . 64.23 109.533 176.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -55.84 -42.95 76.55 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 124.669 1.187 . . . . 61.13 111.337 -177.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.453 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 43.4 mmtm -67.2 -41.59 85.56 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 115.562 -0.745 . . . . 73.32 111.33 179.291 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.404 HG23 ' HB2' ' A' ' 37' ' ' LEU . 54.4 t -64.68 -40.72 90.02 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.119 0 C-N-CA 123.378 0.671 . . . . 73.4 110.301 -178.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.529 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 19.6 m-85 -64.95 -39.99 94.34 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.265 -0.88 . . . . 75.33 110.53 177.51 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -68.11 -24.33 65.02 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.199 0.6 . . . . 75.11 111.95 176.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.453 ' HG3' ' O ' ' A' ' 83' ' ' LYS . 45.9 mt-10 -80.95 -20.94 40.88 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.651 0.78 . . . . 73.42 111.018 178.08 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.1 mt -106.68 -22.71 12.66 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 122.968 0.507 . . . . 74.52 110.923 -173.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 103.54 39.97 2.47 Favored Glycine 0 C--N 1.351 1.403 0 C-N-CA 123.153 0.406 . . . . 62.1 114.054 177.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.529 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 10.1 m-85 -112.76 134.6 54.2 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 107.432 -1.322 . . . . 74.21 107.432 169.625 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 -83.61 158.37 21.93 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.447 0.699 . . . . 74.54 110.092 -175.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.79 -39.66 78.04 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 124.491 1.117 . . . . 73.4 111.539 177.509 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 22.6 t -60.57 -35.64 76.56 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 124.452 1.101 . . . . 73.54 111.761 178.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -65.3 -26.41 68.06 Favored 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 124.222 1.009 . . . . 74.44 111.977 178.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.482 HG23 HG11 ' A' ' 104' ' ' VAL . 47.1 t -90.91 117.88 35.04 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 124.219 1.007 . . . . 74.1 109.174 -177.51 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 20.7 m -134.65 106.78 7.13 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.598 0.759 . . . . 72.12 109.958 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 69.3 m95 -68.97 109.95 4.2 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 122.731 0.413 . . . . 70.24 110.167 176.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -107.73 96.92 6.73 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 107.993 -1.114 . . . . 74.0 107.993 177.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 68.37 -120.32 11.51 Favored Glycine 0 C--N 1.343 0.927 0 O-C-N 123.675 0.609 . . . . 54.32 112.415 -178.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -79.67 -32.55 41.5 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 124.663 1.185 . . . . 73.42 110.335 -178.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 20.2 m -105.84 148.8 27.14 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.946 0.899 . . . . 74.21 110.129 -169.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.9 p -104.06 136.49 37.03 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 CA-C-O 121.274 0.559 . . . . 73.31 110.012 177.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 27.6 m -103.67 100.02 9.83 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.467 1.507 . . . . 75.11 108.198 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.482 HG11 HG23 ' A' ' 95' ' ' VAL . 42.0 t -108.71 109.6 28.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 N-CA-C 108.23 -1.026 . . . . 73.3 108.23 -179.612 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -106.49 109.58 21.54 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 109.855 -0.424 . . . . 73.43 109.855 -176.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -115.12 137.41 13.91 Favored Glycine 0 C--N 1.333 0.373 0 N-CA-C 110.552 -1.019 . . . . 70.54 110.552 179.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -87.83 139.76 30.2 Favored 'General case' 0 C--O 1.242 0.674 0 N-CA-C 108.823 -0.806 . . . . 74.21 108.823 173.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.703 HD11 HG22 ' A' ' 48' ' ' ILE . 36.0 mt -73.54 158.16 35.38 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-O 121.448 0.642 . . . . 72.13 111.977 -177.487 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -63.14 -35.22 79.57 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 114.246 -1.343 . . . . 71.35 110.01 164.156 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 67.87 -171.5 34.68 Favored Glycine 0 C--N 1.357 1.746 0 CA-C-N 114.96 -1.018 . . . . 74.34 112.672 -179.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 47.5 t 73.16 -58.14 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 C-N-CA 126.025 1.73 . . . . 74.23 112.466 175.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -54.3 103.62 0.09 Allowed 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 126.345 1.858 . . . . 74.13 112.427 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 78.4 mt -112.63 149.32 32.99 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.762 1.225 . . . . 75.24 108.498 173.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -70.89 148.26 47.95 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 112.183 0.438 . . . . 72.54 112.183 -173.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 9.9 t-160 -103.89 18.65 21.53 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 108.95 -0.759 . . . . 74.34 108.95 167.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -85.19 151.71 23.89 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.428 0.691 . . . . 63.34 110.032 175.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 78.2 t60 -148.84 34.65 0.76 Allowed 'General case' 0 N--CA 1.48 1.068 0 CA-C-O 122.22 1.01 . . . . 63.42 108.313 175.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 18.4 t60 -69.03 -20.64 64.13 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 114.958 -1.019 . . . . 72.44 110.331 178.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 63.2 t-80 -62.22 115.71 4.38 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.984 0.914 . . . . 75.0 110.456 173.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 7.7 m170 . . . . . 0 C--O 1.246 0.916 0 C-N-CA 124.596 1.158 . . . . 72.2 108.899 174.686 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 47.2 tpp . . . . . 0 N--CA 1.478 0.943 0 N-CA-C 110.414 -0.217 . . . . 73.13 110.414 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.5 m -73.98 83.94 1.75 Allowed 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 108.931 -0.766 . . . . 62.12 108.931 168.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 158.07 59.69 0.01 OUTLIER Glycine 0 CA--C 1.507 -0.425 0 N-CA-C 109.011 -1.636 . . . . 51.4 109.011 -173.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -87.79 124.27 33.44 Favored 'General case' 0 C--O 1.239 0.523 0 CA-C-N 114.923 -0.638 . . . . 75.31 110.788 -174.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 25.3 ttpt -88.49 98.61 11.73 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 107.062 -1.459 . . . . 75.1 107.062 163.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.513 HG21 HG21 ' A' ' 62' ' ' VAL . 0.2 OUTLIER -99.23 126.62 52.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 107.54 -1.282 . . . . 74.34 107.54 -179.745 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -102.25 113.8 27.4 Favored 'General case' 0 C--O 1.24 0.554 0 N-CA-C 108.29 -1.004 . . . . 72.34 108.29 179.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 64.0 t -100.67 109.18 24.68 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 C-N-CA 124.933 1.293 . . . . 74.01 108.658 -172.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.435 ' O ' ' HA ' ' A' ' 60' ' ' ILE . 41.7 mt-30 -96.45 98.17 10.03 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 107.7 -1.222 . . . . 72.25 107.7 -176.113 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 48.6 t -94.07 104.63 15.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 N-CA-C 108.525 -0.917 . . . . 70.5 108.525 -175.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.405 ' HE3' HG21 ' A' ' 18' ' ' THR . 1.7 tmtp? -111.98 102.82 11.03 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 107.573 -1.269 . . . . 71.31 107.573 -176.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.413 ' HA ' ' O ' ' A' ' 57' ' ' ARG . 8.7 tt -119.47 124.34 72.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 122.902 0.481 . . . . 75.23 110.451 -172.047 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 39.0 m -91.5 121.71 33.44 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.269 0.628 . . . . 70.55 109.493 178.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.646 ' SG ' HG22 ' A' ' 48' ' ' ILE . 1.3 t -158.43 143.13 16.13 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.709 1.204 . . . . 74.14 109.878 -177.543 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.401 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 63.3 t30 62.44 25.32 15.1 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 124.182 0.993 . . . . 73.23 111.526 172.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 85.86 -8.19 73.95 Favored Glycine 0 C--N 1.345 1.054 0 CA-C-N 115.766 -0.652 . . . . 73.24 113.498 179.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -108.66 169.51 8.61 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.677 0.791 . . . . 75.14 110.738 -179.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.405 HG21 ' HE3' ' A' ' 11' ' ' LYS . 87.0 m -115.03 123.96 50.4 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 114.905 -1.043 . . . . 74.41 108.771 171.298 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -110.28 100.77 9.59 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 107.718 -1.216 . . . . 70.0 107.718 178.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.7 pp20? -106.27 146.39 30.42 Favored 'General case' 0 C--O 1.242 0.704 0 N-CA-C 108.982 -0.747 . . . . 72.1 108.982 177.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.1 tpt180 -157.21 124.64 5.27 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 123.305 0.378 . . . . 74.34 110.204 174.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 44.0 m -89.17 109.57 20.42 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 108.962 -0.755 . . . . 75.45 108.962 173.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -98.01 135.79 39.21 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 108.814 -0.81 . . . . 73.45 108.814 178.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -97.12 108.69 21.47 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 107.732 -1.21 . . . . 74.04 107.732 175.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 94.7 mt -115.24 137.83 51.6 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 108.233 -1.025 . . . . 73.54 108.233 -178.291 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -132.18 132.55 43.28 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 109.334 -0.617 . . . . 73.21 109.334 -175.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -156.27 149.86 24.76 Favored 'General case' 0 C--O 1.239 0.509 0 C-N-CA 123.323 0.649 . . . . 75.02 109.626 173.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 51.7 t -63.41 -37.69 80.2 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 C-N-CA 124.215 1.006 . . . . 74.11 109.869 174.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 53.4 mtt180 -130.12 145.31 51.69 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.442 0.697 . . . . 74.32 110.848 175.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 35.2 p-10 -69.53 -23.26 63.56 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.063 0.945 . . . . 73.0 111.333 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -59.26 -37.75 78.4 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.224 0.61 . . . . 73.33 110.731 170.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -81.94 -22.24 36.81 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.486 0.715 . . . . 75.44 111.348 179.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.574 HD21 ' HD2' ' A' ' 36' ' ' LYS . 0.7 OUTLIER -70.4 -22.55 62.73 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.411 1.084 . . . . 75.44 110.265 178.189 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.519 ' HG2' HG22 ' A' ' 80' ' ' ILE . 50.1 mtpt -52.79 -53.59 46.13 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 124.004 0.922 . . . . 75.04 113.168 -178.495 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -61.1 -30.14 70.18 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 123.41 0.444 . . . . 63.24 111.717 -177.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.574 ' HD2' HD21 ' A' ' 33' ' ' LEU . 58.0 mttm -67.58 -45.35 75.78 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 123.503 0.502 . . . . 71.43 110.355 174.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.442 HD11 HD23 ' A' ' 81' ' ' LEU . 95.8 mt -58.63 -44.77 90.12 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.735 0.814 . . . . 74.12 111.439 177.124 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.503 ' HG2' HG11 ' A' ' 84' ' ' VAL . 51.2 mtpt -61.25 -47.45 86.0 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 123.764 0.665 . . . . 75.41 111.044 -178.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -62.42 -52.46 63.48 Favored 'General case' 0 N--CA 1.476 0.83 0 O-C-N 123.607 0.567 . . . . 65.32 110.982 178.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 22.4 t -58.0 -42.18 82.08 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 C-N-CA 124.894 1.278 . . . . 74.0 112.52 -178.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 39.4 mt -70.35 -37.75 74.7 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.341 0.657 . . . . 74.31 110.965 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -68.06 -35.76 78.73 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 119.426 -0.321 . . . . 75.54 111.473 175.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -72.93 -45.29 58.93 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.373 0.669 . . . . 73.34 110.818 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.7 tpm_? -60.25 -41.39 93.11 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.86 0.864 . . . . 74.04 110.235 176.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.439 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 64.4 mtp -92.67 2.81 56.52 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 115.64 -0.709 . . . . 74.41 112.821 -178.222 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -65.47 -49.57 62.11 Favored Pre-proline 0 CA--C 1.553 1.07 0 CA-C-O 118.603 -0.713 . . . . 71.53 111.404 178.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.474 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 37.9 Cg_endo -63.69 -27.42 68.66 Favored 'Trans proline' 0 C--N 1.389 2.699 0 C-N-CA 121.391 1.394 . . . . 72.0 111.756 172.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.646 HG22 ' SG ' ' A' ' 14' ' ' CYS . 45.0 mm -74.19 -34.06 36.7 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.02 0 C-N-CA 124.149 0.979 . . . . 72.43 110.729 -173.534 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.601 ' HA ' HD22 ' A' ' 108' ' ' LEU . 93.0 mttt -73.9 -31.36 63.07 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.276 0.63 . . . . 73.5 110.086 176.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.8 tmmm? -76.14 -29.06 57.66 Favored 'General case' 0 CA--C 1.548 0.903 0 CA-C-N 115.108 -0.951 . . . . 73.31 109.654 175.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 92.1 mt -71.89 -32.28 67.26 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 109.08 -0.711 . . . . 71.15 109.08 173.805 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.38 40.32 33.57 Favored Glycine 0 C--N 1.349 1.253 0 CA-C-N 115.834 -0.621 . . . . 72.42 112.369 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.401 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 68.5 m -71.44 97.11 1.58 Allowed 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 109.415 -0.587 . . . . 74.24 109.415 174.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -50.9 -39.7 55.03 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 125.792 1.637 . . . . 75.41 112.539 -169.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 9.5 ttp180 -134.21 130.76 37.68 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 107.796 -1.187 . . . . 73.51 107.796 179.154 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 23.0 m -124.86 145.19 32.55 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 C-N-CA 122.897 0.479 . . . . 73.43 110.669 -178.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.499 ' HG3' HG23 ' A' ' 103' ' ' THR . 21.1 ttt180 -104.39 108.55 20.02 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 108.237 -1.024 . . . . 74.52 108.237 170.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 37.7 mt -101.62 104.25 16.08 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 N-CA-C 108.253 -1.017 . . . . 74.22 108.253 176.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 70.3 m -101.91 103.48 14.15 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 107.839 -1.171 . . . . 75.12 107.839 177.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.435 ' HA ' ' O ' ' A' ' 9' ' ' GLN . 61.5 mt -98.93 130.25 48.09 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 123.258 0.623 . . . . 72.24 109.83 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 27.8 ttm-85 -115.92 120.04 37.89 Favored 'General case' 0 C--O 1.239 0.506 0 N-CA-C 107.726 -1.212 . . . . 71.34 107.726 174.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.513 HG21 HG21 ' A' ' 6' ' ' VAL . 7.6 p -94.73 139.09 19.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 N-CA-C 108.636 -0.875 . . . . 71.12 108.636 -178.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -81.08 121.56 26.24 Favored 'General case' 0 C--O 1.24 0.596 0 N-CA-C 108.904 -0.776 . . . . 73.24 108.904 -177.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -95.19 149.99 20.7 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.626 0.77 . . . . 71.02 110.35 -176.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 23.5 m -77.32 -44.41 29.66 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.2 1.0 . . . . 71.23 111.455 -178.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -156.39 158.0 36.59 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.189 0.596 . . . . 72.43 110.473 -174.08 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.52 -44.15 89.44 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 124.599 1.16 . . . . 74.33 112.984 -176.353 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -75.6 -22.26 57.07 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 122.9 0.48 . . . . 72.13 110.892 178.085 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -84.6 -17.38 38.92 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 118.894 -0.574 . . . . 75.54 112.034 178.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -57.35 -44.01 83.94 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.096 0.558 . . . . 71.42 111.785 -179.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.423 ' HZ2' ' HB2' ' A' ' 71' ' ' LYS . 0.1 OUTLIER -62.75 -33.98 76.28 Favored 'General case' 0 N--CA 1.479 1.018 0 O-C-N 124.001 0.813 . . . . 74.41 111.17 -179.808 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -70.55 -59.42 2.85 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 109.524 -0.547 . . . . 71.13 109.524 176.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -63.4 -30.21 71.37 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.055 1.342 . . . . 64.12 112.784 -173.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.34 -55.63 15.02 Favored 'General case' 0 C--O 1.213 -0.841 0 N-CA-C 109.313 -0.625 . . . . 74.1 109.313 179.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 5.5 tmtm? -62.24 -43.8 98.0 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 125.241 1.416 . . . . 64.24 110.711 179.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 60.3 tttm -64.1 -55.44 21.97 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.427 1.491 . . . . 73.45 111.637 -175.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -75.04 -19.12 60.18 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 115.207 -0.906 . . . . 75.21 110.603 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.15 -43.18 99.03 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 122.887 0.475 . . . . 73.44 110.89 172.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.456 ' O ' ' HG2' ' A' ' 83' ' ' LYS . . . -60.1 -41.92 93.58 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 124.0 0.812 . . . . 65.23 110.482 176.22 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.519 HG22 ' HG2' ' A' ' 34' ' ' LYS . 42.8 mm -63.09 -50.64 78.58 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 124.385 1.074 . . . . 73.52 111.604 178.549 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.442 HD23 HD11 ' A' ' 37' ' ' LEU . 34.1 mt -64.35 -43.36 94.8 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.279 0.632 . . . . 72.32 110.315 -179.198 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 60.8 t30 -59.5 -40.08 85.91 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 124.505 1.122 . . . . 73.5 110.854 -177.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.456 ' HG2' ' O ' ' A' ' 79' ' ' ALA . 74.7 mmtt -69.26 -41.86 76.36 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 115.588 -0.733 . . . . 73.41 111.213 176.237 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.535 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 37.4 t -62.11 -50.64 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 123.343 0.657 . . . . 72.42 109.884 -178.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.447 ' CE2' HG21 ' A' ' 104' ' ' VAL . 28.3 m-85 -61.28 -36.19 79.37 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.099 0.96 . . . . 74.42 111.544 178.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.83 -31.91 73.01 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.426 0.691 . . . . 73.42 111.449 175.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -85.39 -12.86 51.1 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.139 0.976 . . . . 73.22 111.117 178.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 54.6 mt -98.69 0.24 44.23 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 122.783 0.433 . . . . 75.55 110.11 -178.535 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 96.13 -1.62 62.97 Favored Glycine 0 C--N 1.35 1.355 0 O-C-N 123.443 0.464 . . . . 35.42 113.374 177.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -82.25 140.34 33.71 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 109.603 -0.517 . . . . 72.15 109.603 178.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -70.36 147.33 49.71 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.062 0.545 . . . . 72.31 110.093 178.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -50.67 -55.99 13.97 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 125.288 1.435 . . . . 73.41 111.515 178.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 11.6 t -59.37 -19.92 50.67 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 124.287 1.035 . . . . 72.14 113.543 -174.035 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -74.09 -19.07 60.71 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.104 0.561 . . . . 72.14 112.139 -179.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.474 ' HA ' HG23 ' A' ' 104' ' ' VAL . 49.0 t -74.29 101.2 1.69 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 N-CA-C 107.058 -1.46 . . . . 75.01 107.058 175.62 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 8.1 m -111.43 94.16 4.83 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 109.496 -0.557 . . . . 65.24 109.496 -172.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 65.7 m95 -72.04 107.43 4.74 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 109.003 -0.74 . . . . 74.13 109.003 174.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -101.63 75.57 1.59 Allowed 'General case' 0 C--O 1.238 0.478 0 C-N-CA 124.556 1.143 . . . . 74.42 108.402 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 64.9 -88.14 0.08 OUTLIER Glycine 0 C--N 1.346 1.092 0 CA-C-N 114.988 -1.005 . . . . 72.01 112.789 -178.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -82.97 -61.3 1.9 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.461 1.105 . . . . 75.1 109.779 -178.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 11.5 m -102.5 144.26 31.17 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 114.947 -1.024 . . . . 74.31 110.302 -167.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 6.3 p -103.44 120.05 52.87 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 C-N-CA 123.032 0.533 . . . . 74.41 110.255 -178.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.499 HG23 ' HG3' ' A' ' 57' ' ' ARG . 52.5 m -99.72 110.61 23.0 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.453 1.101 . . . . 73.33 108.812 177.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.474 HG23 ' HA ' ' A' ' 95' ' ' VAL . 46.2 t -112.41 112.66 41.43 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 124.266 1.026 . . . . 74.33 108.381 -176.843 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -92.38 114.34 26.87 Favored 'General case' 0 C--O 1.24 0.599 0 N-CA-C 109.206 -0.664 . . . . 73.24 109.206 -179.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -107.79 137.96 14.32 Favored Glycine 0 C--N 1.342 0.872 0 CA-C-N 115.972 -0.558 . . . . 64.42 112.981 -176.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 23.6 tm0? -85.59 117.48 24.51 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 107.98 -1.118 . . . . 73.23 107.98 171.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.601 HD22 ' HA ' ' A' ' 49' ' ' LYS . 8.6 tt -118.58 140.56 49.7 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.841 1.256 . . . . 64.23 107.806 -179.252 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -142.55 120.87 12.32 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 121.047 0.451 . . . . 74.42 111.652 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -111.91 78.74 0.25 Allowed Glycine 0 C--N 1.343 0.927 0 N-CA-C 110.531 -1.028 . . . . 73.14 110.531 174.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 82.9 t -53.78 -35.63 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 C-N-CA 124.458 1.103 . . . . 73.42 111.621 -176.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -126.8 99.83 5.92 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 108.016 -1.105 . . . . 65.41 108.016 174.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 79.6 mt -82.3 106.95 14.6 Favored 'General case' 0 C--O 1.242 0.71 0 C-N-CA 123.093 0.557 . . . . 74.41 110.001 178.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.81 166.82 22.46 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 115.081 -0.963 . . . . 72.12 110.789 178.671 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 43.1 p-80 -158.78 71.69 0.55 Allowed 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 121.773 0.797 . . . . 74.15 109.951 177.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 56.0 p-80 -68.85 122.14 18.01 Favored 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 107.571 -1.27 . . . . 73.11 107.571 170.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -47.98 83.73 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 125.52 1.528 . . . . 75.34 114.828 -159.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 67.2 m-70 -147.36 -162.14 1.48 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 126.157 1.783 . . . . 72.54 107.917 176.126 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 16.3 p-80 -152.61 54.45 0.79 Allowed 'General case' 0 N--CA 1.479 0.989 0 CA-C-O 121.874 0.845 . . . . 75.44 110.089 173.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 . . . . . 0 N--CA 1.484 1.231 0 C-N-CA 123.84 0.856 . . . . 75.04 109.302 178.257 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 mmt . . . . . 0 N--CA 1.483 1.187 0 CA-C-O 120.738 0.304 . . . . 74.43 110.553 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.6 m -71.7 -25.63 62.17 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 123.672 0.789 . . . . 73.12 110.301 174.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -99.16 132.04 10.78 Favored Glycine 0 C--N 1.34 0.781 0 CA-C-N 115.582 -0.736 . . . . 71.31 111.422 172.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.4 tmtm? -124.49 131.63 53.49 Favored 'General case' 0 C--O 1.243 0.716 0 N-CA-C 107.18 -1.415 . . . . 74.33 107.18 -178.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -71.96 101.39 2.68 Favored 'General case' 0 C--N 1.351 0.657 0 CA-C-O 121.192 0.52 . . . . 74.32 109.612 178.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.3 p -100.35 150.23 5.64 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 124.129 0.972 . . . . 75.24 109.805 -178.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -100.5 113.61 26.53 Favored 'General case' 0 C--O 1.239 0.536 0 N-CA-C 108.463 -0.94 . . . . 71.34 108.463 172.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.434 HG22 HD13 ' A' ' 25' ' ' LEU . 88.8 t -101.39 107.49 21.54 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 124.833 1.253 . . . . 70.21 108.688 -177.21 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -94.93 101.08 12.83 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 107.862 -1.162 . . . . 75.21 107.862 -177.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 92.2 t -96.14 111.07 25.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 N-CA-C 108.907 -0.775 . . . . 75.55 108.907 -177.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.3 ttmm -107.49 102.92 12.15 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.265 1.026 . . . . 74.21 108.329 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 15.2 tt -111.11 121.52 63.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 CA-C-O 121.3 0.571 . . . . 74.51 110.515 -177.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 30.2 m -95.16 119.78 34.25 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.031 0.933 . . . . 73.21 109.364 178.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.647 ' SG ' HG21 ' A' ' 48' ' ' ILE . 21.7 t -150.72 134.98 16.97 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.926 1.29 . . . . 73.31 108.835 -175.405 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.572 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 4.0 t30 65.56 29.87 10.85 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 125.014 1.326 . . . . 75.21 110.473 177.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.19 0.03 75.63 Favored Glycine 0 C--N 1.353 1.52 0 CA-C-N 115.487 -0.779 . . . . 74.24 113.879 -178.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -112.71 164.54 13.24 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.918 0.887 . . . . 74.4 110.645 -177.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 82.3 m -115.84 119.86 37.37 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.569 0.748 . . . . 65.04 110.487 176.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -109.93 120.75 43.45 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 107.115 -1.439 . . . . 74.42 107.115 176.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -143.36 156.46 44.69 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 118.433 0.56 . . . . 74.31 111.994 -177.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 39.3 ttp180 -166.49 134.9 2.85 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-N 114.9 -1.045 . . . . 73.22 108.721 -174.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 57.4 m -91.62 118.6 30.77 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.729 0.812 . . . . 73.11 109.813 178.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 67.7 m-85 -100.41 137.57 38.65 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.203 1.001 . . . . 73.01 109.041 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -100.18 107.89 19.87 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 106.776 -1.565 . . . . 73.12 106.776 173.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.434 HD13 HG22 ' A' ' 8' ' ' VAL . 67.3 mt -111.23 98.28 7.39 Favored 'General case' 0 C--O 1.239 0.513 0 C-N-CA 123.514 0.726 . . . . 73.21 109.304 -175.225 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 68.5 t80 -92.36 140.59 29.44 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 115.568 -0.742 . . . . 73.11 109.464 172.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.513 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -141.5 171.62 13.81 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.883 0.873 . . . . 74.35 109.498 178.078 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 48.1 t -101.81 -28.65 3.14 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 C-N-CA 123.255 0.622 . . . . 73.41 109.455 173.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.579 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 95.2 mtt180 -130.86 174.24 10.17 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.941 0.897 . . . . 75.54 109.745 176.567 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.419 ' HB3' ' HE3' ' A' ' 76' ' ' LYS . 14.0 p-10 -72.46 -39.18 67.95 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.549 0.74 . . . . 74.34 109.91 173.817 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -64.11 -26.72 68.66 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.089 0.956 . . . . 75.24 111.455 -178.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.579 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 38.2 mm-40 -67.84 -32.74 73.48 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.642 0.777 . . . . 71.43 111.293 178.632 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.42 ' HA ' ' HD2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -67.67 -20.08 65.26 Favored 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 123.759 0.824 . . . . 74.11 110.689 -177.391 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.413 ' HE2' ' HB3' ' A' ' 34' ' ' LYS . 36.2 mtpt -56.83 -61.22 2.59 Favored 'General case' 0 C--N 1.362 1.15 0 C-N-CA 123.2 0.6 . . . . 64.13 112.344 179.577 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -57.46 -31.84 66.34 Favored 'General case' 0 N--CA 1.481 1.122 0 O-C-N 124.0 0.812 . . . . 55.41 111.657 -176.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.42 ' HD2' ' HA ' ' A' ' 33' ' ' LEU . 65.9 mttm -67.13 -47.31 71.47 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.907 0.883 . . . . 75.54 110.29 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.513 HD11 HD22 ' A' ' 81' ' ' LEU . 97.2 mt -63.9 -48.17 77.68 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.72 0.808 . . . . 73.1 111.916 177.242 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -60.25 -41.14 92.56 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.605 0.762 . . . . 74.14 111.514 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.428 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 30.2 mmmt -66.93 -51.89 49.7 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 122.611 0.365 . . . . 72.42 111.195 175.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 20.6 t -56.02 -44.11 77.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 C-N-CA 123.381 0.672 . . . . 75.45 111.578 -179.078 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 82.4 mt -69.69 -52.62 24.06 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.051 0.541 . . . . 75.02 110.993 -179.009 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -63.97 -42.74 97.15 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 113.196 0.813 . . . . 72.11 113.196 -177.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.428 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 23.2 mm-40 -67.44 -46.14 73.97 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 122.223 0.209 . . . . 72.43 110.59 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 36.1 tpt85 -70.08 -35.15 73.98 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 122.647 0.379 . . . . 74.43 111.518 -176.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 60.4 mtp -86.93 -7.79 57.85 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 113.11 0.782 . . . . 75.55 113.11 -176.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.405 ' HA ' ' HD3' ' A' ' 49' ' ' LYS . 24.2 t70 -61.49 -48.13 91.43 Favored Pre-proline 0 CA--C 1.569 1.683 0 CA-C-O 118.843 -0.599 . . . . 65.35 111.608 177.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -68.92 -19.17 40.55 Favored 'Trans proline' 0 C--N 1.391 2.811 0 C-N-CA 122.182 1.922 . . . . 71.35 113.554 170.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.647 HG21 ' SG ' ' A' ' 14' ' ' CYS . 46.8 mm -74.68 -34.29 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 C-N-CA 123.624 0.77 . . . . 71.13 110.466 177.135 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.429 ' HG2' HD13 ' A' ' 108' ' ' LEU . 5.2 mtpm? -72.85 -32.71 65.65 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.924 0.889 . . . . 72.32 109.626 173.359 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.34 -27.72 68.79 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.549 1.14 . . . . 74.13 110.718 172.641 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.516 HD11 ' SG ' ' A' ' 14' ' ' CYS . 68.3 mt -76.18 -35.09 59.29 Favored 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 109.712 -0.477 . . . . 75.01 109.712 171.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 79.11 35.95 29.07 Favored Glycine 0 C--N 1.345 1.069 0 O-C-N 123.822 0.701 . . . . 71.43 112.374 177.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.572 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 80.8 m -69.99 99.3 1.41 Allowed 'General case' 0 C--N 1.345 0.411 0 N-CA-C 109.285 -0.635 . . . . 61.2 109.285 176.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 44.0 mtmt -55.16 -32.84 62.44 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.954 1.301 . . . . 74.43 112.203 -169.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -125.28 136.63 53.71 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 108.01 -1.107 . . . . 74.24 108.01 168.011 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.406 ' O ' ' HA ' ' A' ' 105' ' ' GLU . 17.1 m -121.16 134.89 63.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 123.603 0.761 . . . . 73.14 109.058 174.664 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -100.55 107.53 19.23 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 108.716 -0.846 . . . . 74.31 108.716 172.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 35.7 mt -104.18 103.42 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 N-CA-C 108.904 -0.776 . . . . 73.51 108.904 177.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 51.4 m -99.91 102.73 14.21 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 108.3 -1.0 . . . . 72.42 108.3 176.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 73.8 mt -97.24 109.54 23.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 C-N-CA 124.021 0.928 . . . . 75.51 108.73 179.242 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -92.07 134.7 34.59 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 107.952 -1.129 . . . . 75.51 107.952 171.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.8 p -94.02 146.96 5.94 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 N-CA-C 106.813 -1.551 . . . . 62.2 106.813 174.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.5 tmtm? -80.43 125.29 29.74 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 107.934 -1.135 . . . . 71.55 107.934 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 14.7 m170 -92.21 106.09 18.17 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 114.874 -1.057 . . . . 62.54 108.312 -178.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 13.6 p -63.85 -43.7 95.35 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.084 0.954 . . . . 73.53 111.35 -178.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -163.83 157.26 18.65 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.551 1.141 . . . . 74.2 108.766 -179.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.43 -26.77 68.08 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.553 0.741 . . . . 74.24 112.844 -174.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -86.38 -45.84 10.82 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.406 0.682 . . . . 64.34 110.44 176.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -68.66 -29.36 67.82 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.838 0.855 . . . . 74.24 112.095 -173.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -67.06 -27.27 67.24 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.412 0.685 . . . . 74.41 111.071 -177.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 71.0 mmtt -67.61 -33.09 74.29 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.82 0.448 . . . . 73.41 109.91 -177.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.497 ' HZ2' ' HB2' ' A' ' 72' ' ' LYS . 0.1 OUTLIER -74.16 -58.08 3.53 Favored 'General case' 0 C--N 1.347 0.469 0 CA-C-N 115.674 -0.694 . . . . 73.21 109.74 172.592 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 48.9 mm-40 -67.06 -31.42 71.91 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 113.735 1.013 . . . . 74.14 113.735 -167.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -78.85 -42.49 27.39 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 118.082 0.401 . . . . 74.54 110.949 -177.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 53.8 tptt -68.74 -38.63 80.28 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.61 0.764 . . . . 75.04 111.128 177.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.419 ' HE3' ' HB3' ' A' ' 30' ' ' ASP . 76.6 tttt -59.18 -50.04 75.56 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 125.483 1.513 . . . . 75.03 110.387 172.51 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -70.12 -29.08 65.93 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 114.934 -1.03 . . . . 74.03 110.48 -177.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.87 -43.71 87.54 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.925 0.89 . . . . 74.24 110.521 178.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.82 -41.95 99.53 Favored 'General case' 0 C--N 1.354 0.798 0 O-C-N 123.987 0.805 . . . . 75.24 110.903 176.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 50.0 mm -62.78 -41.83 93.95 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 C-N-CA 123.66 0.784 . . . . 75.4 110.894 175.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.513 HD22 HD11 ' A' ' 37' ' ' LEU . 47.1 mt -64.76 -37.92 89.23 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.764 0.826 . . . . 75.14 110.921 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -57.25 -45.14 84.25 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.771 0.828 . . . . 72.31 110.49 178.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 9.7 mmpt? -66.97 -41.26 87.13 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 114.892 -1.049 . . . . 74.52 110.495 -178.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.48 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 54.6 t -65.69 -56.71 13.82 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 C-N-CA 124.071 0.949 . . . . 63.21 110.571 -177.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.516 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 22.0 m-85 -60.13 -38.1 82.05 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 124.098 0.959 . . . . 74.42 111.569 -177.345 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.74 -30.04 71.18 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.577 0.751 . . . . 75.33 111.835 177.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -87.59 -9.03 55.5 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.491 0.716 . . . . 75.05 111.949 177.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.48 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 59.8 mt -105.0 -15.32 15.14 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 122.724 0.409 . . . . 75.21 110.543 -178.695 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 95.11 13.83 51.07 Favored Glycine 0 C--N 1.348 1.213 0 CA-C-N 116.257 -0.429 . . . . 64.21 113.484 178.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.516 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 14.3 m-85 -87.5 124.32 33.34 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 108.518 -0.919 . . . . 71.45 108.518 173.699 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 38.6 t-20 -81.87 146.84 29.63 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.708 0.803 . . . . 74.22 110.008 -171.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -53.15 -36.15 60.53 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 125.257 1.423 . . . . 75.2 111.425 173.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 17.2 m -57.15 -21.23 31.24 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 124.706 1.202 . . . . 75.43 113.378 178.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -105.89 -10.48 16.63 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.425 1.09 . . . . 71.02 111.896 -173.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 60.9 t -87.43 103.43 13.37 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 C-N-CA 123.628 0.771 . . . . 74.5 109.696 -175.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 30.8 m -108.89 115.49 30.18 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.015 0.926 . . . . 71.44 110.798 -172.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 55.5 m95 -97.81 144.1 27.76 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.007 0.523 . . . . 73.32 111.314 177.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -132.41 66.54 1.55 Allowed 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 108.172 -1.047 . . . . 73.32 108.172 170.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 42.06 22.7 0.12 Allowed Glycine 0 N--CA 1.488 2.135 0 N-CA-C 118.023 1.969 . . . . 62.4 118.023 174.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -175.04 -52.73 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.418 0 CA-C-N 118.148 0.974 . . . . 74.43 110.615 -168.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 52.7 m -117.58 151.8 36.42 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.393 1.077 . . . . 73.15 109.483 -177.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 6.5 p -126.05 113.47 34.31 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.198 0 C-N-CA 123.275 0.63 . . . . 74.33 111.074 176.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 53.6 m -92.8 101.21 13.59 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.693 1.197 . . . . 75.35 109.082 175.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.469 HG21 ' CE2' ' A' ' 85' ' ' PHE . 55.8 t -104.9 112.33 38.09 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 C-N-CA 124.623 1.169 . . . . 74.44 108.419 177.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . 0.406 ' HA ' ' O ' ' A' ' 56' ' ' VAL . 47.4 mt-10 -96.12 156.67 16.24 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.048 -0.723 . . . . 75.22 109.048 175.0 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -154.05 142.37 9.06 Favored Glycine 0 C--O 1.241 0.541 0 C-N-CA 121.387 -0.435 . . . . 72.24 112.332 176.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 23.0 tp60 -74.45 99.77 3.64 Favored 'General case' 0 C--N 1.351 0.644 0 N-CA-C 106.897 -1.52 . . . . 74.03 106.897 171.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.429 HD13 ' HG2' ' A' ' 49' ' ' LYS . 20.5 tp -85.57 160.75 19.56 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.768 0.827 . . . . 62.31 110.185 -176.752 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -68.3 -179.1 1.2 Allowed 'General case' 0 CA--C 1.547 0.861 0 CA-C-O 122.288 1.042 . . . . 75.1 112.313 175.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 154.07 -106.1 0.29 Allowed Glycine 0 N--CA 1.449 -0.473 0 CA-C-N 113.647 -1.615 . . . . 73.44 109.368 -177.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 17.6 m -126.33 169.79 17.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 124.251 1.02 . . . . 64.04 110.519 -179.227 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 37.3 t70 78.46 -32.74 0.16 Allowed 'General case' 0 N--CA 1.5 2.049 0 C-N-CA 125.602 1.561 . . . . 74.33 114.439 170.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 70.9 mt -65.59 140.78 58.55 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 124.285 1.034 . . . . 71.12 111.171 -174.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.88 -26.82 68.78 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 113.996 1.11 . . . . 73.42 113.996 -168.649 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -69.01 164.86 21.39 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.356 0.662 . . . . 75.15 111.555 -179.333 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 28.7 p-80 -61.16 124.95 22.0 Favored 'General case' 0 N--CA 1.485 1.288 0 O-C-N 123.883 0.74 . . . . 75.51 111.453 -170.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 10.8 p80 -142.04 142.32 32.87 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.859 0.864 . . . . 72.53 109.936 -176.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 23.7 m170 -111.66 178.86 4.19 Favored 'General case' 0 C--O 1.241 0.652 0 C-N-CA 124.453 1.101 . . . . 74.11 108.269 172.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 -77.79 81.27 4.22 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 107.803 -1.184 . . . . 74.05 107.803 167.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 44.8 t-80 . . . . . 0 C--O 1.251 1.151 0 C-N-CA 125.1 1.36 . . . . 74.1 110.033 -178.208 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.418 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.6 mpt? . . . . . 0 N--CA 1.478 0.943 0 N-CA-C 108.857 -0.794 . . . . 71.43 108.857 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.3 m -77.27 70.51 3.67 Favored 'General case' 0 N--CA 1.481 1.075 0 CA-C-O 121.775 0.798 . . . . 75.3 109.816 178.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 131.72 159.85 9.57 Favored Glycine 0 C--N 1.341 0.826 0 CA-C-N 114.805 -1.089 . . . . 73.42 112.448 -171.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.17 150.02 36.01 Favored 'General case' 0 C--O 1.244 0.807 0 C-N-CA 123.315 0.646 . . . . 74.42 110.674 177.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -97.06 101.95 13.63 Favored 'General case' 0 C--O 1.239 0.513 0 N-CA-C 106.659 -1.608 . . . . 75.11 106.659 167.168 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.2 p -100.23 134.42 39.93 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 C-N-CA 124.148 0.979 . . . . 75.32 108.642 -178.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.42 ' HA ' ' O ' ' A' ' 23' ' ' TYR . 34.6 mt-10 -106.29 113.51 27.08 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 108.058 -1.09 . . . . 74.52 108.058 175.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 77.6 t -97.25 107.74 20.46 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 114.827 -1.079 . . . . 71.4 108.331 -176.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -94.52 99.75 11.85 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 107.26 -1.385 . . . . 74.12 107.26 -177.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 97.2 t -94.56 103.31 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 N-CA-C 108.113 -1.069 . . . . 74.41 108.113 -177.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.442 ' HG3' ' HB3' ' A' ' 20' ' ' GLU . 34.7 ttmt -115.0 101.21 8.79 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 107.732 -1.21 . . . . 75.24 107.732 -176.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.45 HD12 HG13 ' A' ' 48' ' ' ILE . 11.3 tt -116.24 125.95 73.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 C-N-CA 123.376 0.67 . . . . 74.53 110.373 -169.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 55.5 m -92.07 122.47 34.61 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 109.944 -0.391 . . . . 72.42 109.944 176.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.508 ' SG ' HG22 ' A' ' 48' ' ' ILE . 14.6 t -155.86 147.99 23.45 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.462 1.505 . . . . 64.41 108.644 -178.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.448 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 11.6 t30 67.17 18.51 10.39 Favored 'General case' 0 N--CA 1.499 1.994 0 CA-C-O 121.791 0.805 . . . . 74.44 110.682 174.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.5 7.11 88.73 Favored Glycine 0 C--N 1.358 1.772 0 CA-C-N 115.495 -0.775 . . . . 74.23 113.586 -176.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.621 ' HB3' ' HZ2' ' A' ' 17' ' ' LYS . 7.9 mtpm? -124.98 169.2 12.34 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.114 0.965 . . . . 72.35 110.397 -178.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.4 m -120.05 115.0 22.84 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 109.923 -0.399 . . . . 72.34 109.923 -178.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 61.9 m-85 -104.45 102.97 12.6 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.717 1.207 . . . . 75.33 108.996 -175.423 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.442 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -105.57 161.25 14.53 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 122.84 0.456 . . . . 75.45 111.282 -179.261 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 20.2 ttt180 -169.15 130.11 1.13 Allowed 'General case' 0 N--CA 1.477 0.888 0 O-C-N 123.893 0.746 . . . . 72.42 109.778 174.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 26.0 m -93.16 111.82 23.57 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.006 0.923 . . . . 74.22 109.692 178.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.42 ' O ' ' HA ' ' A' ' 7' ' ' GLU . 87.5 m-85 -98.69 122.49 41.98 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.646 0.778 . . . . 74.14 110.363 -177.394 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 24.9 mp0 -88.69 111.07 21.52 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 107.972 -1.122 . . . . 74.01 107.972 174.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.517 HD13 HG21 ' A' ' 40' ' ' VAL . 80.9 mt -124.77 119.26 28.39 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.215 1.006 . . . . 75.04 108.459 -177.715 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 87.2 t80 -113.74 138.87 49.64 Favored 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 109.751 -0.462 . . . . 75.15 109.751 179.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -156.7 149.79 24.04 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.125 0.57 . . . . 74.32 110.187 175.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 26.7 t -68.48 -26.94 34.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 124.627 1.171 . . . . 71.01 110.417 175.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.524 ' HB3' ' HG2' ' A' ' 31' ' ' GLU . 74.4 mtt180 -135.35 137.71 42.65 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.111 0.964 . . . . 72.1 110.017 178.254 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -71.82 -17.78 62.13 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 123.269 0.628 . . . . 63.2 111.717 176.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.524 ' HG2' ' HB3' ' A' ' 29' ' ' ARG . 13.5 pt-20 -70.74 -27.68 64.14 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 122.621 0.368 . . . . 73.23 110.876 172.116 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.464 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 31.5 mm-40 -83.47 -23.04 32.39 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.22 0.608 . . . . 74.2 110.476 177.323 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.01 -21.29 65.95 Favored 'General case' 0 CA--C 1.56 1.364 0 C-N-CA 124.168 0.987 . . . . 74.43 110.106 178.031 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -48.29 -56.56 7.73 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 124.289 1.036 . . . . 74.12 112.505 178.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.409 ' HA ' ' HD3' ' A' ' 38' ' ' LYS . 1.9 pp20? -60.33 -31.87 70.71 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.215 0.606 . . . . 74.33 112.08 -176.711 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -70.59 -40.6 73.14 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.378 0.671 . . . . 74.01 110.59 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.47 HD12 HD23 ' A' ' 81' ' ' LEU . 77.6 mt -63.33 -33.65 75.99 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.717 0.807 . . . . 72.31 111.067 174.625 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.528 ' HA ' HD11 ' A' ' 88' ' ' LEU . 57.3 mtpt -65.3 -41.85 93.67 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.383 0.673 . . . . 72.45 110.93 175.54 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.4 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 42.7 mmtm -61.5 -51.51 68.35 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 109.392 -0.596 . . . . 74.4 109.392 175.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.517 HG21 HD13 ' A' ' 25' ' ' LEU . 38.7 t -54.05 -50.86 51.47 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 C-N-CA 124.781 1.232 . . . . 71.43 111.863 -178.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 80.1 mt -67.41 -51.53 50.65 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.165 0.586 . . . . 74.02 111.534 -177.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -66.1 -38.9 89.37 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.088 0.555 . . . . 71.44 112.296 -174.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -70.72 -42.54 70.46 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.022 0.529 . . . . 75.34 110.736 176.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 18.6 tpt180 -69.93 -34.49 73.53 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 122.658 0.383 . . . . 72.13 111.743 -178.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 62.0 mtp -91.88 -8.24 46.98 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.532 0.567 . . . . 75.41 112.532 -177.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -59.05 -49.29 94.04 Favored Pre-proline 0 CA--C 1.569 1.674 0 CA-C-O 118.9 -0.572 . . . . 74.12 111.673 174.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -67.54 -25.53 40.99 Favored 'Trans proline' 0 C--N 1.394 2.967 0 C-N-CA 122.035 1.824 . . . . 72.43 112.571 174.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.508 HG22 ' SG ' ' A' ' 14' ' ' CYS . 50.9 mm -72.64 -33.89 45.96 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.114 0 C-N-CA 124.169 0.988 . . . . 73.5 110.918 -177.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -71.09 -31.98 68.5 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.753 0.821 . . . . 75.02 110.073 176.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.7 tmmm? -71.7 -33.11 68.51 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 115.112 -0.949 . . . . 71.5 110.699 172.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 91.2 mt -69.43 -30.68 68.66 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 109.345 -0.613 . . . . 73.55 109.345 177.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 93.28 19.19 36.52 Favored Glycine 0 C--N 1.345 1.067 0 CA-C-N 115.446 -0.797 . . . . 75.4 113.787 172.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.448 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 71.6 m -71.35 102.82 2.7 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.837 0.319 . . . . 73.14 111.055 -177.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -55.67 -56.62 18.31 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.87 1.268 . . . . 73.54 110.016 176.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 14.1 tpp85 -103.23 125.54 49.95 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 114.781 -1.1 . . . . 74.05 109.366 176.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 26.8 m -122.09 142.97 36.31 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.03 0.932 . . . . 74.44 109.212 172.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.3 ttm105 -111.17 106.11 15.02 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 108.006 -1.109 . . . . 74.5 108.006 172.174 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 24.5 mt -101.57 112.46 34.7 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 N-CA-C 108.203 -1.036 . . . . 75.43 108.203 -179.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 46.5 m -100.73 104.61 15.89 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 107.859 -1.163 . . . . 75.13 107.859 176.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 75.8 mt -100.38 115.31 41.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 N-CA-C 109.081 -0.711 . . . . 74.42 109.081 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -101.66 123.97 46.54 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 108.518 -0.919 . . . . 75.44 108.518 172.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 7.8 p -93.19 130.5 42.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 N-CA-C 107.683 -1.229 . . . . 73.55 107.683 178.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? -81.76 118.79 23.15 Favored 'General case' 0 C--O 1.243 0.713 0 N-CA-C 107.11 -1.441 . . . . 72.4 107.11 179.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 23.1 m170 -72.5 131.65 42.82 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 115.328 -0.851 . . . . 73.2 108.989 -177.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 40.6 t -59.81 -45.05 93.57 Favored 'General case' 0 CA--C 1.55 0.963 0 O-C-N 123.948 0.78 . . . . 52.14 110.933 -179.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -154.97 163.83 39.75 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 123.523 0.729 . . . . 73.11 110.672 -178.488 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -56.66 -47.69 79.22 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.397 1.479 . . . . 62.21 112.817 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.43 -31.31 68.44 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 122.642 0.377 . . . . 74.52 111.015 177.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -76.79 -15.98 59.59 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 115.36 -0.837 . . . . 72.33 112.747 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -54.0 -54.84 33.51 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.901 0.48 . . . . 71.33 112.197 -174.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -66.85 -44.72 80.28 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.442 0.697 . . . . 75.23 111.196 -174.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 24.4 ttmm -63.62 -59.54 4.48 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 115.47 -0.786 . . . . 75.42 110.529 -178.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -74.14 -20.66 60.16 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 113.301 0.852 . . . . 71.04 113.301 -172.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.16 -43.34 64.74 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-N 119.386 0.994 . . . . 72.12 109.559 175.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -65.44 -37.91 88.28 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.115 0.966 . . . . 73.02 111.681 176.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.418 ' HZ3' ' HB3' ' A' ' 76' ' ' LYS . 9.7 mtpm? -71.11 -44.24 66.05 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.048 0.539 . . . . 65.33 110.65 177.627 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -76.88 -18.73 58.15 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.253 0.621 . . . . 75.44 109.784 -176.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.12 -45.96 92.53 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.346 0.659 . . . . 75.43 109.904 169.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -73.03 -32.9 65.39 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 124.047 0.842 . . . . 54.03 111.391 178.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.437 ' O ' HG21 ' A' ' 84' ' ' VAL . 46.3 mm -62.81 -54.24 36.37 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 C-N-CA 123.095 0.558 . . . . 74.02 109.825 174.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.47 HD23 HD12 ' A' ' 37' ' ' LEU . 32.2 mt -60.41 -44.99 95.17 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.8 0.84 . . . . 74.4 110.339 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 57.5 t30 -64.27 -33.7 76.41 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.602 0.761 . . . . 73.43 110.721 -175.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.474 ' O ' ' HG2' ' A' ' 87' ' ' GLU . 27.7 mmtp -73.04 -35.16 66.69 Favored 'General case' 0 C--O 1.213 -0.843 0 CA-C-O 119.007 -0.52 . . . . 71.44 111.485 174.15 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.437 HG21 ' O ' ' A' ' 80' ' ' ILE . 69.0 t -66.81 -36.44 77.22 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 CA-C-O 121.388 0.614 . . . . 73.42 110.604 177.286 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.545 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 24.2 m-85 -62.38 -43.24 99.28 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 114.9 -1.045 . . . . 73.31 109.623 173.33 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -69.45 -28.53 66.19 Favored 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 122.851 0.46 . . . . 74.34 111.461 175.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 83' ' ' LYS . 58.0 mm-40 -65.11 -34.75 79.14 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 124.084 0.954 . . . . 73.11 110.84 177.65 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.528 HD11 ' HA ' ' A' ' 38' ' ' LYS . 70.9 mt -107.27 -6.6 17.14 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 122.994 0.518 . . . . 74.11 112.204 -170.188 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 93.28 54.9 1.65 Allowed Glycine 0 C--N 1.346 1.09 0 CA-C-O 121.331 0.406 . . . . 72.34 113.267 176.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.545 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 72.9 m-85 -118.16 145.96 44.55 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 106.816 -1.55 . . . . 73.24 106.816 169.236 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -76.83 158.44 30.82 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 122.949 0.5 . . . . 71.34 110.273 178.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -64.82 -35.94 82.74 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.333 0.653 . . . . 74.21 110.359 176.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 18.1 m -51.11 -35.38 35.02 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 124.938 1.295 . . . . 74.13 112.975 174.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . 0.437 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 3.2 m-20 -58.96 -37.88 77.79 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 124.057 0.943 . . . . 75.53 110.973 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 17.6 t -83.73 110.24 18.23 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 C-N-CA 124.183 0.993 . . . . 54.35 109.502 -169.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 51.8 m -139.26 113.98 9.24 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 122.867 0.467 . . . . 54.32 109.972 174.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.438 ' HA ' ' HA ' ' A' ' 102' ' ' VAL . 60.7 m95 -79.04 121.77 25.38 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.197 0.599 . . . . 72.33 110.597 176.709 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -101.07 87.9 3.38 Favored 'General case' 0 C--O 1.242 0.678 0 C-N-CA 124.79 1.236 . . . . 75.3 107.71 168.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.87 -103.1 0.78 Allowed Glycine 0 C--N 1.343 0.956 0 CA-C-N 115.82 -0.627 . . . . 64.42 112.196 -174.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -106.4 -8.51 17.13 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.405 0.682 . . . . 70.24 111.645 -176.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 37.3 m -109.71 127.21 54.44 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 108.881 -0.785 . . . . 73.21 108.881 178.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.438 ' HA ' ' HA ' ' A' ' 97' ' ' TRP . 8.1 p -95.32 118.4 41.43 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 N-CA-C 108.841 -0.8 . . . . 73.22 108.841 176.458 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 39.4 m -92.72 100.41 12.91 Favored 'General case' 0 C--O 1.242 0.67 0 N-CA-C 107.576 -1.268 . . . . 72.12 107.576 176.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.437 ' HA ' ' O ' ' A' ' 94' ' ' ASN . 60.8 t -103.69 110.3 29.66 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 N-CA-C 108.301 -1.0 . . . . 73.33 108.301 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -101.71 111.46 23.71 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 108.526 -0.916 . . . . 71.24 108.526 176.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -116.57 155.16 16.37 Favored Glycine 0 C--N 1.342 0.876 0 CA-C-N 115.421 -0.809 . . . . 70.42 112.594 -172.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -105.47 150.73 25.04 Favored 'General case' 0 C--O 1.243 0.75 0 C-N-CA 123.475 0.71 . . . . 71.54 109.217 170.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.32 169.7 20.76 Favored 'General case' 0 C--O 1.244 0.795 0 C-N-CA 124.004 0.922 . . . . 74.21 109.353 178.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -79.09 80.03 5.46 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 108.854 -0.795 . . . . 72.32 108.854 176.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -85.53 101.43 2.55 Favored Glycine 0 C--N 1.338 0.664 0 CA-C-N 114.785 -1.098 . . . . 63.23 111.98 -178.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 46.4 t -68.86 114.34 5.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 N-CA-C 109.078 -0.712 . . . . 72.53 109.078 178.081 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -71.62 108.61 5.06 Favored 'General case' 0 C--O 1.238 0.464 0 O-C-N 123.863 0.727 . . . . 54.51 109.748 -176.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 75.8 mt -99.33 11.09 40.08 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.396 0.678 . . . . 73.22 110.552 175.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -81.57 105.67 12.91 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 121.225 0.535 . . . . 64.02 109.951 -177.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 30.2 m170 -72.06 170.43 13.91 Favored 'General case' 0 C--O 1.243 0.715 0 CA-C-N 114.892 -1.049 . . . . 64.24 110.026 171.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 47.4 m-70 65.04 36.92 7.07 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 124.154 0.982 . . . . 73.41 108.496 -165.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 54.4 t60 -70.26 -8.36 49.55 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 114.481 -1.236 . . . . 74.52 113.024 -167.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 58.1 m-70 -63.03 -18.79 63.72 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 122.603 0.361 . . . . 74.4 111.37 175.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 22.0 p80 -115.55 157.67 23.75 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.559 0.744 . . . . 74.34 109.757 169.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 . . . . . 0 CA--C 1.557 1.217 0 N-CA-C 107.872 -1.159 . . . . 72.41 107.872 168.299 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.473 ' N ' ' SD ' ' A' ' 1' ' ' MET . 1.3 mpt? . . . . . 0 N--CA 1.477 0.885 0 N-CA-C 109.466 -0.568 . . . . 74.31 109.466 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.4 m -70.99 103.54 2.71 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 108.097 -1.075 . . . . 63.25 108.097 169.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 162.44 47.14 0.02 OUTLIER Glycine 0 C--N 1.339 0.714 0 N-CA-C 110.216 -1.153 . . . . 74.22 110.216 -179.186 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 57.2 mttm -100.61 154.92 18.18 Favored 'General case' 0 C--O 1.245 0.858 0 C-N-CA 123.624 0.77 . . . . 71.51 110.61 -169.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -80.35 102.67 9.71 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 105.432 -2.062 . . . . 74.12 105.432 160.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.1 p -102.42 134.29 43.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 124.373 1.069 . . . . 75.44 108.44 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.534 ' HB2' ' HG3' ' A' ' 63' ' ' LYS . 46.8 mt-10 -107.96 115.2 29.69 Favored 'General case' 0 C--O 1.243 0.728 0 N-CA-C 107.876 -1.157 . . . . 75.03 107.876 175.9 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 99.1 t -95.72 109.27 22.33 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 CA-C-N 114.025 -1.443 . . . . 64.12 108.333 -174.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.441 ' HG2' HG22 ' A' ' 22' ' ' THR . 36.5 mt-30 -94.21 100.97 12.95 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 107.933 -1.136 . . . . 74.24 107.933 -176.151 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 98.5 t -95.77 104.2 15.56 Favored 'Isoleucine or valine' 0 C--O 1.243 0.753 0 N-CA-C 108.779 -0.823 . . . . 75.14 108.779 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.498 ' HG3' ' HB3' ' A' ' 20' ' ' GLU . 39.0 ttpt -108.64 102.54 11.59 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 108.042 -1.095 . . . . 73.43 108.042 -179.261 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.507 HD11 HG13 ' A' ' 48' ' ' ILE . 15.8 tt -111.48 120.19 61.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 C-N-CA 123.364 0.666 . . . . 75.52 110.29 -176.142 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 7.0 m -92.28 108.46 19.97 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 108.605 -0.887 . . . . 62.43 108.605 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.646 ' SG ' HG21 ' A' ' 48' ' ' ILE . 52.5 t -128.7 119.34 24.46 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.947 0.899 . . . . 75.54 108.986 -175.157 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.496 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 22.1 t-20 77.3 -8.61 1.65 Allowed 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 126.327 1.851 . . . . 74.4 112.602 173.619 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 124.17 -4.43 8.96 Favored Glycine 0 C--N 1.341 0.857 0 CA-C-O 119.861 -0.41 . . . . 73.44 112.588 -175.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -106.25 144.97 32.19 Favored 'General case' 0 C--O 1.241 0.642 0 C-N-CA 123.084 0.554 . . . . 74.14 109.672 179.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 47.2 m -94.32 108.32 20.22 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.809 0.844 . . . . 75.42 108.731 177.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 70.6 m-85 -101.65 101.35 11.86 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 107.843 -1.169 . . . . 75.11 107.843 177.191 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.498 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 0.2 OUTLIER -123.23 141.84 51.56 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 122.846 0.458 . . . . 75.51 111.049 -178.146 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 41.1 ttm180 -154.94 135.8 13.69 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.374 -0.83 . . . . 73.44 108.94 177.055 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.441 HG22 ' HG2' ' A' ' 9' ' ' GLN . 29.8 m -94.6 117.13 29.65 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.377 1.071 . . . . 75.35 108.31 177.668 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.524 ' HH ' ' HD3' ' A' ' 44' ' ' ARG . 94.9 m-85 -99.17 120.28 39.24 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.111 0.964 . . . . 71.21 110.034 -176.644 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -83.33 109.24 17.11 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 108.204 -1.036 . . . . 73.3 108.204 178.104 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 96.6 mt -119.49 148.36 43.36 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.02 0.928 . . . . 75.34 109.101 179.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 54.0 t80 -136.39 139.86 42.79 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 108.42 -0.955 . . . . 74.44 108.42 174.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.545 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -162.72 151.81 15.12 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 123.683 0.793 . . . . 73.34 109.377 174.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 43.5 t -76.0 -71.14 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 N-CA-C 108.633 -0.877 . . . . 73.13 108.633 175.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.469 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 57.1 mtp85 -82.18 155.36 25.0 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.352 0.596 . . . . 73.54 110.977 -179.52 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -68.63 -28.65 67.09 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 114.952 -1.022 . . . . 70.14 110.955 175.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 60.8 mm-40 -58.61 -36.07 73.47 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.529 0.732 . . . . 73.53 111.644 171.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.545 ' HB2' ' HB1' ' A' ' 27' ' ' ALA . 9.2 mm-40 -67.58 -34.09 76.34 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 123.717 0.807 . . . . 74.32 110.822 -179.443 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.4 HD22 ' HB2' ' A' ' 27' ' ' ALA . 0.2 OUTLIER -73.07 -25.26 60.84 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.554 0.742 . . . . 70.55 110.871 -177.633 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -53.94 -59.73 4.25 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.766 0.826 . . . . 74.15 112.252 -178.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -57.65 -33.46 68.32 Favored 'General case' 0 N--CA 1.479 0.987 0 O-C-N 124.088 0.868 . . . . 73.11 111.894 -178.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 64.6 mttm -68.66 -44.9 73.12 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 123.418 0.687 . . . . 74.53 109.912 -179.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 89.6 mt -65.08 -36.84 85.61 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.767 0.827 . . . . 72.41 111.482 178.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.529 ' HA ' HD11 ' A' ' 88' ' ' LEU . 59.2 mtpt -63.58 -43.22 97.61 Favored 'General case' 0 C--N 1.357 0.897 0 C-N-CA 122.778 0.431 . . . . 72.25 110.138 177.18 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -66.92 -47.91 70.27 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 123.467 0.479 . . . . 74.33 111.623 176.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 54.8 t -57.86 -41.87 80.88 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.227 0 C-N-CA 123.57 0.748 . . . . 72.3 110.747 -178.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.549 HD23 HD12 ' A' ' 60' ' ' ILE . 74.6 mt -72.21 -51.12 22.53 Favored 'General case' 0 C--O 1.217 -0.633 0 CA-C-O 118.755 -0.64 . . . . 75.0 111.425 178.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -55.69 -50.21 70.88 Favored 'General case' 0 N--CA 1.496 1.851 0 C-N-CA 122.901 0.48 . . . . 70.15 112.027 -179.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 56.3 mm-40 -63.01 -34.77 78.27 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 115.966 -0.561 . . . . 75.3 110.827 178.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.524 ' HD3' ' HH ' ' A' ' 23' ' ' TYR . 20.5 tpt180 -65.7 -45.52 82.48 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.296 0.638 . . . . 75.12 110.954 176.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.591 ' HE3' HG23 ' A' ' 56' ' ' VAL . 94.6 mmm -80.57 -21.83 41.33 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.698 0.799 . . . . 74.32 112.379 -170.13 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -57.38 -55.73 41.38 Favored Pre-proline 0 CA--C 1.565 1.531 0 O-C-N 123.721 0.638 . . . . 63.34 111.521 -178.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.406 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 60.8 Cg_endo -69.27 -24.71 31.61 Favored 'Trans proline' 0 C--N 1.389 2.689 0 C-N-CA 121.623 1.549 . . . . 65.54 112.334 177.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.646 HG21 ' SG ' ' A' ' 14' ' ' CYS . 44.7 mm -69.99 -34.42 59.7 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.015 0 C-N-CA 123.938 0.895 . . . . 73.21 111.506 -177.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 58.4 mtpt -67.14 -35.6 80.07 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 109.998 -0.371 . . . . 75.2 109.998 173.591 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.32 -35.65 79.85 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 123.772 0.829 . . . . 75.45 109.376 176.088 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.41 HD11 HD12 ' A' ' 48' ' ' ILE . 91.7 mt -70.79 -23.29 62.35 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 122.86 0.464 . . . . 73.01 110.008 175.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 71.88 39.63 59.0 Favored Glycine 0 C--N 1.343 0.97 0 CA-C-N 115.667 -0.697 . . . . 75.1 113.968 168.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.496 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 72.8 m -79.03 111.76 15.55 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 122.498 0.319 . . . . 74.32 111.03 -178.462 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -46.74 -37.22 8.16 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 126.177 1.791 . . . . 73.32 112.864 178.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.463 ' HD2' ' N ' ' A' ' 56' ' ' VAL . 0.0 OUTLIER -146.2 136.86 24.16 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 107.469 -1.308 . . . . 75.32 107.469 175.096 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.591 HG23 ' HE3' ' A' ' 45' ' ' MET . 31.0 m -124.66 142.14 42.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 124.472 1.109 . . . . 71.34 109.879 177.075 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.4 ' O ' ' HA ' ' A' ' 12' ' ' ILE . 52.9 ttp180 -111.01 105.5 14.28 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 109.056 -0.72 . . . . 72.32 109.056 176.357 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.416 HD13 ' SD ' ' A' ' 45' ' ' MET . 52.0 mt -94.79 109.59 22.51 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 125.312 1.445 . . . . 73.43 108.184 176.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 27.4 m -107.19 105.48 15.48 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 108.229 -1.026 . . . . 73.0 108.229 177.069 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.549 HD12 HD23 ' A' ' 41' ' ' LEU . 79.8 mt -97.6 122.83 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 123.564 0.746 . . . . 75.15 109.341 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 79.6 mtt-85 -110.68 138.01 47.62 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.515 0.726 . . . . 74.5 109.604 174.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.5 p -99.39 139.64 20.62 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 N-CA-C 108.21 -1.033 . . . . 75.32 108.21 170.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.534 ' HG3' ' HB2' ' A' ' 7' ' ' GLU . 10.6 mmpt? -81.97 127.48 33.09 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 122.641 0.376 . . . . 75.35 110.438 178.81 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 20.2 p80 -147.16 154.16 40.74 Favored 'General case' 0 C--O 1.24 0.564 0 C-N-CA 123.896 0.878 . . . . 61.41 110.598 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 71.8 p -164.91 32.66 0.06 Allowed 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.981 0.912 . . . . 62.24 109.056 174.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -135.85 82.11 1.93 Allowed 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 107.509 -1.293 . . . . 75.44 107.509 -175.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.61 -6.23 5.04 Favored 'General case' 0 N--CA 1.483 1.181 0 N-CA-C 113.911 1.078 . . . . 61.02 113.911 -166.08 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -78.48 -66.99 0.78 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.231 0.612 . . . . 74.51 110.205 170.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.409 ' O ' ' HG2' ' A' ' 73' ' ' GLU . 44.5 mm-40 -84.35 -27.65 27.58 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 113.384 0.883 . . . . 75.35 113.384 -168.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -59.73 -29.39 68.11 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 112.943 0.72 . . . . 71.31 112.943 -172.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -76.36 -30.23 57.51 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.029 0.932 . . . . 73.33 110.496 -178.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -72.94 -41.72 64.2 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.417 1.087 . . . . 73.23 109.884 172.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.409 ' HG2' ' O ' ' A' ' 69' ' ' GLU . 10.7 mm-40 -79.92 -23.0 42.06 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 115.781 -0.645 . . . . 72.12 111.946 -173.345 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -76.48 -40.3 50.71 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 122.824 0.449 . . . . 64.22 109.947 174.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.3 ttmm -57.26 -41.71 80.19 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 124.238 1.015 . . . . 74.24 110.587 170.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -66.75 -45.02 79.88 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 114.423 -1.262 . . . . 74.41 110.712 178.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -72.7 -22.35 60.91 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.411 1.084 . . . . 74.12 110.089 -176.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.423 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -63.87 -46.51 84.6 Favored 'General case' 0 C--N 1.354 0.761 0 C-N-CA 123.812 0.845 . . . . 52.12 110.472 173.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.38 -34.96 73.18 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 115.372 -0.831 . . . . 63.01 111.533 178.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 31.9 mm -62.13 -54.76 30.1 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 123.636 0.775 . . . . 72.22 111.224 177.096 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 16.2 mt -67.78 -26.97 66.37 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 122.564 0.345 . . . . 75.23 111.535 178.076 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -61.63 -37.54 84.34 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.045 0.538 . . . . 73.41 110.074 174.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.547 ' HB3' ' HZ2' ' A' ' 83' ' ' LYS . 3.1 mmmp? -69.07 -47.37 65.45 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 115.9 -0.591 . . . . 71.12 110.931 172.322 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.413 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 71.8 t -61.01 -55.96 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 123.745 0.818 . . . . 72.34 111.083 -172.314 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.443 ' CZ ' HG22 ' A' ' 104' ' ' VAL . 35.0 m-85 -56.6 -44.26 80.93 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 124.218 0.949 . . . . 74.35 111.607 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.41 -32.06 73.39 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.19 0.596 . . . . 75.32 111.633 -179.268 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -86.15 -12.34 50.19 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.858 0.863 . . . . 74.23 111.77 -179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.529 HD11 ' HA ' ' A' ' 38' ' ' LYS . 41.7 mt -106.64 8.97 31.42 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.126 0.57 . . . . 70.54 111.253 -179.213 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 86.54 14.8 65.05 Favored Glycine 0 C--N 1.347 1.172 0 N-CA-C 114.221 0.448 . . . . 63.15 114.221 174.082 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.472 ' HH ' ' HG3' ' A' ' 45' ' ' MET . 63.4 m-85 -94.94 134.66 37.35 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.285 0.634 . . . . 72.45 110.304 174.636 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -88.47 162.03 16.69 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.001 0.92 . . . . 73.4 108.957 178.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -60.94 -28.29 68.85 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.635 0.774 . . . . 64.0 111.9 177.137 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 35.9 t -59.56 -31.36 69.35 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.087 0.955 . . . . 74.03 111.466 177.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . 0.515 ' ND2' ' HA2' ' A' ' 106' ' ' GLY . 18.7 m120 -76.04 -32.89 59.55 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 122.902 0.481 . . . . 72.34 111.019 178.196 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 44.5 t -106.42 116.21 49.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 123.515 0.726 . . . . 63.14 111.287 -165.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 10.6 t -126.07 122.93 37.21 Favored 'General case' 0 CA--C 1.556 1.199 0 C-N-CA 123.06 0.544 . . . . 74.31 110.065 173.388 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.423 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 37.8 m95 -91.12 146.05 24.17 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.567 0.747 . . . . 74.23 112.086 -177.795 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -152.31 73.93 1.06 Allowed 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 115.303 -0.862 . . . . 52.01 109.129 172.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 61.47 -93.41 0.08 OUTLIER Glycine 0 C--N 1.352 1.444 0 CA-C-N 114.443 -1.253 . . . . 71.05 114.656 173.425 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -69.23 -43.99 72.93 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.831 1.253 . . . . 75.52 111.251 -176.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 16.8 m -121.37 139.73 53.05 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.354 -0.839 . . . . 73.2 110.053 -171.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 6.7 p -107.04 126.67 63.09 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 N-CA-C 108.593 -0.891 . . . . 74.13 108.593 166.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 33.5 m -96.23 104.03 15.96 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 107.947 -1.131 . . . . 75.1 107.947 177.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.443 HG22 ' CZ ' ' A' ' 85' ' ' PHE . 58.9 t -105.38 110.6 31.61 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.516 0 N-CA-C 107.623 -1.251 . . . . 75.04 107.623 178.327 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . 0.417 ' HB3' ' HD3' ' A' ' 55' ' ' ARG . 46.3 mt-10 -109.96 110.03 20.83 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 107.728 -1.212 . . . . 73.34 107.728 173.433 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . 0.515 ' HA2' ' ND2' ' A' ' 94' ' ' ASN . . . -118.78 135.22 11.32 Favored Glycine 0 C--N 1.342 0.909 0 N-CA-C 111.437 -0.665 . . . . 71.52 111.437 -179.286 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 4.3 pm0 -78.92 140.35 38.09 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 108.047 -1.094 . . . . 73.5 108.047 172.167 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 83.6 mt -117.35 147.5 42.57 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.063 0.458 . . . . 75.15 110.561 178.101 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -59.92 -34.77 73.67 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 114.385 -1.28 . . . . 63.12 110.562 169.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 65.47 -135.17 36.1 Favored Glycine 0 C--N 1.355 1.637 0 CA-C-N 115.563 -0.744 . . . . 71.3 111.854 -178.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 12.0 t -91.75 56.88 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.989 0 N-CA-C 107.987 -1.116 . . . . 55.02 107.987 172.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 31.8 t70 60.17 23.91 13.24 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 124.568 1.147 . . . . 74.45 111.374 -176.182 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 80.2 mt -75.0 130.27 39.07 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.28 0.632 . . . . 70.42 110.025 -175.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -71.09 115.42 10.21 Favored 'General case' 0 C--O 1.24 0.586 0 C-N-CA 123.203 0.601 . . . . 73.02 109.814 -179.6 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -70.36 92.42 0.8 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 123.646 0.778 . . . . 61.1 109.728 176.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 -103.41 153.72 20.18 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.241 1.016 . . . . 73.4 109.677 174.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 57.8 t-80 -154.37 104.5 2.59 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 108.739 -0.837 . . . . 75.42 108.739 176.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 55.9 m-70 -84.84 159.03 20.47 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.805 0.842 . . . . 73.41 110.78 178.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 14.1 t-80 -143.06 -13.52 0.72 Allowed 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.896 0.878 . . . . 74.41 110.831 175.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 34.3 m170 . . . . . 0 CA--C 1.557 1.228 0 C-N-CA 122.839 0.455 . . . . 75.41 110.387 176.462 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.6 ttm . . . . . 0 N--CA 1.478 0.965 0 N-CA-C 109.914 -0.402 . . . . 73.43 109.914 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.7 m -99.4 36.59 1.72 Allowed 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.979 0.912 . . . . 72.05 110.174 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -69.45 80.97 0.29 Allowed Glycine 0 C--N 1.354 1.573 0 CA-C-N 115.482 -0.781 . . . . 73.34 112.379 -178.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.72 144.75 29.65 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.167 0.587 . . . . 74.41 109.847 -172.349 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.556 ' HZ1' ' HB3' ' A' ' 5' ' ' LYS . 5.8 ttpm? -86.71 113.1 22.28 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 108.931 -0.766 . . . . 72.21 108.931 173.398 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.487 HG21 HG21 ' A' ' 62' ' ' VAL . 1.6 p -100.35 138.09 25.75 Favored 'Isoleucine or valine' 0 C--O 1.241 0.636 0 N-CA-C 107.544 -1.28 . . . . 74.3 107.544 170.165 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.417 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 40.2 mt-10 -100.16 113.12 25.54 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 107.445 -1.317 . . . . 75.4 107.445 176.024 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.405 HG13 HG21 ' A' ' 60' ' ' ILE . 90.0 t -95.38 107.25 19.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 N-CA-C 108.033 -1.099 . . . . 74.12 108.033 -176.898 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -95.08 100.1 11.98 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 108.294 -1.002 . . . . 74.22 108.294 -175.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 64.1 t -95.09 107.98 20.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 N-CA-C 108.968 -0.753 . . . . 61.32 108.968 -177.28 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.0 ttmm -109.82 103.65 12.49 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 108.356 -0.979 . . . . 71.0 108.356 -179.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.485 HD12 HG13 ' A' ' 48' ' ' ILE . 15.0 tt -112.29 123.35 67.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 CA-C-O 121.22 0.534 . . . . 74.41 110.618 -176.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 17.4 m -100.16 103.3 14.77 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 108.726 -0.842 . . . . 75.42 108.726 -179.033 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 35.1 t -113.73 129.17 56.61 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.784 0.833 . . . . 74.34 110.004 -178.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 72.08 -72.64 0.11 Allowed 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 125.584 1.553 . . . . 61.14 110.934 176.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -163.93 16.54 0.11 Allowed Glycine 0 C--N 1.34 0.793 0 CA-C-O 119.924 -0.375 . . . . 74.43 112.21 176.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -127.92 156.05 43.24 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.741 0.816 . . . . 73.32 110.638 -179.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 62.2 m -104.23 121.72 43.88 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.166 0.986 . . . . 73.1 109.814 179.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 39.6 m-85 -116.11 105.28 12.43 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 108.084 -1.08 . . . . 74.42 108.084 178.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -135.76 154.61 51.18 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 112.291 0.478 . . . . 73.04 112.291 -173.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 75.4 ttt180 -161.52 140.81 10.06 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 114.942 -1.026 . . . . 75.14 109.65 177.116 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 88.4 m -90.86 114.52 26.97 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 123.818 0.847 . . . . 73.35 109.208 174.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -98.17 129.77 44.94 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.549 0.74 . . . . 74.53 109.871 -178.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -89.95 108.31 19.64 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 108.104 -1.073 . . . . 71.04 108.104 178.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 82.9 mt -122.96 100.95 7.15 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.326 0.65 . . . . 74.42 109.83 -173.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.485 ' HA ' ' HA ' ' A' ' 5' ' ' LYS . 80.0 t80 -84.18 131.95 34.71 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 109.637 -0.505 . . . . 75.22 109.637 172.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.533 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -132.63 149.89 52.24 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.399 0.68 . . . . 74.54 109.445 175.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 60.6 t -87.76 -36.66 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-O 122.035 0.921 . . . . 75.34 109.442 176.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.428 ' O ' ' HB1' ' A' ' 27' ' ' ALA . 84.0 mtt180 -121.31 155.93 33.65 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 107.217 -1.401 . . . . 72.23 107.217 170.121 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.427 ' HB3' ' HZ1' ' A' ' 76' ' ' LYS . 8.3 p-10 -56.51 -30.28 62.84 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.265 0.626 . . . . 74.54 110.602 166.561 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -65.3 -28.95 69.68 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.646 1.178 . . . . 65.43 112.086 176.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.533 ' HB2' ' HB1' ' A' ' 27' ' ' ALA . 19.9 mm-40 -67.98 -32.78 73.44 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 110.511 -0.181 . . . . 75.23 110.511 176.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.706 HD23 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -71.34 -16.81 62.45 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.585 0.754 . . . . 75.24 111.334 -177.08 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -53.51 -64.89 0.68 Allowed 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.554 0.741 . . . . 65.32 111.949 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -59.67 -30.16 68.56 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 124.218 0.949 . . . . 72.11 112.383 -178.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.706 ' HD2' HD23 ' A' ' 33' ' ' LEU . 50.4 mttm -66.1 -47.09 75.35 Favored 'General case' 0 C--N 1.355 0.814 0 C-N-CA 123.099 0.56 . . . . 75.23 110.06 178.31 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.574 HD12 HD23 ' A' ' 81' ' ' LEU . 85.1 mt -59.54 -43.74 93.43 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 124.128 0.893 . . . . 72.45 110.993 177.456 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.575 ' HA ' HD12 ' A' ' 88' ' ' LEU . 54.3 mtpt -58.3 -50.95 71.8 Favored 'General case' 0 C--N 1.358 0.939 0 O-C-N 123.999 0.812 . . . . 73.31 111.1 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -66.18 -47.0 75.38 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 123.537 0.523 . . . . 71.21 111.328 -178.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 40.3 t -54.68 -43.73 67.18 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 C-N-CA 123.73 0.812 . . . . 64.4 111.542 179.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.613 HD22 HD12 ' A' ' 60' ' ' ILE . 46.7 mt -66.15 -48.51 70.54 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.206 0.603 . . . . 73.43 111.246 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -58.61 -49.21 78.3 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.229 0.611 . . . . 74.25 111.439 179.389 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -66.8 -40.02 87.94 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.407 1.083 . . . . 71.31 111.565 -176.203 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -66.09 -41.14 91.05 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 123.452 0.47 . . . . 75.41 110.714 176.325 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.473 ' SD ' ' OH ' ' A' ' 90' ' ' TYR . 48.1 mtp -92.49 -7.98 45.88 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 113.905 1.076 . . . . 71.15 113.905 -172.072 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -67.24 -44.8 49.34 Favored Pre-proline 0 CA--C 1.564 1.494 0 CA-C-O 118.995 -0.526 . . . . 73.24 111.581 -179.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -71.2 -22.93 25.07 Favored 'Trans proline' 0 C--N 1.386 2.536 0 C-N-CA 121.692 1.595 . . . . 73.4 113.139 169.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.485 HG13 HD12 ' A' ' 12' ' ' ILE . 43.5 mm -66.64 -32.67 59.09 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 C-N-CA 123.494 0.717 . . . . 74.23 110.487 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.425 ' HG3' ' O ' ' A' ' 45' ' ' MET . 90.2 mttt -55.97 -50.45 70.76 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-O 121.512 0.672 . . . . 73.04 109.268 172.882 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.554 ' HG3' ' HG3' ' A' ' 114' ' ' GLU . 37.5 ttpt -65.55 -29.34 69.94 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 114.044 -1.434 . . . . 74.42 111.48 -177.383 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.473 HD13 HD13 ' A' ' 48' ' ' ILE . 87.8 mt -71.76 -29.5 64.57 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 122.588 0.355 . . . . 72.24 110.759 175.605 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 72.13 84.25 0.23 Allowed Glycine 0 C--N 1.35 1.336 0 O-C-N 123.763 0.664 . . . . 72.41 113.082 170.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 1.2 p -131.64 134.08 45.6 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.322 0.649 . . . . 75.24 111.234 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -72.3 -37.07 69.07 Favored 'General case' 0 C--N 1.356 0.869 0 C-N-CA 124.302 1.041 . . . . 72.11 110.586 -178.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 41.8 ttm180 -127.42 131.96 50.17 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 109.627 -0.509 . . . . 74.41 109.627 175.642 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 31.5 m -120.37 137.66 53.44 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 124.961 1.304 . . . . 73.54 108.385 171.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.431 ' O ' ' HA ' ' A' ' 12' ' ' ILE . 24.9 ttm180 -108.26 106.61 16.85 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 108.304 -0.999 . . . . 75.35 108.304 173.191 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 30.9 mt -96.72 105.38 17.03 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 N-CA-C 108.187 -1.042 . . . . 73.03 108.187 178.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 27.7 t -105.13 103.21 12.71 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 107.844 -1.169 . . . . 75.1 107.844 -179.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.613 HD12 HD22 ' A' ' 41' ' ' LEU . 66.6 mt -101.2 121.67 52.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 123.625 0.77 . . . . 75.55 109.829 -176.809 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -102.14 134.72 44.93 Favored 'General case' 0 C--O 1.241 0.611 0 N-CA-C 109.35 -0.611 . . . . 75.05 109.35 175.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.487 HG21 HG21 ' A' ' 6' ' ' VAL . 7.3 p -95.93 116.44 37.72 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.047 0 N-CA-C 106.975 -1.491 . . . . 74.32 106.975 173.147 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.417 ' HB3' ' H ' ' A' ' 7' ' ' GLU . 24.2 tptm -90.57 110.36 21.5 Favored 'General case' 0 C--O 1.239 0.529 0 O-C-N 121.366 -0.834 . . . . 75.22 108.903 -176.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 18.7 p80 -110.56 111.5 22.77 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.356 1.063 . . . . 73.24 108.558 178.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 27.7 t -70.9 -30.72 67.16 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 122.979 0.512 . . . . 70.14 110.425 177.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -85.64 155.44 21.12 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.009 0.924 . . . . 70.14 110.276 177.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.05 -8.65 11.19 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.143 0.977 . . . . 61.42 112.375 -176.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -86.22 -68.67 0.72 Allowed 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.068 0.547 . . . . 71.31 111.652 -175.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -76.1 -17.63 59.52 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.385 1.074 . . . . 75.21 112.685 -174.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -58.12 -26.07 62.18 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 114.14 1.163 . . . . 72.53 114.14 -170.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.5 pttp -66.56 -38.42 87.05 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 123.409 0.684 . . . . 74.51 110.943 174.246 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -70.5 -44.8 66.89 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.794 0.838 . . . . 71.1 109.322 173.031 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.495 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 24.3 mm-40 -68.52 -17.89 64.26 Favored 'General case' 0 C--N 1.353 0.746 0 O-C-N 124.389 1.055 . . . . 71.12 111.97 -176.018 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.14 -54.77 18.15 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 122.766 0.426 . . . . 65.23 110.538 174.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 50.3 mtpt -63.77 -41.14 98.03 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 124.265 0.978 . . . . 74.32 111.178 177.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.495 ' HB3' ' HA ' ' A' ' 73' ' ' GLU . 50.2 tttm -65.93 -42.16 90.43 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.257 1.423 . . . . 74.12 111.232 -178.03 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -79.1 -21.85 46.06 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.485 0.714 . . . . 74.51 110.815 176.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.2 -42.73 99.37 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 122.664 0.386 . . . . 74.24 110.418 176.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.64 -35.39 77.79 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.359 0.664 . . . . 65.3 111.259 176.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 49.3 mm -64.57 -46.31 92.95 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.801 0 C-N-CA 124.212 1.005 . . . . 75.11 110.297 174.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.574 HD23 HD12 ' A' ' 37' ' ' LEU . 48.1 mt -64.67 -48.1 76.0 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.683 0.793 . . . . 74.1 111.52 -178.872 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 61.9 m-80 -62.35 -34.14 76.08 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 123.669 0.606 . . . . 72.43 111.446 -173.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.8 mmmm -72.64 -37.28 68.05 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 123.261 0.351 . . . . 75.24 111.785 176.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.478 HG12 ' HG2' ' A' ' 38' ' ' LYS . 40.4 t -66.61 -52.54 44.69 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.121 0 C-N-CA 123.474 0.71 . . . . 73.31 110.168 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.558 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 29.9 m-85 -56.25 -42.98 78.25 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 124.36 1.038 . . . . 74.32 111.229 176.746 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -59.87 -34.0 72.56 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.788 0.835 . . . . 73.22 112.4 179.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -86.37 -15.44 40.44 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.353 0.661 . . . . 73.15 112.429 -176.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.575 HD12 ' HA ' ' A' ' 38' ' ' LYS . 78.2 mt -106.57 -9.51 16.56 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 112.474 0.546 . . . . 72.43 112.474 -171.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 118.51 14.4 6.36 Favored Glycine 0 N--CA 1.478 1.44 0 N-CA-C 113.918 0.327 . . . . 62.31 113.918 174.388 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.558 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 12.6 m-85 -109.2 150.08 28.43 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 108.745 -0.835 . . . . 74.21 108.745 174.651 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -86.12 166.89 15.43 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 109.697 -0.483 . . . . 75.25 109.697 171.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -88.48 32.38 0.78 Allowed 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 121.541 0.686 . . . . 53.22 110.062 174.359 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 79.2 p -110.46 -28.36 8.57 Favored 'General case' 0 C--N 1.343 0.325 0 C-N-CA 125.065 1.346 . . . . 71.01 108.112 176.018 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -76.97 -9.54 58.76 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.122 -0.944 . . . . 73.51 110.957 178.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 23.3 t -89.34 99.26 9.05 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.796 0 N-CA-C 108.751 -0.833 . . . . 74.21 108.751 -175.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 59.5 m -126.22 106.14 9.33 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.609 0.763 . . . . 74.22 109.636 -176.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 56.1 m95 -77.04 111.88 13.08 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.318 0.647 . . . . 74.32 110.461 177.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -108.44 95.17 5.48 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 105.437 -2.06 . . . . 73.12 105.437 170.053 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 64.95 -121.87 22.76 Favored Glycine 0 C--N 1.345 1.035 0 O-C-N 123.741 0.65 . . . . 61.24 112.106 -172.3 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -90.89 0.33 57.52 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.763 0.825 . . . . 64.14 111.444 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 63.5 m -119.48 118.95 32.46 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.543 0.737 . . . . 45.2 110.362 -169.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.491 HG12 HD12 ' A' ' 81' ' ' LEU . 7.2 p -91.9 128.02 43.82 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.184 0 N-CA-C 109.052 -0.722 . . . . 64.04 109.052 173.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 40.5 m -105.08 112.24 25.29 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.567 0.747 . . . . 73.33 109.129 178.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 78.7 t -114.91 113.01 42.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 125.262 1.425 . . . . 75.34 108.112 179.54 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.4 145.65 46.98 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 109.217 -0.66 . . . . 75.5 109.217 -179.614 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 161.77 -147.91 14.78 Favored Glycine 0 C--N 1.332 0.35 0 N-CA-C 110.917 -0.873 . . . . 55.3 110.917 -173.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 5.0 pm0 -142.1 165.07 28.45 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 117.226 0.513 . . . . 72.21 110.103 177.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -100.78 159.61 15.04 Favored 'General case' 0 C--O 1.243 0.729 0 C-N-CA 123.819 0.848 . . . . 72.42 109.436 173.109 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -97.29 113.49 25.12 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 109.151 -0.685 . . . . 72.52 109.151 170.238 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -143.35 104.59 0.35 Allowed Glycine 0 C--N 1.335 0.492 0 N-CA-C 109.981 -1.247 . . . . 75.11 109.981 176.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 28.6 m -70.87 -31.52 45.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 CA-C-O 120.857 0.361 . . . . 75.13 110.422 177.326 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -104.44 104.3 14.15 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 108.331 -0.988 . . . . 75.1 108.331 176.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 33.0 mt -98.51 -65.35 0.97 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 106.925 -1.509 . . . . 75.45 106.925 170.114 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.554 ' HG3' ' HG3' ' A' ' 50' ' ' LYS . 24.4 mt-10 -152.99 133.63 13.79 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.267 1.427 . . . . 74.15 108.46 167.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 68.0 m-70 -76.82 164.97 25.33 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 108.597 -0.89 . . . . 74.23 108.597 167.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 29.4 t-80 -88.33 34.44 0.75 Allowed 'General case' 0 N--CA 1.486 1.337 0 CA-C-O 122.075 0.94 . . . . 73.1 110.005 176.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 82.2 t60 -71.63 -25.71 62.26 Favored 'General case' 0 C--N 1.347 0.482 0 C-N-CA 124.427 1.091 . . . . 63.24 111.263 179.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 45.2 t60 -61.74 98.11 0.09 Allowed 'General case' 0 C--N 1.354 0.788 0 CA-C-O 121.823 0.821 . . . . 70.13 111.104 -177.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 64.8 m80 -116.73 -41.78 3.03 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 106.187 -1.783 . . . . 75.41 106.187 165.181 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 56.9 t-80 . . . . . 0 C--O 1.253 1.279 0 CA-C-N 113.962 -1.472 . . . . 73.31 107.471 172.825 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.7 mmm . . . . . 0 N--CA 1.477 0.898 0 N-CA-C 109.792 -0.447 . . . . 73.1 109.792 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.8 p -100.35 100.39 11.17 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.044 0.937 . . . . 73.44 108.504 173.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 168.4 72.28 0.03 OUTLIER Glycine 0 C--N 1.341 0.82 0 N-CA-C 110.399 -1.08 . . . . 74.21 110.399 -177.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 63.4 mttm -103.96 127.88 51.49 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.617 0.767 . . . . 74.03 111.397 -174.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.423 ' HE3' ' HB3' ' A' ' 5' ' ' LYS . 1.0 OUTLIER -101.13 105.25 16.38 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 106.635 -1.617 . . . . 75.1 106.635 169.664 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.3 p -98.79 144.77 11.22 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 N-CA-C 109.083 -0.71 . . . . 72.54 109.083 176.341 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.403 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 41.0 mt-10 -100.46 110.6 22.79 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 107.49 -1.3 . . . . 73.52 107.49 170.03 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.453 HG21 HD12 ' A' ' 25' ' ' LEU . 77.2 t -99.54 106.68 19.41 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 125.072 1.349 . . . . 74.31 108.282 -179.372 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.446 ' NE2' ' HB3' ' A' ' 61' ' ' ARG . 39.6 mt-30 -98.73 100.28 11.48 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 107.824 -1.176 . . . . 72.32 107.824 -176.404 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.439 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 95.8 t -93.69 103.08 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 N-CA-C 108.605 -0.887 . . . . 75.21 108.605 -176.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.409 ' HA ' ' HB3' ' A' ' 20' ' ' GLU . 22.5 ttmm -109.61 102.85 11.65 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 108.021 -1.103 . . . . 74.11 108.021 -178.111 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.519 HD11 HG13 ' A' ' 48' ' ' ILE . 13.7 tt -112.82 141.83 27.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 109.46 -0.57 . . . . 73.13 109.46 -179.332 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 45.0 m -121.22 133.05 55.15 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.591 0.756 . . . . 75.24 110.031 -178.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.522 ' SG ' ' ND2' ' A' ' 15' ' ' ASN . 19.6 t -160.31 133.88 6.95 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.599 1.16 . . . . 75.03 110.015 176.952 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.522 ' ND2' ' SG ' ' A' ' 14' ' ' CYS . 63.6 m-80 63.92 23.45 13.34 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 124.705 1.202 . . . . 75.33 112.17 -178.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 74.72 16.21 80.37 Favored Glycine 0 C--N 1.35 1.333 0 CA-C-N 116.307 -0.406 . . . . 70.42 113.013 -174.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.3 mmpt? -118.71 122.26 42.06 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.977 0.911 . . . . 75.23 109.859 178.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 89.9 m -98.46 121.5 40.47 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 123.15 0.58 . . . . 75.24 110.122 178.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.1 m-85 -106.17 111.11 23.59 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 107.364 -1.347 . . . . 63.14 107.364 176.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.439 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 0.8 OUTLIER -140.51 155.47 46.63 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 112.393 0.516 . . . . 61.03 112.393 -173.575 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 40.8 ttm180 -168.32 145.06 3.93 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.003 0.921 . . . . 74.2 109.549 175.108 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 53.5 m -85.47 112.29 20.76 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.669 0.787 . . . . 72.01 109.05 172.047 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -98.88 138.85 35.41 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.761 0.824 . . . . 72.54 109.111 178.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 26.2 mp0 -104.89 109.43 21.4 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 107.616 -1.253 . . . . 75.13 107.616 -178.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.453 HD12 HG21 ' A' ' 8' ' ' VAL . 81.6 mt -117.02 102.6 9.47 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.865 0.866 . . . . 74.51 109.322 -175.266 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.419 ' O ' ' HE3' ' A' ' 36' ' ' LYS . 72.5 t80 -94.67 126.27 39.86 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.308 0.643 . . . . 73.31 109.612 176.741 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.476 ' HB3' ' HB2' ' A' ' 32' ' ' GLU . . . -139.95 153.21 46.85 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.808 0.843 . . . . 72.4 109.5 175.171 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 47.2 t -74.86 -58.68 4.26 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 N-CA-C 108.664 -0.865 . . . . 73.53 108.664 174.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.486 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 79.2 mtt180 -101.42 168.21 9.66 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 115.571 -0.74 . . . . 65.33 111.223 -178.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.8 -46.15 76.11 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.448 1.499 . . . . 75.11 110.038 -178.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -60.22 -30.15 69.2 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 113.774 -1.557 . . . . 75.3 111.766 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.486 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 37.4 mm-40 -71.34 -24.58 62.13 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.49 0.716 . . . . 75.35 111.645 -178.738 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.68 -28.31 61.68 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 122.917 0.487 . . . . 74.24 110.034 178.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.433 ' HE2' ' HB3' ' A' ' 34' ' ' LYS . 39.5 mtpt -52.59 -56.85 12.43 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 123.351 0.66 . . . . 74.42 112.477 -176.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.455 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 2.8 pp20? -59.65 -32.62 70.63 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 123.993 0.808 . . . . 73.33 112.153 -175.511 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.419 ' HE3' ' O ' ' A' ' 26' ' ' TYR . 55.3 mttm -67.85 -46.49 71.62 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.296 0.639 . . . . 74.04 110.206 177.825 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 72.5 mt -58.38 -42.42 87.0 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.168 0.987 . . . . 73.51 110.844 177.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.581 ' HZ2' ' HB3' ' A' ' 38' ' ' LYS . 8.5 mtpm? -62.41 -40.98 98.29 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.095 0.958 . . . . 74.22 111.266 178.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.455 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 74.3 mmtt -63.46 -51.68 64.65 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 123.434 0.459 . . . . 73.34 110.837 175.707 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 92.3 t -60.36 -37.95 76.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 124.171 0.988 . . . . 74.51 111.629 -177.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.43 HD21 HD11 ' A' ' 60' ' ' ILE . 65.2 mt -68.46 -51.15 46.75 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 122.901 0.48 . . . . 74.31 110.257 178.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -61.76 -30.51 70.83 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.169 0.588 . . . . 74.34 111.725 178.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -67.56 -53.13 30.98 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.243 0.617 . . . . 72.43 110.721 175.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.412 ' NE ' ' HA ' ' A' ' 44' ' ' ARG . 0.0 OUTLIER -74.97 -26.92 59.93 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 123.324 0.39 . . . . 73.33 111.763 -173.073 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.568 ' HB3' ' HE3' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -82.04 -27.92 32.75 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.594 0.758 . . . . 74.0 112.014 -179.405 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -56.99 -52.48 73.77 Favored Pre-proline 0 CA--C 1.562 1.438 0 N-CA-C 113.025 0.75 . . . . 73.32 113.025 -173.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.412 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 41.9 Cg_endo -64.24 -30.99 64.31 Favored 'Trans proline' 0 C--N 1.385 2.453 0 C-N-CA 121.775 1.65 . . . . 74.0 111.793 176.191 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.519 HG13 HD11 ' A' ' 12' ' ' ILE . 44.8 mm -74.9 -33.34 29.77 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.046 0 C-N-CA 123.999 0.919 . . . . 75.22 111.003 -174.408 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.568 ' HE3' ' HB3' ' A' ' 45' ' ' MET . 98.9 mttt -70.17 -34.36 72.89 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.39 0.676 . . . . 73.51 109.743 175.429 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -72.87 -29.22 63.01 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.884 0.874 . . . . 73.34 110.901 175.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 73.6 mt -71.81 -29.74 64.76 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 109.317 -0.623 . . . . 74.43 109.317 173.642 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 71.52 54.11 9.14 Favored Glycine 0 C--N 1.351 1.4 0 O-C-N 123.791 0.682 . . . . 74.32 111.982 176.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.482 ' SG ' HG22 ' A' ' 48' ' ' ILE . 12.7 m -73.35 122.0 21.34 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 122.98 0.512 . . . . 74.31 110.391 -179.321 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -67.4 -25.1 65.78 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.763 0.825 . . . . 75.13 110.807 177.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 16.8 tpp180 -140.38 129.15 23.11 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.132 0.973 . . . . 72.14 108.931 175.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 19.7 m -118.22 143.53 28.78 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 123.298 0.639 . . . . 74.54 109.601 170.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.489 ' HG3' ' HG2' ' A' ' 105' ' ' GLU . 52.0 ttt-85 -131.52 106.43 8.21 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 108.814 -0.81 . . . . 74.33 108.814 172.381 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.42 ' HB ' ' HB ' ' A' ' 104' ' ' VAL . 39.3 mt -99.6 129.42 50.18 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 C-N-CA 124.922 1.289 . . . . 74.0 107.539 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.2 m -120.68 103.3 9.02 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 107.464 -1.309 . . . . 70.32 107.464 179.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.43 HD11 HD21 ' A' ' 41' ' ' LEU . 73.2 mt -98.77 104.95 16.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 N-CA-C 108.884 -0.784 . . . . 72.33 108.884 -177.409 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.446 ' HB3' ' NE2' ' A' ' 9' ' ' GLN . 0.0 OUTLIER -96.23 109.99 22.36 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 108.4 -0.963 . . . . 73.11 108.4 -176.339 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 21.9 t -95.03 127.0 47.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 C-N-CA 124.468 1.107 . . . . 63.1 110.089 -174.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.403 ' HB3' ' H ' ' A' ' 7' ' ' GLU . 3.9 tppp? -87.6 102.52 14.69 Favored 'General case' 0 C--O 1.24 0.565 0 N-CA-C 108.717 -0.845 . . . . 72.43 108.717 177.627 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 36.7 m80 -71.61 140.92 49.96 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 123.402 0.439 . . . . 75.31 110.114 178.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 17.2 m -62.39 -46.57 88.01 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.698 1.199 . . . . 74.52 112.532 -166.339 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -141.71 153.24 44.51 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 122.723 0.409 . . . . 74.21 110.992 -172.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -74.57 -15.44 60.84 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 124.196 0.999 . . . . 74.44 112.803 -175.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -86.14 -44.93 11.82 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 122.763 0.425 . . . . 64.32 109.887 171.43 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -66.28 -35.14 79.63 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-N 115.575 -0.738 . . . . 75.22 112.551 -177.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -43.59 -38.43 2.99 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 115.038 1.496 . . . . 64.02 115.038 -167.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -67.11 -41.97 85.31 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.412 0.685 . . . . 74.3 111.039 -177.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 18.2 tppt? -77.53 -35.74 53.04 Favored 'General case' 0 C--O 1.241 0.642 0 C-N-CA 123.72 0.808 . . . . 75.35 109.837 174.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.661 ' HG3' ' HD2' ' A' ' 76' ' ' LYS . 34.9 tt0 -74.29 -15.19 60.97 Favored 'General case' 0 C--N 1.351 0.673 0 CA-C-N 115.533 -0.758 . . . . 73.33 111.345 -175.124 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.77 -62.2 1.64 Allowed 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 108.685 -0.857 . . . . 65.24 108.685 171.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 57.8 tttm -65.1 -24.56 67.47 Favored 'General case' 0 N--CA 1.481 1.1 0 O-C-N 123.514 0.508 . . . . 75.4 111.715 -179.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.661 ' HD2' ' HG3' ' A' ' 73' ' ' GLU . 3.4 ttmp? -59.54 -60.45 3.83 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.93 0.892 . . . . 73.34 110.685 172.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -77.31 -21.73 53.05 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 115.549 -0.75 . . . . 73.04 109.961 -174.565 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.416 ' HA ' ' CE2' ' A' ' 97' ' ' TRP . . . -64.11 -43.47 95.24 Favored 'General case' 0 C--N 1.345 0.406 0 C-N-CA 123.488 0.715 . . . . 64.35 110.142 172.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.88 -48.26 79.75 Favored 'General case' 0 C--N 1.349 0.561 0 O-C-N 124.142 0.901 . . . . 54.03 110.752 175.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.4 ' O ' HG21 ' A' ' 84' ' ' VAL . 38.1 mm -62.54 -50.59 79.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 O-C-N 123.944 0.778 . . . . 71.43 111.41 -175.204 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 10.7 mt -67.03 -39.11 86.92 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-O 119.253 -0.403 . . . . 74.11 111.035 -179.312 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -61.09 -36.87 80.81 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 122.967 0.507 . . . . 73.01 110.65 -179.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.485 ' O ' ' HG2' ' A' ' 87' ' ' GLU . 33.2 mmtp -71.31 -37.33 71.81 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 115.482 -0.781 . . . . 72.15 111.04 175.907 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.4 HG21 ' O ' ' A' ' 80' ' ' ILE . 53.8 t -64.64 -38.57 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 123.539 0.736 . . . . 74.12 110.402 178.576 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.546 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 22.0 m-85 -64.34 -36.02 82.78 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 114.955 -1.021 . . . . 73.42 110.431 174.907 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -73.77 -23.5 59.72 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 123.683 0.793 . . . . 75.32 111.652 175.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.485 ' HG2' ' O ' ' A' ' 83' ' ' LYS . 37.6 mm-40 -74.71 -29.72 61.29 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.024 0.53 . . . . 73.23 111.718 176.35 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 82.1 mt -108.35 -18.87 13.64 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.174 0.59 . . . . 74.23 111.781 -168.44 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 107.18 11.44 25.81 Favored Glycine 0 C--N 1.347 1.174 0 N-CA-C 114.6 0.6 . . . . 62.34 114.6 174.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.546 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 87.7 m-85 -72.1 120.21 17.39 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 108.807 -0.812 . . . . 74.43 108.807 171.682 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -77.6 165.07 24.75 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.671 0.788 . . . . 70.22 110.329 -173.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -53.06 -44.42 67.46 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.771 0.828 . . . . 72.41 111.701 173.023 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 34.5 t -66.56 -8.51 27.4 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.231 1.012 . . . . 72.13 112.215 179.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . 0.433 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 12.8 m120 -104.26 -11.03 17.44 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.409 0.684 . . . . 73.41 111.176 178.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 57.6 t -109.87 113.46 44.28 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 C-N-CA 123.483 0.713 . . . . 74.11 109.925 -175.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 7.9 m -123.13 97.58 5.49 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.303 0.641 . . . . 73.41 110.159 175.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.416 ' CE2' ' HA ' ' A' ' 78' ' ' ALA . 5.1 m95 -74.17 150.08 40.59 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 122.892 0.477 . . . . 75.22 110.967 178.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -159.4 81.76 0.75 Allowed 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.361 0.664 . . . . 73.22 110.29 -178.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 70.08 -101.06 0.83 Allowed Glycine 0 CA--C 1.533 1.194 0 CA-C-N 115.237 -0.892 . . . . 72.25 113.581 174.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -90.77 -20.97 21.78 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.678 0.791 . . . . 62.5 111.093 177.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 17.0 m -114.64 128.81 56.52 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.198 0.599 . . . . 73.02 110.74 -169.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.423 HG12 ' HB ' ' A' ' 60' ' ' ILE . 10.3 p -99.91 130.87 48.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 N-CA-C 108.048 -1.093 . . . . 73.4 108.048 166.476 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 15.1 m -108.1 102.54 11.69 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.495 -0.928 . . . . 73.51 108.495 179.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.433 ' HA ' ' O ' ' A' ' 94' ' ' ASN . 41.0 t -92.91 109.01 21.06 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 N-CA-C 108.008 -1.108 . . . . 71.44 108.008 -179.184 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . 0.489 ' HG2' ' HG3' ' A' ' 57' ' ' ARG . 42.1 mt-10 -121.55 112.43 18.47 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 107.21 -1.404 . . . . 72.42 107.21 -176.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -164.75 -167.23 24.99 Favored Glycine 0 C--O 1.246 0.88 0 C-N-CA 120.93 -0.652 . . . . 72.34 113.254 -173.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 27.4 pt20 -103.47 146.5 28.42 Favored 'General case' 0 C--O 1.24 0.575 0 C-N-CA 124.499 1.12 . . . . 74.34 109.833 -178.545 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.563 HD12 ' HA ' ' A' ' 49' ' ' LYS . 64.6 mt -79.5 158.89 27.14 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 115.459 -0.791 . . . . 72.55 110.865 172.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -77.42 75.3 3.98 Favored 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 125.324 1.45 . . . . 70.43 110.502 173.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -125.38 -58.81 0.17 Allowed Glycine 0 N--CA 1.471 1.032 0 CA-C-N 116.101 -0.499 . . . . 72.34 111.959 -175.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.6 t -67.23 -45.34 86.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 N-CA-C 108.853 -0.795 . . . . 71.25 108.853 177.611 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -81.02 116.74 21.12 Favored 'General case' 0 C--O 1.242 0.691 0 CA-C-N 114.567 -1.197 . . . . 75.25 108.683 175.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 67.3 mt -86.43 -14.04 44.47 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.659 0.784 . . . . 74.43 111.655 -174.392 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -85.22 64.46 8.69 Favored 'General case' 0 C--O 1.241 0.618 0 CA-C-O 121.659 0.742 . . . . 74.22 110.726 -175.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 16.4 t-160 -65.74 133.19 50.52 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 107.828 -1.175 . . . . 75.13 107.828 167.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 45.6 m80 -63.62 94.73 0.09 Allowed 'General case' 0 CA--C 1.54 0.588 0 O-C-N 123.728 0.643 . . . . 70.54 111.057 -177.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 55.7 m80 -78.29 148.47 33.84 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 114.621 -1.172 . . . . 72.44 108.245 173.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 47.3 p-80 -78.03 160.79 27.92 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 109.593 -0.521 . . . . 71.3 109.593 179.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 54.7 t60 -52.89 120.25 5.58 Favored 'General case' 0 N--CA 1.48 1.041 0 O-C-N 124.289 0.993 . . . . 63.14 112.316 -171.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 58.4 m-70 . . . . . 0 C--O 1.248 1.021 0 C-N-CA 124.157 0.983 . . . . 74.33 108.874 173.088 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.2 mtt . . . . . 0 N--CA 1.477 0.885 0 N-CA-C 109.291 -0.633 . . . . 72.33 109.291 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.8 t -77.81 -51.2 10.87 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 123.398 0.679 . . . . 71.41 110.934 -177.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -81.87 97.15 1.84 Allowed Glycine 0 C--N 1.347 1.178 0 N-CA-C 111.488 -0.645 . . . . 74.32 111.488 -179.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.528 ' HA ' ' HE2' ' A' ' 4' ' ' LYS . 8.1 mmpt? -115.15 170.33 8.44 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.689 0.795 . . . . 74.31 111.503 -175.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -88.35 98.43 11.6 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 108.163 -1.051 . . . . 74.51 108.163 178.075 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.425 ' CG2' HG21 ' A' ' 62' ' ' VAL . 0.2 OUTLIER -98.42 137.4 26.04 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 CA-C-N 114.104 -1.407 . . . . 74.44 107.516 177.69 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -107.29 114.06 27.85 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 108.412 -0.958 . . . . 75.52 108.412 176.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.428 HG13 HG21 ' A' ' 60' ' ' ILE . 93.5 t -98.98 107.73 21.04 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 C-N-CA 125.628 1.571 . . . . 70.32 108.987 -171.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.534 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 63.6 mt-30 -95.27 100.89 12.61 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 108.277 -1.008 . . . . 75.31 108.277 -174.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.526 HG12 HG23 ' A' ' 58' ' ' ILE . 88.4 t -93.02 104.66 15.95 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 C-N-CA 123.579 0.751 . . . . 72.41 109.382 -175.373 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.4 ttmm -102.91 102.27 12.34 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 107.714 -1.217 . . . . 74.32 107.714 178.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.487 ' HA ' ' O ' ' A' ' 57' ' ' ARG . 12.4 tt -115.9 118.5 58.99 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 CA-C-O 121.157 0.503 . . . . 74.35 110.889 -174.606 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 19.8 m -97.09 102.97 14.86 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 108.879 -0.785 . . . . 75.45 108.879 178.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.589 ' SG ' HG22 ' A' ' 48' ' ' ILE . 42.2 t -120.0 125.75 49.13 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.876 1.27 . . . . 75.31 109.46 178.81 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.512 ' ND2' ' HB3' ' A' ' 51' ' ' LEU . 88.1 m-20 61.43 25.56 15.48 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 125.051 1.341 . . . . 71.41 112.115 -177.008 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.98 10.96 85.7 Favored Glycine 0 C--N 1.348 1.195 0 CA-C-N 115.718 -0.674 . . . . 72.45 113.467 -177.777 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -108.23 133.33 52.61 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.245 1.018 . . . . 71.34 108.982 176.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 49.6 m -106.24 118.03 35.58 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.072 0.549 . . . . 64.32 110.032 -173.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -111.56 101.96 10.33 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 107.243 -1.391 . . . . 75.25 107.243 179.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.424 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 14.1 pt-20 -116.95 134.51 54.66 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 122.038 -0.414 . . . . 74.32 110.46 179.249 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.8 ttt180 -155.35 141.05 18.02 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.657 -0.701 . . . . 74.13 110.075 -178.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 42.9 m -92.28 118.55 31.0 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 124.555 1.142 . . . . 63.01 110.151 178.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 89.6 m-85 -103.91 131.98 50.61 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.937 0.895 . . . . 64.43 110.332 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -91.49 110.13 21.44 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 108.814 -0.81 . . . . 71.14 108.814 -179.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 80.6 mt -118.98 112.89 20.16 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.674 0.79 . . . . 72.11 109.843 -179.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 88.0 t80 -110.2 138.79 46.1 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.619 0.767 . . . . 74.12 109.133 172.248 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.51 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -135.96 172.08 13.53 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.726 0.81 . . . . 74.35 110.075 177.644 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 24.0 t -98.01 -44.14 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 N-CA-C 108.749 -0.834 . . . . 74.34 108.749 168.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.574 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 92.9 mtt180 -116.71 158.3 24.05 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 115.464 -0.789 . . . . 73.1 110.501 178.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.415 ' HB2' HD11 ' A' ' 80' ' ' ILE . 15.9 p-10 -68.6 -29.14 67.59 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.909 0.883 . . . . 62.41 110.772 178.357 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.529 ' HA ' ' HD3' ' A' ' 34' ' ' LYS . 60.5 mm-40 -60.37 -40.87 92.35 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.488 0.715 . . . . 75.12 110.925 170.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.574 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 34.6 mm-40 -65.81 -28.16 68.79 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 116.082 -0.508 . . . . 75.11 110.601 178.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.43 -33.16 60.89 Favored 'General case' 0 CA--C 1.56 1.341 0 C-N-CA 122.917 0.487 . . . . 75.42 110.272 -179.108 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.529 ' HD3' ' HA ' ' A' ' 31' ' ' GLU . 53.3 mtpt -54.08 -55.47 27.18 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.924 0.89 . . . . 64.43 111.867 179.614 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.499 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 11.6 pt-20 -60.85 -35.98 77.98 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 115.293 -0.867 . . . . 73.3 111.384 -179.418 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 64.7 mttm -66.64 -41.05 88.91 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.259 0.624 . . . . 75.24 111.127 -178.314 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.537 HD11 HD22 ' A' ' 81' ' ' LEU . 94.3 mt -62.81 -40.93 98.91 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 123.746 0.654 . . . . 63.03 110.767 174.55 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -62.12 -41.71 98.5 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 122.765 0.426 . . . . 71.42 111.02 175.304 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.499 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 72.8 mmtt -63.94 -55.45 22.46 Favored 'General case' 0 N--CA 1.478 0.961 0 O-C-N 123.415 0.447 . . . . 75.3 110.275 178.607 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 51.7 t -54.56 -46.66 72.12 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.391 0 C-N-CA 124.541 1.136 . . . . 65.43 111.524 -178.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.418 ' O ' ' HG2' ' A' ' 45' ' ' MET . 67.1 mt -68.34 -41.0 81.36 Favored 'General case' 0 C--O 1.207 -1.14 0 CA-C-O 118.751 -0.643 . . . . 74.35 110.926 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -61.91 -43.02 99.7 Favored 'General case' 0 N--CA 1.492 1.662 0 CA-C-N 118.531 0.605 . . . . 65.1 111.857 176.171 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 21.6 mm-40 -61.32 -46.32 90.75 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 109.526 -0.546 . . . . 73.43 109.526 177.586 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -67.66 -41.1 84.3 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 114.989 -1.005 . . . . 74.14 111.481 -176.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.589 ' SD ' HD12 ' A' ' 58' ' ' ILE . 92.1 mmm -79.02 -21.36 47.07 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.025 0.53 . . . . 75.14 111.183 -175.715 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.498 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 13.9 t70 -57.67 -52.4 74.65 Favored Pre-proline 0 CA--C 1.565 1.556 0 N-CA-C 112.929 0.715 . . . . 73.41 112.929 -171.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.423 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 73.3 Cg_endo -71.75 -22.97 23.16 Favored 'Trans proline' 0 C--N 1.39 2.712 0 C-N-CA 121.805 1.67 . . . . 72.34 112.204 175.089 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.589 HG22 ' SG ' ' A' ' 14' ' ' CYS . 46.9 mm -74.21 -31.67 29.87 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 C-N-CA 124.58 1.152 . . . . 74.21 110.784 -175.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.555 ' HG2' HD13 ' A' ' 108' ' ' LEU . 49.2 mtmt -73.77 -34.58 64.75 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.216 0.606 . . . . 75.13 110.021 175.003 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -65.83 -27.21 68.08 Favored 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 124.343 1.057 . . . . 64.22 109.575 174.024 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.512 ' HB3' ' ND2' ' A' ' 15' ' ' ASN . 83.7 mt -75.27 -39.5 59.69 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 109.617 -0.512 . . . . 74.1 109.617 173.183 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 77.63 36.49 33.23 Favored Glycine 0 C--N 1.346 1.135 0 CA-C-N 115.237 -0.892 . . . . 65.12 114.076 174.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.405 ' O ' ' HB3' ' A' ' 108' ' ' LEU . 2.0 p -71.65 119.69 16.17 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 109.55 -0.537 . . . . 75.45 109.55 171.84 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.9 mptt -70.36 -25.02 63.08 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 124.105 0.962 . . . . 75.03 110.804 -170.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 33.0 ttp-105 -129.07 125.74 37.9 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.173 0.989 . . . . 74.21 108.354 178.148 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 15.3 m -122.17 137.08 56.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 123.419 0.687 . . . . 75.54 109.44 177.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.487 ' O ' ' HA ' ' A' ' 12' ' ' ILE . 18.3 ttm180 -111.19 104.1 12.58 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 108.532 -0.914 . . . . 74.12 108.532 172.98 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.589 HD12 ' SD ' ' A' ' 45' ' ' MET . 59.4 mt -98.45 105.2 16.96 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 N-CA-C 108.029 -1.1 . . . . 73.15 108.029 174.259 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 27.1 m -101.85 104.34 15.07 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 107.713 -1.217 . . . . 61.22 107.713 179.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.428 HG21 HG13 ' A' ' 8' ' ' VAL . 50.7 mt -95.14 116.03 35.53 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 C-N-CA 123.641 0.776 . . . . 72.34 109.369 -177.13 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.534 ' HB2' ' HB2' ' A' ' 9' ' ' GLN . 33.1 mtm180 -100.87 113.94 27.34 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 107.395 -1.335 . . . . 74.42 107.395 174.941 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.425 HG21 ' CG2' ' A' ' 6' ' ' VAL . 3.2 p -92.43 126.92 44.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 N-CA-C 108.129 -1.063 . . . . 75.44 108.129 -178.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.8 ttpp -81.94 109.36 16.22 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 109.021 -0.733 . . . . 75.21 109.021 -177.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . 0.481 ' ND1' ' HB2' ' A' ' 70' ' ' GLU . 31.6 m170 -86.0 108.52 18.26 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 124.073 0.949 . . . . 74.24 109.055 -178.629 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 13.4 m -74.98 -25.87 59.16 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.181 0.992 . . . . 71.11 112.798 -169.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -146.15 128.01 15.39 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.041 0.536 . . . . 70.3 109.695 -175.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.29 -27.51 68.67 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 113.813 1.042 . . . . 65.35 113.813 -172.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -84.86 -36.58 21.46 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 122.658 0.383 . . . . 74.34 110.822 -179.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -77.51 -28.08 51.97 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 116.093 -0.503 . . . . 63.23 112.061 -178.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.6 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 0.1 OUTLIER -70.27 -13.11 62.02 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 113.865 1.061 . . . . 72.51 113.865 -169.301 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 49.0 mtmt -67.68 -51.75 46.01 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-O 121.735 0.779 . . . . 75.23 109.162 171.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -74.9 -31.36 61.54 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.414 1.486 . . . . 75.2 110.857 -179.011 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.6 ' HB3' ' HA ' ' A' ' 70' ' ' GLU . 0.1 OUTLIER -73.65 -49.23 27.01 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.77 0.828 . . . . 73.21 110.435 -177.678 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.61 -34.24 77.8 Favored 'General case' 0 N--CA 1.483 1.223 0 O-C-N 123.591 0.557 . . . . 73.11 111.571 177.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 54.8 tptt -58.79 -50.9 72.21 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 124.37 1.044 . . . . 74.35 109.346 174.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.491 ' O ' HG12 ' A' ' 80' ' ' ILE . 39.3 ttmt -68.28 -39.68 82.05 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 114.377 -1.283 . . . . 71.24 110.838 -178.68 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -75.02 -22.39 58.51 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.314 1.045 . . . . 74.43 110.071 -171.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -67.13 -43.3 82.73 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.483 0.713 . . . . 63.24 110.616 172.423 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.15 -37.35 85.46 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 115.667 -0.697 . . . . 74.33 110.763 175.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.491 HG12 ' O ' ' A' ' 76' ' ' LYS . 43.4 mm -62.7 -47.86 90.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 123.893 0.877 . . . . 75.23 110.188 177.481 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.537 HD22 HD11 ' A' ' 37' ' ' LEU . 39.8 mt -67.71 -33.78 75.58 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.692 0.797 . . . . 74.01 111.618 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -60.88 -40.84 94.51 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.01 0.524 . . . . 74.42 110.155 -178.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 49.0 mmtm -64.95 -45.02 87.48 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.672 -0.694 . . . . 73.14 110.957 176.229 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.494 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 77.4 t -64.81 -59.75 3.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 C-N-CA 123.342 0.657 . . . . 74.44 110.302 -172.459 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.523 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 30.4 m-85 -57.79 -42.67 84.64 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.116 0.967 . . . . 73.03 112.342 -177.506 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.02 -34.61 77.94 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.21 0.604 . . . . 72.11 111.323 179.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -89.1 1.14 56.04 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.05 0.94 . . . . 70.14 111.672 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 37.8 mt -106.11 -26.08 11.76 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.226 0.611 . . . . 74.34 110.73 175.043 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 124.49 -9.99 8.16 Favored Glycine 0 C--N 1.345 1.072 0 CA-C-O 119.913 -0.382 . . . . 64.33 112.989 -179.253 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.523 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 70.9 m-85 -79.12 127.8 32.47 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 122.774 0.43 . . . . 71.24 110.011 177.062 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.421 ' N ' HD21 ' A' ' 91' ' ' ASN . 0.8 OUTLIER -84.36 171.02 13.02 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.796 0.838 . . . . 72.44 109.877 -179.502 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -56.77 -42.54 79.56 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.031 0.932 . . . . 74.35 111.642 178.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 30.9 t -56.23 -31.64 63.71 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.277 1.031 . . . . 72.51 112.949 178.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . 0.463 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 14.1 m120 -65.24 -32.21 73.76 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 122.662 0.385 . . . . 74.12 111.653 179.492 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 58.9 t -88.86 127.35 41.7 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 C-N-CA 124.02 0.928 . . . . 70.22 110.427 -172.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 63.5 m -143.72 122.38 12.56 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.468 0.707 . . . . 74.45 110.665 172.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 75.2 m95 -87.89 124.47 33.71 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 123.522 0.729 . . . . 73.24 111.349 177.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -120.81 91.89 3.64 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 107.955 -1.128 . . . . 71.51 107.955 169.195 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 70.69 -125.81 13.89 Favored Glycine 0 C--N 1.346 1.086 0 CA-C-N 115.79 -0.641 . . . . 64.4 112.095 -177.72 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -81.96 -6.73 59.36 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.76 0.824 . . . . 72.02 111.389 178.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 76.6 m -103.07 149.73 24.3 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.816 0.846 . . . . 73.51 109.564 -179.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.8 p -130.38 116.73 37.07 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.942 0 C-N-CA 123.975 0.91 . . . . 64.41 108.604 169.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 57.0 m -93.71 117.3 29.92 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 108.219 -1.03 . . . . 75.45 108.219 176.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.463 ' HA ' ' O ' ' A' ' 94' ' ' ASN . 89.9 t -114.57 110.97 33.99 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 C-N-CA 124.258 1.023 . . . . 73.23 108.261 177.615 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -123.59 116.16 22.68 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 109.118 -0.697 . . . . 72.13 109.118 178.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -141.15 173.74 23.14 Favored Glycine 0 C--N 1.342 0.873 0 O-C-N 123.477 0.485 . . . . 74.11 112.425 -177.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -78.84 118.69 21.12 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 122.592 0.357 . . . . 73.23 110.101 177.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.555 HD13 ' HG2' ' A' ' 49' ' ' LYS . 41.2 tp -90.44 149.25 22.32 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 108.683 -0.858 . . . . 75.52 108.683 167.062 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 70.71 9.88 6.95 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 124.701 1.2 . . . . 74.3 111.705 177.145 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -78.08 -52.29 5.37 Favored Glycine 0 C--N 1.347 1.177 0 CA-C-N 116.145 -0.48 . . . . 73.11 111.904 177.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 28.3 m -82.8 -14.37 11.97 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 C-N-CA 123.215 0.606 . . . . 62.45 111.522 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -142.65 98.05 3.22 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.933 0.893 . . . . 73.52 108.66 -174.777 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 66.6 mt -76.55 -54.19 7.04 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 123.362 0.665 . . . . 70.34 110.993 -171.526 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -79.76 96.68 6.34 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.317 0.647 . . . . 74.24 112.634 -170.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 32.9 m170 -106.98 -13.74 15.12 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.951 0.9 . . . . 75.52 110.713 172.497 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -71.38 -59.56 2.7 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 108.945 -0.761 . . . . 74.02 108.945 172.706 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 16.7 m-70 -80.81 84.88 6.23 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 108.258 -1.016 . . . . 75.44 108.258 172.24 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 54.4 t-80 -148.63 86.66 1.53 Allowed 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.347 -0.842 . . . . 72.41 109.161 178.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 35.0 m80 -146.08 33.33 1.0 Allowed 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 124.092 0.957 . . . . 62.23 109.627 173.19 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 61.2 t60 . . . . . 0 C--O 1.254 1.307 0 N-CA-C 108.85 -0.796 . . . . 74.31 108.85 176.2 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.0 mtt . . . . . 0 N--CA 1.484 1.27 0 CA-C-O 120.402 0.144 . . . . 72.44 110.9 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.5 m -82.21 113.07 19.79 Favored 'General case' 0 C--N 1.355 0.811 0 C-N-CA 123.347 0.659 . . . . 75.14 109.962 176.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 172.44 112.31 0.28 Allowed Glycine 0 C--N 1.343 0.917 0 N-CA-C 111.57 -0.612 . . . . 75.12 111.57 -179.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.513 ' HZ3' ' HB2' ' A' ' 65' ' ' SER . 33.3 mmtp -108.54 128.59 54.94 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.738 0.815 . . . . 72.14 110.741 178.688 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.411 ' HA ' ' HA ' ' A' ' 26' ' ' TYR . 0.9 OUTLIER -90.42 103.32 16.02 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 107.598 -1.26 . . . . 73.22 107.598 167.06 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.5 p -99.68 142.09 15.81 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 123.987 0.915 . . . . 72.33 109.238 177.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.499 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 34.1 mt-10 -109.67 113.85 26.96 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 108.034 -1.099 . . . . 74.44 108.034 176.043 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 90.1 t -99.25 110.6 26.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 C-N-CA 124.516 1.126 . . . . 62.23 109.998 -171.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.527 ' O ' ' HA ' ' A' ' 60' ' ' ILE . 77.8 mt-30 -82.43 99.74 9.61 Favored 'General case' 0 C--N 1.347 0.474 0 N-CA-C 107.67 -1.233 . . . . 72.51 107.67 178.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 64.0 t -93.38 114.48 30.18 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 N-CA-C 107.237 -1.394 . . . . 74.41 107.237 173.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.486 ' HB3' ' HZ3' ' A' ' 11' ' ' LYS . 7.7 ttpm? -122.35 103.89 9.04 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 107.818 -1.178 . . . . 74.42 107.818 179.666 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.409 ' HA ' ' O ' ' A' ' 57' ' ' ARG . 14.1 tt -122.33 125.69 73.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 122.759 0.424 . . . . 75.35 110.542 -174.333 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 51.4 m -102.2 116.54 32.87 Favored 'General case' 0 C--O 1.241 0.657 0 C-N-CA 123.83 0.852 . . . . 75.15 109.569 176.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 54.1 t -138.89 135.15 34.17 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 124.16 0.984 . . . . 74.43 109.5 175.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.469 ' HB2' ' HB3' ' A' ' 51' ' ' LEU . 67.0 t30 70.22 30.29 3.46 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 124.836 1.254 . . . . 73.42 110.959 175.079 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 83.65 -7.27 69.98 Favored Glycine 0 C--N 1.353 1.487 0 CA-C-N 115.588 -0.733 . . . . 74.14 113.231 -178.053 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 44.9 mtpt -105.4 131.08 53.28 Favored 'General case' 0 C--N 1.348 0.516 0 C-N-CA 123.954 0.902 . . . . 72.52 110.252 -173.085 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 85.8 m -95.34 131.45 41.42 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 108.696 -0.853 . . . . 71.23 108.696 174.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.59 ' HH ' HD13 ' A' ' 51' ' ' LEU . 81.7 m-85 -115.93 144.58 43.86 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 107.046 -1.465 . . . . 75.31 107.046 171.739 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -148.81 130.89 15.36 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 123.105 0.562 . . . . 75.51 109.798 175.358 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 69.9 ttt180 -154.33 134.85 13.46 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 108.471 -0.936 . . . . 72.41 108.471 178.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.422 HG21 ' HB3' ' A' ' 7' ' ' GLU . 16.6 m -101.47 116.82 33.64 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 123.66 0.784 . . . . 75.45 109.808 179.109 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 -97.65 128.71 44.55 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.22 1.008 . . . . 72.45 110.477 -173.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.499 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 25.2 mp0 -90.12 108.35 19.68 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 108.029 -1.1 . . . . 73.42 108.029 -178.136 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.476 HD13 HG23 ' A' ' 40' ' ' VAL . 89.8 mt -121.92 110.11 15.45 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.623 1.169 . . . . 74.43 108.921 -174.104 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.429 ' O ' ' HE3' ' A' ' 36' ' ' LYS . 82.3 t80 -92.53 134.58 34.84 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 122.732 0.413 . . . . 72.32 109.977 173.896 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.525 ' HB2' ' HB2' ' A' ' 32' ' ' GLU . . . -146.65 148.66 32.29 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.415 0.686 . . . . 75.11 110.65 177.686 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 88.5 t -76.38 -56.83 7.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 123.884 0.873 . . . . 75.3 109.56 175.346 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.542 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 94.5 mtt180 -102.32 164.97 11.38 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 115.534 -0.757 . . . . 73.51 110.012 175.618 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -69.72 -27.07 64.67 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 123.147 0.579 . . . . 72.42 110.636 170.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -62.34 -35.2 78.37 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.242 1.017 . . . . 65.44 111.147 176.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.542 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 13.5 mm-40 -70.51 -29.92 66.56 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.358 -0.837 . . . . 74.14 110.135 -178.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.732 HD23 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -75.69 -22.01 57.05 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.107 0.563 . . . . 72.45 110.741 -178.032 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.476 ' HG2' HG22 ' A' ' 80' ' ' ILE . 53.8 mtpt -57.19 -55.83 29.64 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 122.979 0.512 . . . . 71.14 111.13 179.807 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.502 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 2.4 pp20? -61.96 -30.11 70.7 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 115.648 -0.705 . . . . 74.12 112.14 179.7 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.732 ' HD2' HD23 ' A' ' 33' ' ' LEU . 64.3 mttm -70.39 -40.35 74.0 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.197 0.599 . . . . 75.33 110.857 179.454 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.551 HD13 HD21 ' A' ' 81' ' ' LEU . 95.7 mt -62.11 -39.69 93.37 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 123.73 0.643 . . . . 73.1 110.803 174.157 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -64.26 -37.68 88.36 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 122.997 0.519 . . . . 72.34 111.479 175.238 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.502 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 45.0 mmtm -62.88 -55.66 24.18 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 110.054 -0.35 . . . . 73.31 110.054 174.69 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.476 HG23 HD13 ' A' ' 25' ' ' LEU . 55.2 t -54.66 -49.22 69.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 124.808 1.243 . . . . 75.03 111.711 -178.542 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.403 HD22 HD12 ' A' ' 60' ' ' ILE . 40.5 mt -66.32 -45.59 79.78 Favored 'General case' 0 C--O 1.215 -0.712 0 C-N-CA 123.293 0.637 . . . . 75.0 111.601 -176.551 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -65.91 -42.16 90.54 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 112.247 0.462 . . . . 72.43 112.247 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.7 mm-40 -63.13 -50.82 68.94 Favored 'General case' 0 N--CA 1.486 1.344 0 CA-C-O 121.28 0.562 . . . . 62.33 110.634 177.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 15.4 tpt180 -63.7 -41.84 98.06 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.512 1.125 . . . . 75.51 111.37 -177.796 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.49 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 58.0 mtp -92.23 8.21 39.18 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.682 0.623 . . . . 74.41 112.682 -174.733 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.425 ' HA ' ' HZ1' ' A' ' 49' ' ' LYS . 20.4 t70 -73.42 -51.2 5.76 Favored Pre-proline 0 CA--C 1.559 1.295 0 CA-C-O 118.447 -0.787 . . . . 75.44 111.565 174.262 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -69.4 -16.6 39.19 Favored 'Trans proline' 0 C--N 1.389 2.674 0 C-N-CA 121.452 1.435 . . . . 75.11 111.894 174.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.538 HG23 HD13 ' A' ' 108' ' ' LEU . 48.7 mm -72.58 -32.69 42.35 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.132 0 C-N-CA 124.42 1.088 . . . . 73.11 110.309 176.087 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.49 ' HG3' ' O ' ' A' ' 45' ' ' MET . 55.1 mttp -62.3 -41.33 98.41 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 109.387 -0.597 . . . . 73.44 109.387 171.304 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.7 tmmm? -65.58 -32.55 74.2 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.175 0.99 . . . . 73.42 110.993 178.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.59 HD13 ' HH ' ' A' ' 19' ' ' TYR . 83.6 mt -70.47 -30.73 67.61 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 110.106 -0.331 . . . . 74.22 110.106 175.352 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 71.81 56.75 6.31 Favored Glycine 0 C--N 1.348 1.24 0 O-C-N 124.014 0.821 . . . . 75.51 113.448 170.055 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.435 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 89.4 m -88.72 125.54 34.91 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 122.674 0.39 . . . . 62.02 111.303 177.637 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 53.5 tptt -59.91 -39.38 85.23 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.475 1.11 . . . . 75.41 110.256 170.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 25.3 ttm180 -139.85 136.44 33.98 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 109.303 -0.629 . . . . 75.0 109.303 174.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 15.5 m -114.3 144.2 22.39 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 C-N-CA 124.087 0.955 . . . . 74.23 109.241 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.529 ' NH1' ' HG2' ' A' ' 105' ' ' GLU . 23.3 tpp180 -100.25 103.64 15.09 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 107.52 -1.289 . . . . 74.23 107.52 175.04 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 59.6 mt -100.06 133.26 43.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 N-CA-C 107.718 -1.215 . . . . 74.23 107.718 177.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 36.5 t -137.5 102.72 4.85 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 107.529 -1.285 . . . . 72.13 107.529 -176.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.527 ' HA ' ' O ' ' A' ' 9' ' ' GLN . 45.0 mt -115.86 114.28 45.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 C-N-CA 123.214 0.606 . . . . 72.43 111.061 -172.299 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 80.0 ttt180 -105.74 140.44 38.79 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 109.079 -0.712 . . . . 73.51 109.079 176.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.1 p -94.86 141.41 15.07 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 N-CA-C 109.227 -0.657 . . . . 73.24 109.227 178.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.458 ' HB3' ' H ' ' A' ' 7' ' ' GLU . 5.3 tppp? -90.09 123.57 34.07 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 107.045 -1.465 . . . . 74.55 107.045 165.781 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 16.4 p80 -92.02 146.01 24.08 Favored 'General case' 0 C--O 1.238 0.498 0 O-C-N 123.722 0.639 . . . . 71.11 110.963 -179.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.513 ' HB2' ' HZ3' ' A' ' 4' ' ' LYS . 27.7 m -84.49 -50.03 8.11 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 115.346 -0.843 . . . . 74.24 110.955 -176.348 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -93.06 -175.75 3.96 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.308 0.643 . . . . 73.51 111.266 179.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -114.56 -35.19 4.97 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.07 0.948 . . . . 54.02 111.086 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -89.0 -55.53 3.65 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.134 0.573 . . . . 72.32 111.146 174.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.0 mp0 -64.49 -17.88 64.27 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 125.072 1.349 . . . . 72.43 112.436 -171.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.539 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 0.6 OUTLIER -69.41 -22.34 63.69 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.272 1.029 . . . . 75.12 113.744 -174.701 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -69.01 -30.84 69.31 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.582 0.753 . . . . 75.55 109.513 177.432 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -83.14 -40.32 19.9 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.27 1.028 . . . . 73.11 110.102 172.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.539 ' HB3' ' HA ' ' A' ' 70' ' ' GLU . 44.2 tt0 -65.77 -30.26 70.88 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.955 0.902 . . . . 74.13 111.853 -176.164 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.56 -45.3 75.99 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.041 0.536 . . . . 75.34 110.314 176.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.479 ' HZ1' ' HB2' ' A' ' 75' ' ' LYS . 0.0 OUTLIER -69.91 -30.27 67.64 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 123.907 0.754 . . . . 75.2 111.958 176.386 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.406 ' O ' HG12 ' A' ' 80' ' ' ILE . 34.9 ttmt -65.88 -47.14 75.88 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.693 0.797 . . . . 74.31 109.383 174.624 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -73.66 -21.91 60.13 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 114.633 -1.167 . . . . 73.44 109.914 -179.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -66.55 -42.93 86.39 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 123.928 0.891 . . . . 74.43 110.639 173.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.18 -38.43 91.02 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 123.798 0.686 . . . . 72.4 110.382 175.454 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.476 HG22 ' HG2' ' A' ' 34' ' ' LYS . 36.7 mm -65.5 -44.14 94.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 124.272 1.029 . . . . 74.5 111.055 177.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.551 HD21 HD13 ' A' ' 37' ' ' LEU . 35.9 mt -64.54 -45.0 89.04 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.181 0.592 . . . . 74.4 110.088 177.399 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -59.88 -42.29 93.42 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.681 0.792 . . . . 74.23 110.694 -176.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -61.02 -49.57 76.88 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 124.081 0.863 . . . . 74.41 111.073 176.419 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 55.9 t -61.69 -51.01 77.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 123.539 0.736 . . . . 75.41 110.916 -175.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.433 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 35.4 m-85 -59.04 -44.04 91.73 Favored 'General case' 0 N--CA 1.477 0.882 0 O-C-N 124.021 0.825 . . . . 73.5 111.217 179.171 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.53 -32.56 74.26 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.049 0.54 . . . . 75.34 111.681 179.162 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -85.04 -6.46 59.32 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.748 0.819 . . . . 73.52 111.755 -179.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 86.1 mt -104.03 -15.54 15.56 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.388 0.675 . . . . 72.45 110.517 176.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 106.98 20.9 8.44 Favored Glycine 0 C--N 1.345 1.052 0 CA-C-N 116.111 -0.495 . . . . 41.01 113.676 175.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.433 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 95.8 m-85 -88.37 129.05 35.5 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 109.277 -0.638 . . . . 75.45 109.277 169.688 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -77.23 161.29 28.26 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.435 1.094 . . . . 74.14 109.653 -178.048 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -59.06 -38.95 80.62 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 124.18 0.992 . . . . 72.4 111.458 175.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 8.1 t -77.87 9.36 3.62 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 124.089 0.956 . . . . 72.14 112.503 176.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -101.94 -23.33 14.15 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.275 0.63 . . . . 64.21 110.701 168.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 59.6 t -108.78 121.37 61.74 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 C-N-CA 124.038 0.935 . . . . 73.52 110.433 -172.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.9 m -146.06 128.85 16.29 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.996 0.918 . . . . 74.25 109.552 171.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.416 ' HA ' ' HA ' ' A' ' 102' ' ' VAL . 33.7 m95 -73.09 152.73 41.1 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-O 121.468 0.651 . . . . 75.31 111.804 177.214 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -139.45 78.31 1.66 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.953 1.301 . . . . 71.45 107.555 176.241 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 63.92 -98.98 0.27 Allowed Glycine 0 C--N 1.345 1.074 0 CA-C-N 114.974 -1.012 . . . . 73.45 113.602 179.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -84.24 -25.72 29.22 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.648 0.779 . . . . 72.33 112.006 -177.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 28.7 m -125.33 138.04 54.06 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.504 0.722 . . . . 73.31 110.282 -168.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.416 ' HA ' ' HA ' ' A' ' 97' ' ' TRP . 12.2 p -91.59 137.04 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.009 0 N-CA-C 109.489 -0.56 . . . . 74.25 109.489 176.676 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 27.1 m -102.18 106.45 17.29 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.616 1.166 . . . . 74.31 108.266 177.227 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 70.2 t -118.08 112.23 37.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 N-CA-C 108.323 -0.992 . . . . 70.44 108.323 -179.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . 0.529 ' HG2' ' NH1' ' A' ' 57' ' ' ARG . 0.1 OUTLIER -140.92 140.11 34.43 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 122.695 0.398 . . . . 75.24 110.087 178.82 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 160.88 -150.07 19.66 Favored Glycine 0 C--O 1.241 0.59 0 N-CA-C 111.098 -0.801 . . . . 72.12 111.098 -172.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -64.98 143.2 58.11 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 123.587 0.755 . . . . 71.1 112.262 -175.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.538 HD13 HG23 ' A' ' 48' ' ' ILE . 2.0 tt -92.17 128.15 37.91 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 107.427 -1.323 . . . . 74.23 107.427 174.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.458 ' O ' ' HE3' ' A' ' 49' ' ' LYS . 10.5 tp10 -73.58 92.1 1.9 Allowed 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 107.922 -1.14 . . . . 62.02 107.922 167.608 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . 0.453 ' HA2' HD12 ' A' ' 113' ' ' LEU . . . 145.23 34.25 0.07 OUTLIER Glycine 0 C--N 1.339 0.735 0 CA-C-N 115.404 -0.816 . . . . 71.52 112.216 -176.739 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 44.7 t -73.34 99.56 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 N-CA-C 109.253 -0.647 . . . . 73.44 109.253 178.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 34.2 t70 62.7 17.3 9.66 Favored 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 124.769 1.228 . . . . 63.33 112.065 172.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.453 HD12 ' HA2' ' A' ' 110' ' ' GLY . 87.3 mt -73.82 130.7 40.46 Favored 'General case' 0 C--N 1.353 0.749 0 C-N-CA 122.984 0.513 . . . . 73.53 110.081 -179.472 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.16 167.74 13.58 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 123.476 0.711 . . . . 71.12 110.863 172.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 31.4 m170 73.55 0.03 3.52 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 125.483 1.513 . . . . 70.2 113.824 176.03 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 6.5 p-80 -67.91 -32.08 72.31 Favored 'General case' 0 N--CA 1.493 1.713 0 N-CA-C 108.944 -0.762 . . . . 74.41 108.944 170.058 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 31.0 t60 -73.45 82.43 1.45 Allowed 'General case' 0 C--N 1.357 0.903 0 N-CA-C 106.602 -1.629 . . . . 72.33 106.602 168.039 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 14.7 p-80 -83.15 144.53 29.77 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 114.435 -1.257 . . . . 75.52 111.46 -171.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 15.6 p80 -98.23 9.47 42.91 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.697 0.799 . . . . 74.43 110.105 172.218 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 46.8 t-80 . . . . . 0 CA--C 1.556 1.185 0 C-N-CA 124.372 1.069 . . . . 73.23 109.789 171.596 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.8 mmm . . . . . 0 N--CA 1.478 0.944 0 N-CA-C 109.477 -0.564 . . . . 72.23 109.477 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.1 t -153.8 74.83 1.01 Allowed 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 107.31 -1.367 . . . . 73.44 107.31 178.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -166.46 64.07 0.21 Allowed Glycine 0 C--N 1.334 0.455 0 N-CA-C 109.077 -1.609 . . . . 73.32 109.077 178.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 33.6 tptt -90.54 148.24 22.84 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.499 0.72 . . . . 74.34 111.378 -166.04 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.429 ' HB2' ' HD1' ' A' ' 26' ' ' TYR . 34.8 ttpt -127.27 107.32 9.89 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 109.072 -0.714 . . . . 72.12 109.072 174.795 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.1 p -100.69 143.97 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 N-CA-C 108.993 -0.743 . . . . 65.21 108.993 173.363 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -113.63 115.09 27.35 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 109.332 -0.618 . . . . 75.4 109.332 177.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 73.1 t -105.59 115.71 47.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 124.944 1.298 . . . . 73.32 110.062 -168.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.415 ' O ' ' HA ' ' A' ' 60' ' ' ILE . 38.7 mt-30 -97.08 99.59 11.09 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 108.576 -0.898 . . . . 73.42 108.576 -177.043 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.427 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 67.1 t -95.48 109.08 21.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 N-CA-C 109.092 -0.707 . . . . 63.05 109.092 -177.594 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.508 ' HE2' ' HB2' ' A' ' 59' ' ' SER . 35.6 ttpt -110.15 105.28 14.3 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 108.436 -0.95 . . . . 74.14 108.436 177.732 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 10.9 tt -118.15 123.71 72.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 122.983 0.513 . . . . 72.45 111.015 -174.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 41.8 m -95.99 110.82 22.98 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 123.259 0.624 . . . . 75.01 109.425 176.216 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.625 ' SG ' HG22 ' A' ' 48' ' ' ILE . 8.9 t -145.78 132.63 20.1 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.504 1.122 . . . . 75.41 110.185 179.655 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 62.78 35.22 13.96 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 124.479 1.111 . . . . 73.54 110.499 174.024 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.88 12.12 78.6 Favored Glycine 0 C--N 1.351 1.37 0 CA-C-N 115.255 -0.884 . . . . 72.52 114.234 177.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.481 ' HE2' ' HA ' ' A' ' 17' ' ' LYS . 8.0 mmpt? -125.23 142.23 51.62 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.567 0.747 . . . . 64.11 109.847 175.096 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 88.3 m -110.89 118.53 36.37 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 109.007 -0.738 . . . . 72.12 109.007 178.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.409 ' HB3' ' NH1' ' A' ' 44' ' ' ARG . 13.5 m-85 -108.06 109.76 21.28 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.525 1.13 . . . . 73.42 108.026 -172.681 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.477 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 1.7 pp20? -127.52 142.02 51.5 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 122.455 0.302 . . . . 72.35 111.46 -178.8 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 58.2 ttt180 -168.32 143.17 3.48 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.868 0.867 . . . . 75.45 109.553 178.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 23.9 m -89.79 118.16 29.18 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.347 1.059 . . . . 74.14 109.391 173.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -101.87 135.49 43.33 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.813 0.845 . . . . 65.21 109.729 -179.043 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -91.68 107.63 19.35 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 107.514 -1.291 . . . . 74.33 107.514 179.233 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.487 HD23 HG22 ' A' ' 40' ' ' VAL . 70.6 mt -111.14 99.4 8.25 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 109.076 -0.713 . . . . 73.34 109.076 -178.789 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.429 ' HD1' ' HB2' ' A' ' 5' ' ' LYS . 52.7 t80 -93.28 144.3 25.44 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.652 0.781 . . . . 75.52 109.571 177.343 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.548 ' HB2' ' HB2' ' A' ' 32' ' ' GLU . . . -158.26 160.62 37.28 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.186 0.995 . . . . 70.31 109.316 -179.012 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 56.4 t -75.85 -65.78 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 N-CA-C 108.308 -0.997 . . . . 75.22 108.308 170.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.519 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 97.8 mtt180 -96.03 162.18 13.66 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-O 121.064 0.459 . . . . 74.21 110.556 175.258 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 18.6 p-10 -69.96 -26.74 64.25 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.114 0.966 . . . . 60.04 111.222 174.229 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -69.1 -25.22 64.3 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 122.915 0.486 . . . . 72.33 111.438 175.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.548 ' HB2' ' HB2' ' A' ' 27' ' ' ALA . 11.5 mm-40 -70.77 -30.84 67.43 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.226 0.611 . . . . 75.54 109.997 177.319 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.455 HD23 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -66.19 -23.84 66.52 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 124.388 1.075 . . . . 75.3 110.97 -178.887 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.62 ' HZ3' ' HB3' ' A' ' 34' ' ' LYS . 8.5 mtpm? -54.95 -58.66 6.7 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.661 0.784 . . . . 75.33 111.906 -178.796 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.8 pp20? -65.69 -25.94 67.55 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 122.52 0.328 . . . . 71.53 111.783 -178.122 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.455 ' HD2' HD23 ' A' ' 33' ' ' LEU . 59.5 mttm -69.42 -41.91 75.73 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.331 0.652 . . . . 75.51 110.637 177.175 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.507 HD11 HD21 ' A' ' 81' ' ' LEU . 84.8 mt -61.79 -44.07 97.6 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 123.909 0.755 . . . . 74.12 110.578 173.443 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -56.79 -42.14 78.95 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 122.931 0.493 . . . . 75.01 110.822 176.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -62.78 -61.78 2.17 Favored 'General case' 0 C--O 1.218 -0.593 0 O-C-N 123.98 0.8 . . . . 74.22 110.743 177.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.487 HG22 HD23 ' A' ' 25' ' ' LEU . 99.1 t -60.04 -37.84 74.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 123.363 0.665 . . . . 74.43 111.763 -173.416 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 48.9 mt -71.63 -47.71 52.7 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.326 0.65 . . . . 73.55 111.362 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -70.01 -32.24 70.31 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 122.906 0.482 . . . . 74.34 110.923 -177.18 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -82.38 -34.58 28.32 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.112 0.965 . . . . 75.32 110.686 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.409 ' NH1' ' HB3' ' A' ' 19' ' ' TYR . 5.4 tpm_? -60.09 -44.52 94.75 Favored 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 108.956 -0.757 . . . . 72.33 108.956 169.276 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.512 ' HA ' ' HB ' ' A' ' 48' ' ' ILE . 68.7 mtp -88.67 1.04 55.8 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-N 114.465 -1.243 . . . . 75.34 112.531 -178.469 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -65.54 -50.5 56.51 Favored Pre-proline 0 N--CA 1.483 1.199 0 CA-C-N 119.191 0.905 . . . . 72.35 111.15 178.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.516 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 57.5 Cg_endo -68.28 -23.15 39.02 Favored 'Trans proline' 0 C--N 1.388 2.613 0 C-N-CA 121.634 1.556 . . . . 72.32 111.707 172.198 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.625 HG22 ' SG ' ' A' ' 14' ' ' CYS . 47.5 mm -75.5 -34.92 30.87 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.034 0 C-N-CA 124.379 1.072 . . . . 73.4 110.509 -177.03 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.454 ' HG3' ' O ' ' A' ' 45' ' ' MET . 35.7 mtmm -82.8 -12.17 57.69 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.494 0.717 . . . . 73.23 109.951 177.59 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -80.57 -33.06 36.41 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.24 1.016 . . . . 73.35 109.586 164.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 95.7 mt -73.26 -28.45 62.14 Favored 'General case' 0 N--CA 1.484 1.245 0 N-CA-C 109.759 -0.46 . . . . 74.44 109.759 178.566 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 67.65 32.58 78.67 Favored Glycine 0 C--N 1.354 1.529 0 CA-C-N 115.645 -0.707 . . . . 75.44 113.514 173.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 1.6 p -67.8 110.32 3.75 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 109.471 -0.566 . . . . 74.31 109.471 176.137 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.679 ' HE2' ' HG3' ' A' ' 109' ' ' GLU . 6.9 mtpm? -62.38 -20.42 64.4 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.527 1.131 . . . . 75.45 112.788 -171.758 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 43.4 ttp180 -136.4 131.08 33.7 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 108.585 -0.894 . . . . 74.42 108.585 173.033 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 35.6 m -124.49 136.88 59.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 109.11 -0.7 . . . . 71.41 109.11 173.222 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 54.9 ttt180 -106.69 105.38 15.38 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 108.184 -1.043 . . . . 73.44 108.184 177.057 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 32.8 mt -107.43 104.15 16.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 123.259 0.623 . . . . 71.34 109.435 -175.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.508 ' HB2' ' HE2' ' A' ' 11' ' ' LYS . 20.3 m -97.78 104.6 16.64 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 108.347 -0.983 . . . . 64.22 108.347 175.545 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.478 ' HB ' HG11 ' A' ' 102' ' ' VAL . 85.8 mt -97.71 110.24 25.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 123.831 0.852 . . . . 64.5 109.719 -179.782 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 27.7 mtm105 -98.38 107.72 20.25 Favored 'General case' 0 C--O 1.237 0.442 0 N-CA-C 107.05 -1.463 . . . . 74.13 107.05 175.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.1 p -94.61 137.18 23.76 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 N-CA-C 109.125 -0.695 . . . . 72.13 109.125 -171.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -82.37 118.74 23.4 Favored 'General case' 0 C--N 1.35 0.624 0 N-CA-C 109.527 -0.546 . . . . 74.31 109.527 -176.216 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 50.9 m80 -83.74 150.49 25.78 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 124.634 1.174 . . . . 73.45 108.922 177.497 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 29.7 t -65.68 -52.66 49.79 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 123.525 0.516 . . . . 74.32 112.05 -172.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.507 ' H ' ' HB2' ' A' ' 69' ' ' GLU . 15.2 m-20 -140.84 -175.9 4.47 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 124.242 1.017 . . . . 74.21 108.949 -174.11 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.8 -54.13 15.03 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.646 0.778 . . . . 73.32 111.687 -178.044 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.21 -23.36 62.0 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 122.926 0.49 . . . . 73.34 110.406 175.086 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.507 ' HB2' ' H ' ' A' ' 66' ' ' ASP . 24.9 mm-40 -76.56 -11.02 59.8 Favored 'General case' 0 C--O 1.211 -0.922 0 CA-C-O 118.755 -0.641 . . . . 73.45 112.51 174.49 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -57.17 -51.63 68.54 Favored 'General case' 0 N--CA 1.488 1.46 0 CA-C-N 119.241 0.928 . . . . 74.3 110.971 173.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -71.89 -30.74 65.71 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.087 0.555 . . . . 75.02 111.244 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 4.5 tppp? -67.32 -60.61 2.45 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.324 0.65 . . . . 71.33 109.581 178.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -67.0 -15.2 63.58 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.573 1.149 . . . . 74.34 112.164 178.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.36 -62.45 1.67 Allowed 'General case' 0 C--N 1.351 0.671 0 CA-C-N 118.882 0.764 . . . . 74.02 109.856 172.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -69.04 -40.11 78.78 Favored 'General case' 0 CA--C 1.55 0.963 0 O-C-N 124.171 0.919 . . . . 74.34 111.68 -179.318 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 48.3 tttm -67.29 -50.8 58.88 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.907 0.883 . . . . 73.44 111.95 -176.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -75.45 -20.27 58.94 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 110.127 -0.323 . . . . 74.35 110.127 177.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.92 -37.93 74.98 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 122.588 0.355 . . . . 63.35 111.168 171.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.479 ' O ' ' HG2' ' A' ' 83' ' ' LYS . . . -63.77 -45.87 87.84 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.227 0.611 . . . . 71.22 110.665 175.762 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.421 ' O ' HG22 ' A' ' 84' ' ' VAL . 49.4 mm -61.35 -45.61 98.26 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 C-N-CA 123.914 0.885 . . . . 73.53 110.325 -178.748 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.541 HD11 HG13 ' A' ' 102' ' ' VAL . 35.8 mt -69.58 -41.82 75.32 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.66 0.784 . . . . 75.25 111.39 178.881 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -56.31 -43.22 78.74 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 124.331 1.052 . . . . 61.41 110.624 -176.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.479 ' HG2' ' O ' ' A' ' 79' ' ' ALA . 33.6 mmtp -68.14 -42.23 80.47 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 114.67 -1.15 . . . . 73.31 110.758 179.734 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.421 HG22 ' O ' ' A' ' 80' ' ' ILE . 51.1 t -64.34 -47.95 87.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 C-N-CA 123.544 0.738 . . . . 73.53 110.468 -176.097 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.542 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 25.6 m-85 -61.13 -41.36 96.58 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.28 -0.873 . . . . 74.04 110.437 177.224 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.66 -25.39 66.54 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.494 0.718 . . . . 71.4 111.825 176.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -86.11 -9.69 56.22 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 124.018 0.927 . . . . 75.35 111.2 176.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 94.5 mt -106.1 -25.17 12.15 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.221 0.608 . . . . 74.42 111.023 -178.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 116.34 17.09 6.29 Favored Glycine 0 N--CA 1.475 1.29 0 C-N-CA 122.945 0.307 . . . . 71.31 113.696 177.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.542 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 10.3 m-85 -104.14 125.72 50.68 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 107.986 -1.116 . . . . 74.21 107.986 173.159 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -123.71 97.89 5.58 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 122.929 0.491 . . . . 75.12 110.833 -170.308 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 64.19 -72.09 0.06 Allowed 'General case' 0 N--CA 1.494 1.765 0 C-N-CA 125.254 1.422 . . . . 55.33 114.176 164.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 14.6 m -57.08 -30.45 64.32 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 125.068 1.347 . . . . 73.31 112.502 -178.051 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . 0.413 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 10.7 m120 -66.1 -39.73 90.2 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.483 0.713 . . . . 75.22 111.008 176.476 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.42 ' HA ' HG23 ' A' ' 104' ' ' VAL . 47.6 t -93.02 106.99 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 124.999 1.32 . . . . 75.24 110.276 -167.619 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 44.5 m -123.93 126.66 46.73 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 122.996 0.518 . . . . 75.44 110.22 178.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 55.1 m95 -89.84 147.16 23.94 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 122.968 0.507 . . . . 74.42 110.491 174.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -156.86 98.15 1.75 Allowed 'General case' 0 CA--C 1.554 1.109 0 C-N-CA 124.658 1.183 . . . . 65.03 109.166 -177.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 77.54 -99.78 1.5 Allowed Glycine 0 C--N 1.35 1.324 0 CA-C-N 115.36 -0.836 . . . . 64.15 112.979 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -110.86 -7.3 14.6 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 124.409 1.084 . . . . 71.31 110.153 177.052 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 22.0 m -103.45 153.68 20.25 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.188 1.395 . . . . 74.42 110.659 -168.417 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.541 HG13 HD11 ' A' ' 81' ' ' LEU . 2.7 p -128.9 104.62 11.63 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.877 0 C-N-CA 124.323 1.049 . . . . 75.52 108.627 167.238 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.414 HG22 ' HG ' ' A' ' 59' ' ' SER . 24.3 m -91.97 104.92 17.28 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.646 0.778 . . . . 73.34 108.937 -178.897 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.42 HG23 ' HA ' ' A' ' 95' ' ' VAL . 53.1 t -102.01 121.99 53.68 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 C-N-CA 124.825 1.25 . . . . 74.44 109.485 179.573 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -89.03 126.27 35.36 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 108.77 -0.826 . . . . 63.52 108.77 172.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -106.27 154.83 16.81 Favored Glycine 0 N--CA 1.468 0.789 0 N-CA-C 111.131 -0.788 . . . . 75.53 111.131 173.612 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -136.28 120.38 17.71 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.431 0.692 . . . . 75.42 109.584 178.262 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.461 ' O ' ' HA ' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -157.19 132.87 9.31 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.459 0.704 . . . . 72.32 109.647 172.404 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.679 ' HG3' ' HE2' ' A' ' 54' ' ' LYS . 2.3 mp0 -74.95 -47.48 29.34 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.777 0.831 . . . . 73.02 108.907 176.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 172.73 90.52 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.55 0 CA-C-N 114.316 -1.311 . . . . 62.23 110.07 178.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 30.8 m -66.31 156.76 6.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 122.977 0.511 . . . . 75.05 110.789 -178.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -75.51 91.45 2.8 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 115.935 -0.575 . . . . 75.21 109.978 -178.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 67.5 mt -71.2 92.99 1.04 Allowed 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 107.932 -1.136 . . . . 75.34 107.932 171.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.09 -60.59 3.51 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.772 1.229 . . . . 74.43 112.119 -173.425 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 66.7 m80 -161.39 143.2 11.75 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.032 1.333 . . . . 73.42 107.978 -174.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 42.5 m80 -95.39 143.35 26.82 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 108.561 -0.903 . . . . 75.52 108.561 172.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 62.9 t60 -127.42 153.72 45.92 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.201 0.601 . . . . 73.23 109.891 -175.067 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 45.8 m170 -56.45 107.39 0.37 Allowed 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.947 0.899 . . . . 75.05 110.155 175.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 28.4 p-80 -65.57 141.25 58.5 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 123.828 0.705 . . . . 72.4 110.136 -179.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 21.9 m80 . . . . . 0 CA--C 1.549 0.937 0 N-CA-C 108.668 -0.864 . . . . 73.23 108.668 178.338 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.877 0 N-CA-C 107.842 -1.17 . . . . 74.35 107.842 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.2 t -85.96 -9.11 57.43 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.934 0.894 . . . . 54.22 112.089 -174.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -76.83 74.91 1.75 Allowed Glycine 0 C--N 1.348 1.218 0 O-C-N 123.288 0.368 . . . . 73.11 113.435 -177.259 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.06 173.73 6.2 Favored 'General case' 0 C--O 1.243 0.737 0 C-N-CA 123.925 0.89 . . . . 71.42 108.698 171.428 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.409 ' HD2' ' HB3' ' A' ' 24' ' ' GLN . 38.4 ttpt -89.78 111.88 23.02 Favored 'General case' 0 C--O 1.241 0.655 0 N-CA-C 109.406 -0.59 . . . . 75.14 109.406 179.321 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.668 HG21 HG11 ' A' ' 62' ' ' VAL . 3.9 p -98.34 142.87 13.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 N-CA-C 107.927 -1.138 . . . . 74.21 107.927 174.149 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.418 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 44.6 mt-10 -105.52 109.95 22.1 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 107.427 -1.323 . . . . 73.14 107.427 176.265 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 73.2 t -99.16 113.26 33.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 114.355 -1.293 . . . . 75.0 108.705 -173.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.455 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 46.8 mt-30 -104.35 99.92 9.63 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 108.57 -0.9 . . . . 64.51 108.57 -176.159 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.426 HG22 HG12 ' A' ' 60' ' ' ILE . 74.9 t -95.18 108.48 20.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 N-CA-C 108.591 -0.892 . . . . 75.13 108.591 -178.227 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.414 ' HE2' ' HB2' ' A' ' 59' ' ' SER . 36.2 ttpt -109.9 107.27 17.15 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.278 -0.874 . . . . 75.31 108.984 -174.17 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.438 HD12 HG13 ' A' ' 48' ' ' ILE . 14.8 tt -123.55 116.52 48.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 123.086 0.554 . . . . 75.01 110.126 -177.136 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 93.1 m -94.15 124.28 38.07 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 109.568 -0.53 . . . . 72.0 109.568 178.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.415 ' SG ' HG23 ' A' ' 48' ' ' ILE . 47.6 t -150.6 151.56 32.75 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.626 1.17 . . . . 65.31 109.138 -178.171 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 36.1 t30 69.97 -78.23 0.05 OUTLIER 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 124.89 1.276 . . . . 74.55 109.798 -176.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -165.19 11.69 0.08 OUTLIER Glycine 0 N--CA 1.462 0.431 0 CA-C-N 115.487 -0.779 . . . . 63.21 111.293 174.176 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -123.19 156.79 34.39 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.231 1.012 . . . . 74.2 110.45 -173.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 93.6 m -103.22 111.9 24.5 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.318 1.047 . . . . 63.01 109.023 175.101 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 52.8 m-85 -100.46 101.14 12.01 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 108.078 -1.082 . . . . 75.53 108.078 -177.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -134.32 156.16 48.96 Favored 'General case' 0 C--O 1.239 0.519 0 C-N-CA 123.276 0.63 . . . . 74.31 110.695 -177.267 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.3 ttm180 -159.76 146.8 16.53 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.401 -0.818 . . . . 73.5 108.866 175.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 31.8 m -89.09 105.75 17.99 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 108.265 -1.013 . . . . 72.51 108.265 171.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 81.9 m-85 -95.9 119.77 34.97 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.8 0.84 . . . . 74.11 108.859 -177.003 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.418 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 26.6 mp0 -88.2 108.08 19.11 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 107.987 -1.116 . . . . 75.1 107.987 -179.676 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.432 HD21 ' HB3' ' A' ' 36' ' ' LYS . 78.6 mt -115.17 99.63 7.56 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.745 0.818 . . . . 74.34 109.189 -175.058 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.407 ' O ' ' HE3' ' A' ' 36' ' ' LYS . 87.8 t80 -94.11 133.61 37.42 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 108.932 -0.766 . . . . 75.14 108.932 172.614 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.512 ' HB3' ' HB2' ' A' ' 32' ' ' GLU . . . -130.47 171.81 12.58 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.479 0.711 . . . . 73.44 109.663 175.785 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 26.4 t -95.66 -32.27 4.37 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 N-CA-C 109.319 -0.623 . . . . 75.15 109.319 172.477 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.488 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 35.1 mtt180 -132.39 169.57 16.34 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.903 0.881 . . . . 74.34 109.465 179.369 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -66.59 -41.3 88.7 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.871 0.868 . . . . 74.34 110.976 175.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -65.49 -22.01 66.69 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.514 1.126 . . . . 75.51 111.885 -178.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.512 ' HB2' ' HB3' ' A' ' 27' ' ' ALA . 28.5 mm-40 -78.8 -26.5 44.33 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.377 0.671 . . . . 63.24 111.039 -179.543 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.503 HD21 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -71.4 -23.43 61.87 Favored 'General case' 0 CA--C 1.557 1.24 0 C-N-CA 123.821 0.848 . . . . 72.23 110.434 -176.344 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.506 ' HG2' HG21 ' A' ' 80' ' ' ILE . 7.8 mtmp? -57.42 -54.19 49.68 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.303 0.641 . . . . 73.35 111.713 -175.782 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.56 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 1.9 pp20? -60.6 -31.52 70.68 Favored 'General case' 0 C--N 1.354 0.8 0 CA-C-N 115.814 -0.63 . . . . 74.13 111.115 -176.766 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.503 ' HD2' HD21 ' A' ' 33' ' ' LEU . 58.4 mttm -67.31 -43.58 81.29 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.797 0.839 . . . . 74.15 110.417 178.87 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.422 HD13 HD22 ' A' ' 81' ' ' LEU . 75.5 mt -61.05 -39.43 89.8 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.902 0.881 . . . . 74.33 110.687 175.625 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.41 ' HD3' ' HA ' ' A' ' 35' ' ' GLU . 57.3 mtpt -63.87 -42.61 97.47 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.466 0.707 . . . . 74.22 111.042 175.794 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.56 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 31.7 mmtp -61.03 -48.12 83.26 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 109.698 -0.482 . . . . 74.33 109.698 177.492 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 52.9 t -57.13 -50.4 76.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 124.847 1.259 . . . . 63.35 112.032 178.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 70.3 mt -70.75 -49.24 48.93 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.256 0.622 . . . . 75.34 111.12 -173.383 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -60.92 -39.05 87.94 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 122.887 0.475 . . . . 74.13 111.162 177.221 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -63.54 -55.01 27.28 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.662 0.785 . . . . 75.13 110.951 179.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.4 tpm_? -71.0 -33.19 70.15 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 115.573 -0.74 . . . . 72.52 110.92 -173.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 59.6 mtp -89.02 -6.65 57.02 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 112.773 0.657 . . . . 71.32 112.773 -178.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -61.61 -50.31 82.89 Favored Pre-proline 0 CA--C 1.569 1.683 0 CA-C-O 118.739 -0.648 . . . . 74.42 111.855 178.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -71.95 -21.32 24.55 Favored 'Trans proline' 0 C--N 1.391 2.767 0 C-N-CA 121.87 1.713 . . . . 73.33 112.631 174.245 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.438 HG13 HD12 ' A' ' 12' ' ' ILE . 49.3 mm -68.99 -31.46 50.54 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.262 0 C-N-CA 123.549 0.74 . . . . 70.54 109.91 -178.278 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 60.1 mttm -63.32 -39.93 95.91 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.243 -0.889 . . . . 75.24 110.412 174.131 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.48 -28.99 62.23 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 123.429 0.691 . . . . 75.43 109.798 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 94.6 mt -69.85 -33.13 71.86 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 109.703 -0.481 . . . . 72.34 109.703 176.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 69.94 47.98 43.55 Favored Glycine 0 C--N 1.344 0.999 0 CA-C-N 115.097 -0.956 . . . . 64.21 113.246 173.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 99.3 m -75.98 120.98 22.05 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 109.9 -0.408 . . . . 72.04 109.9 174.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 6.6 ptpp? -60.07 -23.19 63.57 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.435 1.094 . . . . 65.51 112.082 177.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 14.3 ttp180 -159.66 139.54 11.61 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.778 0.831 . . . . 72.43 109.182 175.048 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 17.3 m -129.32 150.57 34.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 124.229 1.012 . . . . 64.15 109.944 177.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 26.6 ttt180 -101.84 115.48 30.63 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 108.353 -0.98 . . . . 73.33 108.353 170.209 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 21.1 mt -108.58 102.31 13.8 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 N-CA-C 108.424 -0.954 . . . . 75.13 108.424 177.431 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.414 ' HB2' ' HE2' ' A' ' 11' ' ' LYS . 57.2 m -102.67 104.97 15.35 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 108.551 -0.907 . . . . 73.22 108.551 178.559 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.448 ' HB ' HG13 ' A' ' 102' ' ' VAL . 63.3 mt -99.13 111.66 29.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 124.227 1.011 . . . . 74.11 109.537 -176.085 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.455 ' HB2' ' HB2' ' A' ' 9' ' ' GLN . 2.6 mpt_? -90.88 133.8 34.95 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 108.481 -0.933 . . . . 75.41 108.481 177.044 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.668 HG11 HG21 ' A' ' 6' ' ' VAL . 39.0 t -107.32 110.78 33.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 N-CA-C 107.581 -1.266 . . . . 75.33 107.581 173.048 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.12 101.96 9.96 Favored 'General case' 0 C--N 1.353 0.751 0 N-CA-C 107.095 -1.446 . . . . 72.32 107.095 -176.018 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . 0.46 ' HD2' HG12 ' A' ' 62' ' ' VAL . 65.0 m170 -68.13 108.73 3.23 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 114.796 -1.093 . . . . 72.25 110.369 -175.204 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 47.8 t -60.22 -58.34 8.92 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 124.147 0.905 . . . . 74.33 111.379 -173.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -106.93 143.17 35.41 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.513 0.725 . . . . 75.41 110.718 -176.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.436 ' O ' ' HG2' ' A' ' 70' ' ' GLU . . . -72.59 -46.41 54.37 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.833 0.853 . . . . 73.13 111.563 -175.898 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -67.81 -31.75 71.83 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.02 0.528 . . . . 75.42 112.004 -179.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -80.51 -32.78 36.84 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 112.47 0.544 . . . . 74.13 112.47 -174.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.568 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 12.8 pt-20 -66.31 -17.63 64.87 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 114.556 1.317 . . . . 62.42 114.556 -165.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -70.59 -44.46 67.3 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 108.899 -0.778 . . . . 74.12 108.899 176.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 16.6 tppt? -71.5 -44.33 64.9 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 114.945 -1.025 . . . . 74.13 110.277 174.598 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.568 ' HB3' ' HA ' ' A' ' 70' ' ' GLU . 0.3 OUTLIER -63.84 -52.49 59.88 Favored 'General case' 0 C--O 1.209 -1.076 0 CA-C-N 114.603 -1.181 . . . . 73.11 110.982 -170.365 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.78 -49.58 74.87 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.526 0.73 . . . . 65.25 112.186 -175.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -56.36 -47.39 78.95 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 114.945 -1.025 . . . . 75.13 111.678 177.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -78.85 -22.53 45.96 Favored 'General case' 0 CA--C 1.556 1.207 0 C-N-CA 123.355 0.662 . . . . 64.51 111.317 -177.095 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -81.79 -21.76 37.53 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.939 0.896 . . . . 72.53 109.204 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -59.73 -36.17 76.05 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.087 0.555 . . . . 73.2 110.006 169.416 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -74.7 -37.02 62.73 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.895 0.878 . . . . 71.42 111.324 176.169 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.506 HG21 ' HG2' ' A' ' 34' ' ' LYS . 31.8 mm -62.42 -43.73 98.53 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 C-N-CA 123.853 0.861 . . . . 73.53 110.456 175.814 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.541 HD13 HG12 ' A' ' 102' ' ' VAL . 47.5 mt -67.34 -39.33 85.76 Favored 'General case' 0 C--O 1.22 -0.486 0 C-N-CA 124.243 1.017 . . . . 75.24 110.289 176.649 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -62.89 -34.9 78.38 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.725 0.81 . . . . 74.15 110.996 179.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 41.6 mmtm -61.56 -51.29 69.19 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 123.511 0.507 . . . . 74.22 110.306 172.007 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.461 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 73.9 t -61.31 -46.9 95.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 124.174 0.99 . . . . 71.22 110.73 -173.789 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.51 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 21.1 m-85 -61.5 -35.46 77.74 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 115.267 -0.879 . . . . 75.32 110.54 179.581 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -76.02 -29.53 58.14 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.999 0.519 . . . . 73.13 111.366 176.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -78.58 -13.7 59.69 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 122.997 0.519 . . . . 72.22 110.249 178.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 57.7 mt -108.86 -25.14 10.93 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.791 0.836 . . . . 74.02 110.725 178.22 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 119.77 -17.63 10.08 Favored Glycine 0 C--N 1.349 1.278 0 N-CA-C 115.207 0.843 . . . . 54.42 115.207 176.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.51 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 36.9 m-85 -59.83 135.76 57.79 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.619 0.768 . . . . 74.1 111.476 -177.241 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -99.05 167.75 10.52 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.965 0.906 . . . . 64.5 111.799 -172.181 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -56.66 -39.43 73.72 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 125.106 1.363 . . . . 73.51 112.516 -179.408 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 51.2 p -59.5 -29.03 67.57 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.299 1.039 . . . . 64.35 111.873 179.135 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -84.16 -26.55 28.74 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.706 0.802 . . . . 72.22 111.72 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 44.7 t -83.52 104.96 12.67 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 N-CA-C 109.364 -0.606 . . . . 74.25 109.364 -175.467 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 97.2 m -133.02 112.88 12.19 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.442 0.697 . . . . 65.13 110.248 178.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 59.8 m95 -76.32 112.3 12.67 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 123.198 0.599 . . . . 74.1 110.481 178.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.509 ' HB3' ' HG1' ' A' ' 103' ' ' THR . 15.5 t70 -121.6 106.08 11.03 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.753 1.221 . . . . 64.21 109.303 179.608 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 72.86 54.75 6.95 Favored Glycine 0 C--N 1.35 1.342 0 O-C-N 123.518 0.511 . . . . 51.24 113.99 172.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 60.03 22.77 11.93 Favored 'General case' 0 N--CA 1.503 2.179 0 C-N-CA 124.755 1.222 . . . . 64.3 111.757 -179.383 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 40.4 m -138.96 141.71 38.41 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.073 1.349 . . . . 74.23 107.685 -171.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.541 HG12 HD13 ' A' ' 81' ' ' LEU . 5.1 p -94.99 107.65 19.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 N-CA-C 108.878 -0.786 . . . . 75.43 108.878 179.271 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.509 ' HG1' ' HB3' ' A' ' 98' ' ' ASP . 89.0 m -98.55 107.72 20.24 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.766 0.826 . . . . 72.54 109.145 -178.752 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 45.2 t -94.73 131.87 40.35 Favored 'Isoleucine or valine' 0 C--O 1.243 0.733 0 C-N-CA 124.818 1.247 . . . . 74.05 109.631 -178.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -85.13 112.92 21.12 Favored 'General case' 0 C--O 1.24 0.556 0 N-CA-C 107.647 -1.242 . . . . 75.45 107.647 170.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -110.29 137.08 14.04 Favored Glycine 0 N--CA 1.465 0.617 0 CA-C-N 117.8 0.273 . . . . 63.45 112.889 -177.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -133.85 104.11 6.15 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 106.126 -1.805 . . . . 70.32 106.126 164.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.428 HD12 ' H ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -80.49 163.16 23.97 Favored 'General case' 0 C--O 1.244 0.8 0 C-N-CA 123.581 0.752 . . . . 74.3 111.303 -171.844 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -81.29 -166.36 1.14 Allowed 'General case' 0 CA--C 1.552 1.055 0 CA-C-N 115.156 -0.929 . . . . 64.44 110.283 174.353 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 95.1 -78.77 0.86 Allowed Glycine 0 C--N 1.345 1.069 0 N-CA-C 110.857 -0.897 . . . . 72.14 110.857 178.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 82.8 t -66.26 -38.29 81.56 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 C-N-CA 123.658 0.783 . . . . 64.44 110.589 179.559 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 29.9 t0 -126.12 78.65 1.78 Allowed 'General case' 0 C--O 1.24 0.569 0 CA-C-N 115.353 -0.839 . . . . 75.11 108.995 -175.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 93.8 mt -75.48 131.95 40.46 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.208 -0.906 . . . . 74.14 110.715 178.365 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.455 ' HB3' ' HD2' ' A' ' 117' ' ' HIS . 44.1 mt-10 64.25 39.11 7.61 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.881 1.273 . . . . 72.53 112.788 172.42 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -73.49 -46.93 45.03 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 105.955 -1.869 . . . . 73.24 105.955 157.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 51.2 t-80 -78.15 86.79 4.28 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 105.885 -1.894 . . . . 65.44 105.885 159.017 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.455 ' HD2' ' HB3' ' A' ' 114' ' ' GLU . 9.2 t-80 -78.92 13.9 1.57 Allowed 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 124.513 1.125 . . . . 74.34 113.285 -162.452 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 40.6 m80 -140.87 177.9 7.72 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.138 0.975 . . . . 73.13 109.545 171.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 15.1 m-70 -83.53 166.57 18.15 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.523 0.729 . . . . 75.1 110.04 -178.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 77.7 t60 . . . . . 0 CA--C 1.555 1.137 0 N-CA-C 109.147 -0.686 . . . . 73.22 109.147 174.105 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.4 ttm . . . . . 0 N--CA 1.476 0.829 0 CA-C-O 121.657 0.742 . . . . 74.13 109.312 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 27.7 t -82.38 105.26 13.31 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 107.306 -1.368 . . . . 73.54 107.306 173.312 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -178.42 90.57 0.08 OUTLIER Glycine 0 C--N 1.334 0.444 0 N-CA-C 110.168 -1.173 . . . . 41.33 110.168 -175.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? -97.54 143.13 28.54 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.401 0.681 . . . . 74.3 109.707 -178.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.483 ' HA ' ' HA ' ' A' ' 26' ' ' TYR . 23.7 ttpp -83.81 115.04 22.05 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.18 -1.044 . . . . 75.32 108.18 165.637 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -101.53 152.56 5.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 N-CA-C 106.341 -1.725 . . . . 64.45 106.341 170.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.407 ' H ' ' HB2' ' A' ' 63' ' ' LYS . 42.6 mt-10 -120.0 114.55 22.2 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.676 0.75 . . . . 73.12 109.607 175.59 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.411 HG22 HD12 ' A' ' 25' ' ' LEU . 62.3 t -96.36 113.39 30.61 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 125.105 1.362 . . . . 61.42 109.165 -174.434 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 91.9 mt-30 -96.94 103.03 14.92 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 108.231 -1.026 . . . . 74.23 108.231 -178.125 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 79.9 t -95.98 110.01 23.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 N-CA-C 109.028 -0.73 . . . . 74.1 109.028 -177.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.405 ' HG3' ' HB3' ' A' ' 20' ' ' GLU . 39.5 ttmt -113.21 102.79 10.7 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.905 0.882 . . . . 73.43 108.754 -178.339 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 10.3 tt -118.07 118.07 56.94 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 C-N-CA 123.098 0.559 . . . . 70.13 110.302 -176.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 60.1 m -90.62 110.49 21.64 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 109.079 -0.711 . . . . 72.42 109.079 175.663 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.591 ' SG ' HG21 ' A' ' 48' ' ' ILE . 42.4 t -112.67 124.47 52.63 Favored 'General case' 0 C--O 1.244 0.796 0 N-CA-C 107.631 -1.248 . . . . 70.33 107.631 179.353 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.517 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 43.8 t30 70.19 -80.45 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.021 1.328 . . . . 74.52 109.51 -176.314 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -158.98 18.47 0.27 Allowed Glycine 0 N--CA 1.464 0.536 0 N-CA-C 111.166 -0.774 . . . . 70.22 111.166 176.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.46 ' HE2' ' HA ' ' A' ' 17' ' ' LYS . 11.1 mmpt? -117.46 126.23 52.27 Favored 'General case' 0 C--N 1.348 0.529 0 C-N-CA 124.344 1.058 . . . . 75.32 108.77 -179.562 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 38.2 m -94.68 122.09 36.92 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.646 0.778 . . . . 72.25 109.532 -176.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.665 ' HB3' HH21 ' A' ' 44' ' ' ARG . 67.3 m-85 -113.71 101.21 9.1 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.807 0.843 . . . . 74.53 109.639 -175.172 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.405 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 12.8 pt-20 -118.82 149.24 41.85 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.408 0.683 . . . . 74.33 110.528 -178.476 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 39.8 ttp180 -166.22 137.08 3.52 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.622 0.769 . . . . 75.32 109.904 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 39.4 m -86.24 109.36 18.88 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 109.009 -0.737 . . . . 73.4 109.009 175.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 28.3 m-85 -96.7 134.33 40.1 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 107.985 -1.117 . . . . 72.54 107.985 177.338 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -92.58 108.52 20.04 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 107.661 -1.237 . . . . 63.23 107.661 177.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.421 HD13 HG23 ' A' ' 40' ' ' VAL . 69.7 mt -111.62 96.81 6.31 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 109.187 -0.672 . . . . 74.1 109.187 177.281 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.483 ' HA ' ' HA ' ' A' ' 5' ' ' LYS . 44.6 t80 -93.41 133.92 36.19 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.259 1.024 . . . . 61.04 109.19 173.536 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.547 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -151.67 144.79 24.61 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 122.453 0.301 . . . . 51.44 111.217 179.387 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 94.3 t -65.12 -45.98 92.52 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 O-C-N 124.578 1.174 . . . . 72.21 109.586 173.29 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.561 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 58.4 mtt85 -124.05 155.96 37.38 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.42 0.688 . . . . 74.52 110.118 -179.186 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -65.37 -27.35 68.51 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.58 0.752 . . . . 74.44 110.37 170.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -53.08 -44.88 67.9 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.419 1.088 . . . . 64.33 110.962 168.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.561 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 13.6 mm-40 -73.1 -23.73 60.56 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 115.527 -0.76 . . . . 75.43 111.143 -177.433 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.418 ' HA ' ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -76.15 -26.83 56.67 Favored 'General case' 0 CA--C 1.559 1.292 0 C-N-CA 123.346 0.658 . . . . 73.12 110.133 -178.28 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.479 ' HG2' HG22 ' A' ' 80' ' ' ILE . 55.7 mtpt -60.64 -47.38 86.49 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 123.386 0.674 . . . . 74.33 112.765 -176.037 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -62.33 -35.39 78.94 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.527 0.731 . . . . 75.12 111.511 175.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.418 ' HD2' ' HA ' ' A' ' 33' ' ' LEU . 66.7 mttm -67.72 -42.82 81.34 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.655 0.782 . . . . 75.42 110.54 -179.069 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.455 HD11 HD22 ' A' ' 81' ' ' LEU . 88.8 mt -59.27 -45.95 89.85 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 124.15 0.906 . . . . 73.21 110.216 176.029 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -54.76 -48.47 72.58 Favored 'General case' 0 N--CA 1.482 1.144 0 O-C-N 123.741 0.651 . . . . 73.0 110.964 174.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.476 ' HB3' ' HZ1' ' A' ' 39' ' ' LYS . 4.5 mmmp? -60.81 -59.51 5.27 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.233 0.613 . . . . 74.51 110.98 -178.23 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.421 HG23 HD13 ' A' ' 25' ' ' LEU . 60.7 t -48.65 -44.49 14.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 C-N-CA 125.196 1.398 . . . . 73.21 111.894 -178.822 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.449 HD22 HD12 ' A' ' 60' ' ' ILE . 58.5 mt -65.88 -51.41 59.0 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.312 -0.858 . . . . 73.44 110.802 177.305 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -68.56 -22.35 64.48 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 113.145 0.794 . . . . 72.55 113.145 -176.438 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.472 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 15.6 mm-40 -74.73 -53.56 8.99 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 108.61 -0.885 . . . . 73.44 108.61 174.453 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.665 HH21 ' HB3' ' A' ' 19' ' ' TYR . 17.7 tpt180 -74.64 -25.86 59.49 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-N 114.888 -1.051 . . . . 74.12 111.695 -171.133 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 55.6 mtp -92.39 -8.39 45.02 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 112.639 0.607 . . . . 54.4 112.639 -179.091 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.554 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 33.9 t70 -59.27 -49.84 90.66 Favored Pre-proline 0 CA--C 1.567 1.609 0 CA-C-O 118.791 -0.623 . . . . 72.41 112.206 177.527 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.425 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 39.5 Cg_endo -65.36 -28.53 54.72 Favored 'Trans proline' 0 C--N 1.39 2.761 0 C-N-CA 121.835 1.69 . . . . 74.44 112.644 173.698 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.591 HG21 ' SG ' ' A' ' 14' ' ' CYS . 50.0 mm -67.91 -36.97 77.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 C-N-CA 124.148 0.979 . . . . 73.3 111.511 -170.749 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.554 ' HE2' ' HA ' ' A' ' 46' ' ' ASP . 44.3 mtmt -66.81 -41.15 88.01 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 115.98 -0.554 . . . . 74.34 109.701 177.167 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -72.52 -24.73 61.19 Favored 'General case' 0 CA--C 1.557 1.233 0 CA-C-N 114.603 -1.18 . . . . 71.01 110.189 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 83.3 mt -75.7 -33.01 60.32 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.265 0.626 . . . . 75.2 110.416 173.654 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 72.59 55.05 6.94 Favored Glycine 0 C--N 1.345 1.073 0 CA-C-N 115.91 -0.586 . . . . 63.12 113.052 178.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.517 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 65.6 m -94.54 113.8 25.68 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 108.525 -0.917 . . . . 61.33 108.525 173.153 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.4 mtpm? -63.73 -78.33 0.05 OUTLIER 'General case' 0 N--CA 1.476 0.851 0 O-C-N 123.601 0.563 . . . . 74.34 110.216 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 15.1 ttm180 -84.3 121.21 27.2 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 109.321 -0.622 . . . . 71.41 109.321 178.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 29.3 m -126.26 138.5 54.43 Favored 'Isoleucine or valine' 0 C--O 1.243 0.738 0 C-N-CA 124.275 1.03 . . . . 73.34 108.589 173.618 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 58.9 ttt180 -103.09 109.43 20.99 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 107.775 -1.195 . . . . 74.31 107.775 169.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 34.0 mt -96.05 102.33 13.4 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 N-CA-C 106.791 -1.559 . . . . 65.34 106.791 173.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.3 m -100.68 102.77 13.96 Favored 'General case' 0 C--O 1.24 0.593 0 N-CA-C 107.597 -1.26 . . . . 75.41 107.597 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.449 HD12 HD22 ' A' ' 41' ' ' LEU . 72.2 mt -102.75 118.62 49.94 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 C-N-CA 123.343 0.657 . . . . 74.44 109.279 -178.136 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 51.9 mtm180 -108.5 118.84 37.83 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 108.55 -0.907 . . . . 74.23 108.55 175.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 7.2 p -92.82 138.25 20.49 Favored 'Isoleucine or valine' 0 C--O 1.242 0.679 0 N-CA-C 108.063 -1.088 . . . . 74.33 108.063 177.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.407 ' HB2' ' H ' ' A' ' 7' ' ' GLU . 10.3 mmpt? -80.12 110.1 15.21 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 107.355 -1.35 . . . . 75.22 107.355 174.134 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 55.6 m80 -75.98 142.65 41.88 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 115.342 -0.844 . . . . 74.11 109.125 -176.192 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.434 ' H ' ' HG2' ' A' ' 73' ' ' GLU . 32.0 m -52.15 -40.46 61.44 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.627 1.171 . . . . 71.41 113.641 -170.627 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -169.28 164.88 10.93 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.155 0.982 . . . . 73.15 108.732 -174.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -74.92 -26.19 59.45 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 112.697 0.629 . . . . 74.44 112.697 -178.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.69 -40.51 25.29 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 109.587 -0.523 . . . . 75.33 109.587 171.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -70.01 -17.58 63.28 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 115.436 -0.802 . . . . 73.14 111.658 175.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -49.72 -44.06 48.12 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 125.472 1.509 . . . . 75.05 112.284 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 24.5 mtpp -61.8 -37.24 83.65 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 114.623 -1.171 . . . . 73.2 111.357 -178.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.482 ' HE3' ' HA ' ' A' ' 72' ' ' LYS . 0.9 OUTLIER -83.65 -39.59 20.06 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 115.474 -0.784 . . . . 71.14 111.206 178.104 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.434 ' HG2' ' H ' ' A' ' 65' ' ' SER . 16.4 tp10 -76.65 -44.4 34.1 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.851 0.861 . . . . 74.44 111.18 -161.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.02 -48.87 74.63 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 123.928 0.767 . . . . 71.11 110.685 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 49.6 tptt -61.44 -43.81 98.21 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.291 1.037 . . . . 71.34 111.584 -179.318 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.9 tmmm? -64.18 -50.86 66.45 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 124.522 1.129 . . . . 72.21 110.137 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -75.21 -24.2 57.71 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 115.445 -0.798 . . . . 74.32 111.023 -171.314 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.72 -42.71 99.79 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.613 0.765 . . . . 74.21 110.769 174.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.28 -37.11 84.68 Favored 'General case' 0 CA--C 1.547 0.865 0 CA-C-N 115.227 -0.897 . . . . 72.21 111.214 177.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.479 HG22 ' HG2' ' A' ' 34' ' ' LYS . 48.2 mm -63.16 -47.12 93.92 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 C-N-CA 124.055 0.942 . . . . 74.54 110.728 177.197 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.665 HD11 HG11 ' A' ' 102' ' ' VAL . 56.1 mt -64.37 -46.2 84.41 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.862 0.865 . . . . 75.5 111.253 -177.178 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -59.59 -32.97 70.88 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.851 0.86 . . . . 75.3 109.907 -174.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -69.15 -48.01 63.46 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.324 0.65 . . . . 73.22 111.222 174.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 77.5 t -64.97 -44.86 96.02 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 C-N-CA 123.03 0.532 . . . . 54.04 111.371 -172.318 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 33.9 m-85 -61.29 -37.32 82.76 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.189 0.596 . . . . 75.43 110.942 175.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.53 -30.64 70.35 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.453 0.701 . . . . 75.53 111.437 175.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -81.18 -2.25 47.88 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.214 1.006 . . . . 75.23 111.138 178.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.7 mt -104.94 -24.56 12.82 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.924 0.89 . . . . 74.23 109.772 173.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 128.15 -17.15 5.98 Favored Glycine 0 C--N 1.346 1.118 0 CA-C-O 119.421 -0.655 . . . . 61.43 113.109 178.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -61.05 138.06 58.21 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-N 117.266 0.533 . . . . 75.54 110.422 178.222 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.436 ' N ' HD21 ' A' ' 91' ' ' ASN . 0.7 OUTLIER -81.01 169.25 17.74 Favored 'General case' 0 C--O 1.243 0.756 0 C-N-CA 123.26 0.624 . . . . 75.13 109.525 176.359 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -61.94 -37.16 83.65 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.009 0.524 . . . . 70.24 111.448 -178.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 40.4 p -63.54 -25.41 68.24 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.367 1.067 . . . . 73.31 113.083 179.203 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . 0.437 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 12.7 m120 -63.56 -39.92 95.64 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 122.687 0.395 . . . . 70.43 110.251 172.548 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 36.3 t -83.74 102.58 9.9 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.93 0 C-N-CA 124.352 1.061 . . . . 75.22 109.8 -171.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' THR . . . . . 0.41 ' O ' ' HA ' ' A' ' 102' ' ' VAL . 5.9 m -111.21 152.86 26.61 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.683 0.793 . . . . 62.33 109.079 -179.258 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 20.6 m95 -128.6 115.7 18.48 Favored 'General case' 0 N--CA 1.484 1.243 0 CA-C-N 118.335 0.516 . . . . 75.2 109.777 176.02 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -157.77 126.78 5.75 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.426 1.09 . . . . 72.31 110.131 -174.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 62.48 46.75 93.15 Favored Glycine 0 C--N 1.352 1.47 0 C-N-CA 123.049 0.356 . . . . 72.42 112.981 179.024 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 59.08 9.3 1.24 Allowed 'General case' 0 N--CA 1.503 2.198 0 C-N-CA 126.632 1.973 . . . . 73.4 113.243 -176.575 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 33.0 m -109.27 145.12 36.46 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.637 1.175 . . . . 73.22 109.199 -174.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.665 HG11 HD11 ' A' ' 81' ' ' LEU . 6.0 p -97.89 108.85 22.51 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.852 0 N-CA-C 107.961 -1.126 . . . . 64.31 107.961 166.006 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 80.0 m -92.64 100.93 13.35 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 108.564 -0.902 . . . . 74.53 108.564 179.205 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.437 ' HA ' ' O ' ' A' ' 94' ' ' ASN . 52.3 t -95.29 108.43 20.92 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 N-CA-C 107.483 -1.303 . . . . 75.23 107.483 175.345 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -119.06 129.47 55.11 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 107.644 -1.243 . . . . 75.42 107.644 179.594 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -160.71 -164.88 16.43 Favored Glycine 0 C--O 1.241 0.54 0 N-CA-C 111.344 -0.702 . . . . 73.44 111.344 -178.529 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -127.24 119.38 26.24 Favored 'General case' 0 C--O 1.243 0.751 0 C-N-CA 123.064 0.546 . . . . 75.42 110.049 177.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 4.9 tt -72.44 129.0 37.31 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 107.083 -1.451 . . . . 65.53 107.083 166.38 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -56.87 105.24 0.2 Allowed 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.527 0.731 . . . . 72.43 111.206 -174.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -169.57 43.4 0.21 Allowed Glycine 0 C--N 1.34 0.758 0 CA-C-N 114.996 -1.002 . . . . 70.24 110.684 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 4.2 t -78.19 80.06 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 123.735 0.814 . . . . 74.04 110.682 -170.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -172.07 -36.81 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.919 1.288 . . . . 74.25 108.09 177.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 71.2 mt -68.48 82.12 0.26 Allowed 'General case' 0 CA--C 1.55 0.952 0 CA-C-N 114.868 -1.06 . . . . 72.31 110.474 177.168 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.76 144.94 52.57 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 114.998 -1.001 . . . . 63.21 110.803 -177.097 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -66.4 96.47 0.36 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 123.75 0.82 . . . . 72.32 111.002 -176.264 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 67.7 m-70 -67.95 -18.49 64.76 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 122.801 0.44 . . . . 74.02 110.322 172.096 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 70.0 m-70 -68.01 86.89 0.25 Allowed 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 108.72 -0.844 . . . . 75.44 108.72 162.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 26.4 p80 -161.44 170.08 20.69 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.834 1.254 . . . . 75.22 108.395 177.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 48.0 t-80 -78.98 126.5 30.77 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 122.873 0.469 . . . . 73.12 110.981 -178.462 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 25.5 t-80 . . . . . 0 C--O 1.249 1.064 0 C-N-CA 124.43 1.092 . . . . 74.23 108.246 175.794 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.7 tpp . . . . . 0 N--CA 1.481 1.118 0 N-CA-C 109.139 -0.689 . . . . 74.35 109.139 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 45.3 m -84.65 54.72 3.13 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.567 0.747 . . . . 72.31 111.002 -177.154 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 124.43 -144.12 15.13 Favored Glycine 0 C--N 1.348 1.215 0 CA-C-N 116.085 -0.507 . . . . 74.05 113.576 177.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.465 ' HE3' ' HA ' ' A' ' 4' ' ' LYS . 0.8 OUTLIER -154.1 130.91 10.83 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.972 0.909 . . . . 72.12 110.305 -171.996 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -97.84 139.81 33.14 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 108.434 -0.95 . . . . 74.13 108.434 168.749 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 5.6 p -143.05 146.68 21.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 123.547 0.739 . . . . 75.45 109.919 177.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.512 ' HG3' ' HG3' ' A' ' 24' ' ' GLN . 3.4 mp0 -106.19 117.85 35.1 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 107.917 -1.142 . . . . 70.22 107.917 174.517 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.547 HG23 HG22 ' A' ' 62' ' ' VAL . 95.0 t -104.48 127.92 58.45 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 124.324 1.05 . . . . 74.13 108.757 -176.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.42 ' O ' ' HA ' ' A' ' 60' ' ' ILE . 45.7 mt-30 -111.1 101.88 10.38 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 109.198 -0.668 . . . . 70.14 109.198 176.126 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 88.0 t -93.84 112.07 26.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 N-CA-C 108.466 -0.939 . . . . 71.03 108.466 -179.533 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.444 ' O ' ' HA ' ' A' ' 58' ' ' ILE . 39.6 ttmt -106.48 104.4 14.08 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 108.455 -0.943 . . . . 74.12 108.455 179.548 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 14.9 tt -116.49 116.91 53.73 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 CA-C-O 121.381 0.61 . . . . 74.54 109.813 -178.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 50.7 m -104.81 135.79 45.53 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 123.372 0.669 . . . . 73.23 111.122 -175.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 39.8 t -163.32 141.21 7.78 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.179 0.992 . . . . 75.35 111.339 174.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.447 ' ND2' ' HB3' ' A' ' 51' ' ' LEU . 91.9 m-20 60.49 32.24 20.46 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 125.279 1.432 . . . . 72.14 112.74 171.885 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 87.97 -1.98 85.33 Favored Glycine 0 C--N 1.345 1.056 0 CA-C-N 115.974 -0.557 . . . . 74.13 113.837 177.084 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 24.4 mmmt -115.21 147.63 40.09 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.243 0.617 . . . . 75.13 110.392 178.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 53.2 m -116.15 130.46 56.81 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 124.102 0.961 . . . . 74.25 108.731 175.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.509 ' HH ' HD12 ' A' ' 51' ' ' LEU . 79.1 m-85 -114.76 100.36 8.18 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 108.407 -0.96 . . . . 72.33 108.407 -179.518 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -127.84 142.05 51.39 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.108 0.563 . . . . 74.43 110.254 -177.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.431 ' HB3' ' HH ' ' A' ' 23' ' ' TYR . 23.3 tpt180 -159.4 145.27 16.14 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 115.87 -0.605 . . . . 73.41 109.939 -173.243 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 22.6 m -98.33 109.08 21.89 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 124.307 1.043 . . . . 74.52 109.706 178.028 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.431 ' HH ' ' HB3' ' A' ' 21' ' ' ARG . 5.8 m-85 -100.83 137.87 38.64 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.555 1.142 . . . . 74.53 108.67 -179.107 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.512 ' HG3' ' HG3' ' A' ' 7' ' ' GLU . 27.0 mp0 -103.59 108.23 19.42 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 108.349 -0.982 . . . . 74.41 108.349 178.457 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 80.4 mt -112.07 99.29 7.96 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.335 1.054 . . . . 72.52 109.637 -174.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 89.1 t80 -92.93 135.55 34.04 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 108.88 -0.785 . . . . 64.52 108.88 169.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.528 ' HB2' ' HB2' ' A' ' 32' ' ' GLU . . . -141.03 150.22 42.72 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.989 0.916 . . . . 74.21 109.467 179.718 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.0 t -80.87 -38.92 17.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-O 121.263 0.554 . . . . 75.14 110.338 175.285 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.528 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 52.2 mtt180 -119.92 163.34 17.71 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.279 0.631 . . . . 74.45 110.174 175.386 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.408 ' HB2' HD11 ' A' ' 80' ' ' ILE . 7.3 p-10 -65.18 -34.57 78.69 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 115.253 -0.885 . . . . 52.44 109.919 170.869 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.506 ' HA ' ' HD3' ' A' ' 34' ' ' LYS . 25.4 mm-40 -56.99 -39.66 75.08 Favored 'General case' 0 C--N 1.359 1.015 0 C-N-CA 124.297 1.039 . . . . 74.24 111.573 173.255 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.528 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 29.9 mm-40 -68.04 -40.85 82.76 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 116.005 -0.543 . . . . 74.22 110.274 178.599 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.49 -33.92 76.64 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.637 0.775 . . . . 74.41 110.368 -179.305 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.506 ' HD3' ' HA ' ' A' ' 31' ' ' GLU . 59.6 mtpt -59.43 -51.79 68.4 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.629 0.772 . . . . 72.42 112.21 -178.649 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.513 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 1.2 pp20? -67.86 -28.04 67.19 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-O 119.467 -0.301 . . . . 63.02 111.33 179.659 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -64.89 -40.99 95.96 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.137 0.575 . . . . 75.04 111.054 174.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.471 HD12 HD23 ' A' ' 81' ' ' LEU . 70.3 mt -61.18 -44.17 97.72 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 123.747 0.655 . . . . 74.14 110.729 173.736 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -61.23 -39.35 89.95 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 122.834 0.453 . . . . 72.4 111.474 176.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.513 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 33.7 mmtp -61.39 -54.42 43.9 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.45 0.7 . . . . 74.04 110.691 176.828 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 47.1 t -58.43 -51.52 70.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 124.549 1.139 . . . . 71.5 112.169 -177.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 70.3 mt -65.72 -48.79 70.79 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 124.054 0.846 . . . . 70.42 111.384 -174.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 31.0 t-20 -60.79 -46.52 90.19 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.256 0.622 . . . . 72.42 110.419 -178.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -60.7 -43.87 97.25 Favored 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 123.622 0.769 . . . . 75.2 112.177 177.371 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 17.1 tpp180 -66.45 -24.89 66.51 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 123.504 0.722 . . . . 75.0 111.298 -178.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.485 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 65.3 mtp -85.43 -14.03 47.43 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-O 118.205 -0.902 . . . . 65.23 112.877 176.774 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.471 ' HA ' ' HD2' ' A' ' 49' ' ' LYS . 0.8 OUTLIER -60.34 -43.98 94.73 Favored Pre-proline 0 N--CA 1.503 2.21 0 CA-C-N 119.861 1.209 . . . . 73.33 113.42 -179.746 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.459 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 12.3 Cg_endo -56.71 -37.19 98.35 Favored 'Trans proline' 0 C--N 1.394 2.956 0 C-N-CA 121.715 1.61 . . . . 73.44 111.802 167.556 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.426 HG23 ' SG ' ' A' ' 53' ' ' CYS . 35.1 mm -72.78 -29.2 29.09 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.211 0 C-N-CA 124.77 1.228 . . . . 75.35 110.844 -174.06 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.607 ' HA ' HD11 ' A' ' 108' ' ' LEU . 80.9 mttt -75.1 -39.25 60.82 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.288 0.635 . . . . 75.4 109.681 179.401 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.6 ttpm? -69.44 -26.05 64.41 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 115.185 -0.916 . . . . 73.35 111.233 173.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.509 HD12 ' HH ' ' A' ' 19' ' ' TYR . 69.8 mt -72.3 -32.48 66.62 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 109.311 -0.626 . . . . 75.53 109.311 171.839 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 82.59 38.31 12.45 Favored Glycine 0 C--N 1.348 1.212 0 CA-C-N 115.897 -0.592 . . . . 73.44 112.297 178.497 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.426 ' SG ' HG23 ' A' ' 48' ' ' ILE . 33.1 m -73.51 118.98 17.11 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.563 0.745 . . . . 74.21 110.541 -179.076 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.495 ' HZ1' ' HB2' ' A' ' 54' ' ' LYS . 0.2 OUTLIER -65.95 -55.47 16.66 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 122.909 0.484 . . . . 72.12 110.349 177.417 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.1 ttm180 -121.51 144.57 48.64 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.984 0.913 . . . . 75.2 109.05 178.479 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 35.2 m -125.78 145.0 33.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 124.191 0.996 . . . . 75.52 109.326 179.165 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 38.6 ttm180 -109.37 109.61 20.53 Favored 'General case' 0 C--O 1.238 0.5 0 N-CA-C 107.948 -1.13 . . . . 74.53 107.948 173.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.444 ' HA ' ' O ' ' A' ' 11' ' ' LYS . 36.6 mt -105.95 134.85 46.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 C-N-CA 123.82 0.848 . . . . 70.13 108.933 179.329 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 50.9 m -129.35 106.97 9.15 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 107.45 -1.315 . . . . 72.52 107.45 173.372 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.465 ' HB ' HG12 ' A' ' 102' ' ' VAL . 76.3 mt -98.88 122.21 50.33 Favored 'Isoleucine or valine' 0 C--O 1.24 0.563 0 C-N-CA 123.513 0.725 . . . . 75.51 110.066 -177.784 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -104.28 103.4 13.15 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 107.078 -1.453 . . . . 75.32 107.078 172.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.547 HG22 HG23 ' A' ' 8' ' ' VAL . 6.7 p -95.98 146.09 7.63 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 N-CA-C 108.776 -0.824 . . . . 74.33 108.776 -177.774 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.425 ' HG3' ' HB2' ' A' ' 7' ' ' GLU . 12.7 mmmm -81.35 109.26 15.68 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.123 0.487 . . . . 71.15 110.236 177.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . 0.43 ' HB3' ' HA ' ' A' ' 70' ' ' GLU . 53.4 m-70 -80.88 111.66 17.55 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 107.501 -1.296 . . . . 74.41 107.501 178.592 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 38.8 t -20.29 -68.35 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 C-N-CA 127.249 2.22 . . . . 54.4 115.281 -166.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.496 ' H ' ' HB2' ' A' ' 69' ' ' GLU . 6.6 m-20 -137.1 173.17 11.98 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 108.057 -1.09 . . . . 74.44 108.057 174.81 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.8 -41.91 97.81 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.431 0.693 . . . . 75.22 111.479 -173.682 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -73.57 -26.87 61.02 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.097 0.559 . . . . 72.0 111.372 176.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.496 ' HB2' ' H ' ' A' ' 66' ' ' ASP . 18.4 mm-40 -74.97 -27.55 60.21 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-O 118.697 -0.668 . . . . 72.23 111.707 179.74 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.43 ' HA ' ' HB3' ' A' ' 64' ' ' HIS . 48.5 mt-10 -46.98 -40.03 13.63 Favored 'General case' 0 N--CA 1.498 1.959 0 N-CA-C 114.449 1.277 . . . . 75.14 114.449 -166.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 58.2 mttp -65.99 -58.21 6.05 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.23 0.612 . . . . 74.34 111.088 -176.65 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.9 tptt -66.19 -35.71 81.17 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.192 0.997 . . . . 73.33 111.048 -178.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -64.61 -48.02 76.43 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.433 1.093 . . . . 71.33 109.438 -179.371 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.48 -39.84 92.41 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 124.129 0.893 . . . . 45.22 111.631 -177.233 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -62.01 -43.64 98.4 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.495 0.718 . . . . 73.03 110.949 175.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.16 -44.55 83.76 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 124.109 0.964 . . . . 74.35 110.351 178.394 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -76.15 -20.27 57.73 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 115.55 -0.75 . . . . 74.11 110.523 -174.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.83 -43.07 94.29 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.344 0.657 . . . . 72.53 109.915 171.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.4 -41.03 85.6 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 123.439 0.696 . . . . 70.34 111.092 176.392 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.408 HD11 ' HB2' ' A' ' 30' ' ' ASP . 31.8 mm -57.71 -53.45 44.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 124.514 1.126 . . . . 71.4 110.914 177.125 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.471 HD23 HD12 ' A' ' 37' ' ' LEU . 43.8 mt -69.24 -33.25 72.99 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.779 0.832 . . . . 63.41 112.294 -178.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 62.3 t30 -59.32 -38.22 79.75 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.318 0.647 . . . . 65.24 110.394 -178.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -71.11 -46.08 62.4 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 114.575 -1.193 . . . . 75.45 111.756 175.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 54.6 t -62.34 -54.33 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 C-N-CA 123.949 0.9 . . . . 75.23 110.801 -173.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.55 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 22.2 m-85 -59.5 -37.08 77.34 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 115.017 -0.992 . . . . 72.44 111.93 -179.609 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.69 -26.64 67.12 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.306 0.643 . . . . 74.3 112.015 179.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -85.85 -12.76 49.94 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.023 0.929 . . . . 72.33 110.683 177.582 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.7 mt -107.21 0.51 23.32 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.608 0.763 . . . . 74.33 111.751 -174.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 103.18 -7.13 51.51 Favored Glycine 0 C--N 1.345 1.061 0 N-CA-C 114.252 0.461 . . . . 71.24 114.252 176.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.55 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 46.6 m-85 -84.44 131.82 34.63 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.469 0.708 . . . . 74.12 110.059 178.389 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -116.44 -166.06 1.12 Allowed 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 124.509 1.124 . . . . 63.54 109.874 -177.479 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -50.65 -51.13 51.94 Favored 'General case' 0 N--CA 1.492 1.668 0 C-N-CA 124.024 0.929 . . . . 72.51 112.278 -179.216 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 20.1 m -63.17 -17.69 62.66 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 124.205 1.002 . . . . 74.23 112.838 -176.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . 0.422 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 18.4 m120 -94.12 -38.98 10.82 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.511 0.725 . . . . 72.34 110.827 -175.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 42.1 t -89.82 127.32 42.5 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 122.708 0.403 . . . . 74.22 109.98 -176.154 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 27.1 m -145.74 113.68 6.49 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.314 0.646 . . . . 75.2 109.862 178.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 68.2 m95 -82.07 142.34 32.39 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 122.778 0.431 . . . . 73.44 110.411 174.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -144.22 94.62 2.6 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.344 1.057 . . . . 73.31 108.93 -177.039 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 67.5 -92.98 0.23 Allowed Glycine 0 C--N 1.348 1.204 0 CA-C-N 115.531 -0.758 . . . . 74.32 113.686 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -114.72 -19.45 11.05 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.348 1.059 . . . . 74.25 110.395 -175.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 89.0 m -100.14 149.65 23.3 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.998 1.319 . . . . 72.45 110.541 -177.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.465 HG12 ' HB ' ' A' ' 60' ' ' ILE . 3.3 p -110.99 113.39 44.14 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 N-CA-C 108.523 -0.917 . . . . 75.2 108.523 169.863 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 48.7 m -100.54 111.19 23.41 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 108.957 -0.757 . . . . 72.31 108.957 178.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.422 ' HA ' ' O ' ' A' ' 94' ' ' ASN . 86.1 t -110.37 109.93 30.29 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 N-CA-C 109.297 -0.631 . . . . 64.43 109.297 177.419 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -110.46 111.49 22.78 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 107.463 -1.31 . . . . 73.43 107.463 177.059 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -157.85 172.87 35.12 Favored Glycine 0 C--N 1.342 0.903 0 C-N-CA 121.802 -0.237 . . . . 70.53 112.718 -174.405 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -85.78 158.51 19.98 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 121.906 0.86 . . . . 73.42 112.142 -172.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.607 HD11 ' HA ' ' A' ' 49' ' ' LYS . 2.2 tt -74.3 135.58 42.59 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 113.796 -1.547 . . . . 64.3 107.823 172.26 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -53.96 -63.12 1.25 Allowed 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.965 0.906 . . . . 73.44 111.692 178.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -169.18 128.66 1.72 Allowed Glycine 0 C--N 1.339 0.715 0 CA-C-N 115.412 -0.813 . . . . 72.14 111.169 179.083 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 92.6 t -69.01 105.86 1.11 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.879 0 N-CA-C 108.945 -0.761 . . . . 74.31 108.945 174.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 29.6 t70 67.8 87.14 0.12 Allowed 'General case' 0 C--N 1.35 0.629 0 C-N-CA 125.069 1.348 . . . . 74.33 110.072 -178.048 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 96.6 mt -69.37 129.64 40.33 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.49 -0.777 . . . . 73.12 111.341 -176.336 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -65.95 -49.85 66.44 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.109 0.964 . . . . 75.33 109.257 172.147 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 29.6 t60 -80.94 77.19 7.85 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 107.907 -1.146 . . . . 75.2 107.907 173.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 21.9 p80 -104.07 -6.18 21.37 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 115.81 -0.632 . . . . 74.51 112.627 -172.464 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 34.5 m170 -76.71 82.69 3.34 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 109.259 -0.645 . . . . 72.13 109.259 173.255 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 24.7 p80 -166.83 157.45 11.94 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.987 1.315 . . . . 75.4 108.249 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -70.17 155.28 40.85 Favored 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 109.52 -0.548 . . . . 75.02 109.52 177.464 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 73.7 m-70 . . . . . 0 CA--C 1.556 1.177 0 N-CA-C 109.101 -0.703 . . . . 75.1 109.101 175.812 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.6 ptt? . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 119.971 -0.062 . . . . 72.25 111.019 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 45.7 t -60.87 127.05 29.67 Favored 'General case' 0 C--O 1.246 0.915 0 C-N-CA 123.469 0.708 . . . . 74.55 110.722 -175.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -74.05 73.07 1.31 Allowed Glycine 0 C--N 1.346 1.138 0 N-CA-C 110.53 -1.028 . . . . 62.43 110.53 171.254 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -111.22 172.89 6.61 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 124.545 1.138 . . . . 74.22 110.218 -174.921 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.497 ' HZ1' ' HB3' ' A' ' 5' ' ' LYS . 4.7 ttpm? -98.05 113.32 25.15 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 107.884 -1.154 . . . . 73.12 107.884 170.052 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -100.42 127.74 53.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 N-CA-C 107.396 -1.335 . . . . 63.41 107.396 172.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -102.34 113.76 27.35 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 108.303 -0.999 . . . . 74.41 108.303 177.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 75.0 t -95.05 106.14 17.83 Favored 'Isoleucine or valine' 0 C--O 1.239 0.522 0 C-N-CA 125.147 1.379 . . . . 74.24 108.606 -174.274 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.504 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 65.5 mt-30 -99.84 98.84 9.59 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 108.373 -0.973 . . . . 52.51 108.373 -172.51 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.416 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 57.3 t -93.67 107.37 19.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 N-CA-C 108.919 -0.771 . . . . 73.44 108.919 -173.609 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.417 ' HG3' ' HB3' ' A' ' 20' ' ' GLU . 40.1 ttmt -106.19 101.65 11.11 Favored 'General case' 0 C--N 1.346 0.416 0 N-CA-C 107.817 -1.179 . . . . 75.23 107.817 178.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.491 ' HA ' ' O ' ' A' ' 57' ' ' ARG . 14.6 tt -119.09 122.08 68.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 122.965 0.506 . . . . 73.45 110.301 -174.062 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 30.0 m -90.33 123.16 33.86 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 109.178 -0.675 . . . . 75.31 109.178 178.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.627 ' SG ' HG21 ' A' ' 48' ' ' ILE . 16.2 t -156.66 126.27 6.23 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.142 0.977 . . . . 74.35 109.01 -173.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.492 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 6.3 t-20 66.33 25.22 10.45 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 125.218 1.407 . . . . 74.4 110.975 175.569 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.19 1.51 86.34 Favored Glycine 0 C--N 1.352 1.443 0 CA-C-N 115.585 -0.734 . . . . 72.22 113.843 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm -109.85 153.07 24.95 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.937 0.895 . . . . 75.13 110.023 -179.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 28.0 m -113.26 107.5 15.98 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.266 0.627 . . . . 73.54 109.415 -179.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -100.89 99.2 9.65 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 107.586 -1.265 . . . . 72.54 107.586 -175.135 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.417 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 8.4 pt-20 -115.4 122.61 46.34 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 109.578 -0.527 . . . . 73.1 109.578 -179.533 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.5 tpm_? -140.76 127.36 20.18 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.554 -0.748 . . . . 71.44 110.243 -169.699 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 27.3 m -86.67 111.35 20.59 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 123.661 0.784 . . . . 73.54 109.891 176.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -97.66 119.81 36.9 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.724 0.81 . . . . 74.22 109.374 177.29 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 26.8 mp0 -86.69 109.26 19.08 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 108.135 -1.061 . . . . 74.41 108.135 -179.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.463 HD11 HG23 ' A' ' 40' ' ' VAL . 86.1 mt -120.26 132.58 55.39 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.922 0.889 . . . . 74.2 109.286 -178.069 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 39.8 t80 -126.4 135.97 52.09 Favored 'General case' 0 C--O 1.24 0.577 0 N-CA-C 108.673 -0.862 . . . . 72.0 108.673 177.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.449 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -156.15 152.55 28.04 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.245 0.618 . . . . 70.34 109.439 173.157 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 95.8 t -67.99 -60.05 2.99 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 O-C-N 124.158 0.911 . . . . 65.3 109.294 174.031 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.56 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 97.4 mtt180 -96.57 162.87 13.27 Favored 'General case' 0 C--O 1.242 0.665 0 CA-C-O 121.837 0.827 . . . . 74.41 111.61 -178.267 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 18.2 p-10 -67.29 -37.16 82.95 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 113.598 -1.637 . . . . 65.14 111.055 174.057 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -67.68 -31.83 72.08 Favored 'General case' 0 C--N 1.353 0.747 0 C-N-CA 124.244 1.017 . . . . 71.25 111.58 -175.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.56 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 26.1 mm-40 -66.4 -35.63 80.8 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.861 -0.609 . . . . 74.23 109.926 177.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.86 -25.85 63.92 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 123.893 0.877 . . . . 74.41 110.784 -176.243 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.456 ' HG2' HG21 ' A' ' 80' ' ' ILE . 53.2 mtmt -55.19 -62.13 1.87 Allowed 'General case' 0 C--N 1.365 1.28 0 C-N-CA 122.944 0.498 . . . . 75.54 111.556 -178.71 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.531 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 3.1 pp20? -61.29 -29.99 70.21 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 115.979 -0.555 . . . . 73.04 111.857 -176.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 56.4 mttm -67.08 -43.38 82.75 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.231 0.612 . . . . 75.52 110.423 177.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.49 HD13 HD21 ' A' ' 81' ' ' LEU . 88.8 mt -59.7 -40.55 88.27 Favored 'General case' 0 N--CA 1.474 0.746 0 O-C-N 123.989 0.806 . . . . 74.22 110.496 176.269 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -58.91 -46.51 87.73 Favored 'General case' 0 C--N 1.359 0.995 0 C-N-CA 123.025 0.53 . . . . 74.25 110.971 175.65 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.531 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 14.2 mmmm -60.58 -52.0 67.02 Favored 'General case' 0 N--CA 1.48 1.046 0 O-C-N 123.586 0.554 . . . . 75.44 110.04 179.183 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.463 HG23 HD11 ' A' ' 25' ' ' LEU . 46.5 t -55.16 -42.87 67.84 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 125.127 1.371 . . . . 70.24 111.996 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 67.0 mt -71.95 -36.64 69.93 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 122.869 0.468 . . . . 73.51 110.611 -179.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.3 m-80 -65.52 -30.95 71.77 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 122.78 0.432 . . . . 74.12 111.643 173.182 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.442 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 13.6 mm-40 -75.18 -54.54 6.94 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 122.501 0.32 . . . . 64.25 110.624 179.158 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.7 tpp180 -66.58 -36.38 82.5 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.29 0.636 . . . . 73.31 111.113 -175.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.497 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 69.9 mtp -86.41 -10.8 53.54 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 118.728 -0.653 . . . . 75.02 112.613 -178.159 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.528 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 22.4 t70 -58.79 -53.22 68.57 Favored Pre-proline 0 CA--C 1.564 1.49 0 CA-C-O 118.41 -0.805 . . . . 73.53 111.479 178.705 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -61.59 -29.67 84.65 Favored 'Trans proline' 0 C--N 1.395 2.988 0 C-N-CA 121.877 1.718 . . . . 75.21 111.912 174.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.627 HG21 ' SG ' ' A' ' 14' ' ' CYS . 49.4 mm -70.25 -34.0 56.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 123.893 0.877 . . . . 73.02 110.804 -173.158 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.528 ' HE2' ' HA ' ' A' ' 46' ' ' ASP . 45.6 mtmt -71.01 -38.97 72.64 Favored 'General case' 0 C--N 1.353 0.722 0 N-CA-C 109.667 -0.494 . . . . 75.02 109.667 178.195 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.1 tmmt? -73.85 -26.05 60.38 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 116.046 -0.524 . . . . 74.31 110.34 177.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.6 mt -70.9 -27.79 64.06 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 108.726 -0.842 . . . . 74.02 108.726 170.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 69.43 37.73 79.45 Favored Glycine 0 C--N 1.353 1.473 0 O-C-N 124.275 0.985 . . . . 70.32 112.933 172.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.492 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 71.4 m -70.74 111.25 6.06 Favored 'General case' 0 C--O 1.241 0.635 0 O-C-N 124.282 0.637 . . . . 55.1 109.917 177.881 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -58.01 -55.01 40.41 Favored 'General case' 0 C--O 1.215 -0.746 0 O-C-N 124.804 1.315 . . . . 75.54 110.465 -173.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 73.9 ttt180 -108.62 136.06 48.83 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 108.641 -0.874 . . . . 73.31 108.641 172.207 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 30.1 m -124.75 139.76 49.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 123.546 0.739 . . . . 73.24 109.623 175.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.491 ' O ' ' HA ' ' A' ' 12' ' ' ILE . 48.8 ttt180 -109.05 106.92 17.05 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 108.569 -0.9 . . . . 73.3 108.569 171.654 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 41.9 mt -102.31 106.16 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 N-CA-C 108.383 -0.969 . . . . 74.4 108.383 -179.67 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 17.5 m -109.22 102.5 11.44 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 107.963 -1.125 . . . . 72.24 107.963 -177.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 71.2 mt -99.67 113.83 36.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 123.496 0.718 . . . . 74.42 109.884 -174.261 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.504 ' HB2' ' HB2' ' A' ' 9' ' ' GLN . 58.5 mtm180 -98.96 122.72 42.59 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 107.705 -1.22 . . . . 75.22 107.705 -179.042 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.2 p -93.59 129.01 44.6 Favored 'Isoleucine or valine' 0 C--O 1.242 0.673 0 N-CA-C 108.932 -0.766 . . . . 61.45 108.932 -177.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.3 tmtt? -97.1 121.97 39.58 Favored 'General case' 0 C--O 1.239 0.532 0 N-CA-C 107.524 -1.287 . . . . 72.41 107.524 176.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 5.9 p80 -113.12 131.51 55.81 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.765 1.226 . . . . 75.43 109.369 -179.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 16.9 m -89.32 -59.22 2.27 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.611 0.765 . . . . 73.32 111.227 -173.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -87.53 131.81 34.25 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 116.276 -0.42 . . . . 74.41 110.244 -175.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -75.3 -24.27 57.45 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 123.653 0.781 . . . . 50.24 112.815 -173.223 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -81.33 -40.19 23.96 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 122.918 0.487 . . . . 63.41 110.417 178.356 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 -68.81 -49.19 60.55 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.017 0.527 . . . . 75.2 111.983 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -49.84 -30.02 9.09 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 124.911 1.382 . . . . 73.23 114.692 -166.07 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.541 ' HZ1' ' HB3' ' A' ' 71' ' ' LYS . 7.9 ttpm? -64.96 -48.26 74.67 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.018 0.927 . . . . 53.35 110.725 -176.322 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.484 ' HZ3' ' HB2' ' A' ' 72' ' ' LYS . 4.6 ttmp? -79.39 -40.98 28.78 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.123 0.569 . . . . 64.12 110.26 173.619 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -63.15 -37.97 89.32 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.321 1.049 . . . . 73.53 111.524 -166.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.71 -36.78 62.72 Favored 'General case' 0 C--N 1.356 0.871 0 C-N-CA 123.494 0.718 . . . . 70.32 111.623 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -66.41 -36.83 83.81 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 122.997 0.519 . . . . 73.22 111.179 174.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.44 ' O ' HG12 ' A' ' 80' ' ' ILE . 79.3 tttt -76.19 -31.71 58.61 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.719 -0.673 . . . . 72.12 109.456 177.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -75.96 -21.97 56.43 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.811 0.845 . . . . 71.05 109.605 176.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.37 -40.3 93.37 Favored 'General case' 0 C--N 1.35 0.615 0 C-N-CA 123.574 0.75 . . . . 72.03 109.757 172.137 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.94 -43.25 93.32 Favored 'General case' 0 C--N 1.351 0.632 0 O-C-N 123.969 0.793 . . . . 63.05 110.38 174.138 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.456 HG21 ' HG2' ' A' ' 34' ' ' LYS . 29.3 mm -62.4 -46.27 96.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 124.306 1.042 . . . . 73.12 111.267 -179.396 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.52 HD13 HG11 ' A' ' 102' ' ' VAL . 39.2 mt -63.05 -46.9 85.31 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.839 0.856 . . . . 74.03 110.013 178.606 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -62.47 -36.94 84.05 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 123.999 0.812 . . . . 74.51 109.819 -175.022 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.423 ' O ' ' HG2' ' A' ' 87' ' ' GLU . 30.2 mmmt -65.54 -41.63 92.83 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 122.902 0.481 . . . . 73.21 111.115 175.916 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.421 HG22 ' O ' ' A' ' 80' ' ' ILE . 53.6 t -65.69 -43.16 93.78 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 123.428 0.691 . . . . 72.21 110.919 -178.453 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.447 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 26.4 m-85 -60.31 -41.62 93.83 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 115.308 -0.86 . . . . 74.15 109.808 175.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.75 -31.75 73.11 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.588 0.755 . . . . 44.03 111.711 177.275 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.423 ' HG2' ' O ' ' A' ' 83' ' ' LYS . 23.5 mm-40 -76.2 -19.6 58.26 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.65 0.78 . . . . 73.05 111.336 178.819 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 78.5 mt -109.32 14.32 23.78 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.551 0.74 . . . . 75.04 110.999 -177.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 81.17 28.5 44.71 Favored Glycine 0 C--N 1.35 1.356 0 N-CA-C 114.488 0.555 . . . . 63.03 114.488 171.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.579 ' HB3' HD22 ' A' ' 94' ' ' ASN . 13.7 m-85 -111.04 146.7 36.26 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 107.856 -1.164 . . . . 72.33 107.856 171.744 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -101.18 172.11 7.21 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.064 0.546 . . . . 72.35 111.402 -178.115 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -65.64 -36.93 85.1 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.372 1.069 . . . . 70.53 111.594 -173.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 18.3 m -62.51 -36.01 81.2 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 124.029 0.931 . . . . 61.52 112.776 -175.527 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ASN . . . . . 0.579 HD22 ' HB3' ' A' ' 90' ' ' TYR . 2.1 p-10 -86.08 -0.53 55.84 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 111.936 0.347 . . . . 64.11 111.936 178.124 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.533 ' HA ' HG23 ' A' ' 104' ' ' VAL . 57.9 t -101.07 106.59 19.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 N-CA-C 107.908 -1.145 . . . . 74.1 107.908 174.789 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 26.2 m -136.74 133.41 36.01 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.195 0.598 . . . . 74.23 109.622 -175.18 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 40.5 m95 -87.77 152.91 21.76 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-O 121.703 0.763 . . . . 74.22 111.826 -179.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -149.89 79.2 1.37 Allowed 'General case' 0 C--O 1.242 0.688 0 C-N-CA 126.254 1.821 . . . . 74.11 106.57 -175.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 72.99 -117.38 5.96 Favored Glycine 0 CA--C 1.531 1.091 0 CA-C-N 115.149 -0.932 . . . . 74.31 112.173 -173.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -97.43 11.16 37.68 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.764 0.825 . . . . 75.41 110.912 175.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 61.6 m -119.58 125.87 49.83 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.663 0.785 . . . . 62.12 109.976 -178.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.52 HG11 HD13 ' A' ' 81' ' ' LEU . 8.9 p -96.02 116.78 38.72 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.763 0 N-CA-C 107.866 -1.161 . . . . 65.11 107.866 170.879 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 4.3 m -99.64 108.14 20.44 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 108.337 -0.986 . . . . 62.54 108.337 -177.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.533 HG13 HD21 ' A' ' 94' ' ' ASN . 83.6 t -115.12 112.28 39.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 C-N-CA 124.819 1.248 . . . . 73.54 108.549 -177.609 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . 0.413 ' HG2' ' HA ' ' A' ' 57' ' ' ARG . 28.1 mt-10 -111.22 152.23 27.35 Favored 'General case' 0 C--O 1.241 0.631 0 N-CA-C 109.484 -0.562 . . . . 73.53 109.484 177.561 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -170.39 145.87 9.41 Favored Glycine 0 N--CA 1.449 -0.436 0 CA-C-N 115.748 -0.66 . . . . 74.51 112.189 177.799 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 57.8 tt0 -71.54 108.58 5.0 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 109.025 -0.731 . . . . 75.44 109.025 168.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.51 HD23 ' HG2' ' A' ' 49' ' ' LYS . 49.5 tp -83.03 96.35 8.32 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 107.424 -1.325 . . . . 74.03 107.424 168.626 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 38.79 -78.9 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 126.479 1.911 . . . . 71.42 114.133 177.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 126.5 34.29 0.62 Allowed Glycine 0 C--N 1.344 1.022 0 N-CA-C 110.105 -1.198 . . . . 73.14 110.105 -172.211 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 2.8 m -62.57 92.63 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 CA-C-O 122.197 0.998 . . . . 74.45 111.902 -177.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -134.89 98.42 4.02 Favored 'General case' 0 C--O 1.239 0.539 0 CA-C-N 114.332 -1.304 . . . . 71.35 107.872 176.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 80.0 mt -86.27 101.08 12.74 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.15 0.98 . . . . 75.33 109.723 -175.008 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -73.49 -51.98 15.23 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 124.001 0.921 . . . . 74.32 112.327 -170.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 22.2 t-80 -116.65 -32.13 5.28 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.344 0.658 . . . . 74.34 109.886 178.518 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 34.0 m80 -82.03 57.32 3.46 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 123.535 0.734 . . . . 73.11 110.018 174.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 38.7 p-80 -53.9 152.39 5.67 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 124.654 1.181 . . . . 75.31 112.944 -171.046 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 80.4 t60 -68.19 104.24 1.76 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 123.387 0.675 . . . . 74.43 110.439 -178.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 21.9 m-70 -69.67 173.84 5.71 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.943 0.897 . . . . 74.13 110.572 172.165 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 81.3 t60 . . . . . 0 C--O 1.254 1.295 0 C-N-CA 122.919 0.487 . . . . 73.4 110.548 179.605 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.5 tppt? . . . . . 0 CA--C 1.537 0.468 0 CA-C-O 120.591 0.234 . . . . 72.239999999999995 110.973 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -84.83 93.5 8.51 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 106.792 -1.559 . . . . 74.129999999999995 106.792 169.383 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.445 HG21 HG22 ' A' ' 62' ' ' VAL . 5.9 p -106.36 152.82 7.87 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 C-N-CA 123.982 0.913 . . . . 74.0 110.395 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.429 ' OE2' ' HG3' ' A' ' 24' ' ' GLN . 11.1 mp0 -100.32 114.32 27.73 Favored 'General case' 0 C--N 1.351 0.631 0 N-CA-C 107.935 -1.135 . . . . 72.129999999999995 107.935 173.546 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.438 HG22 HG23 ' A' ' 62' ' ' VAL . 78.1 t -112.63 113.62 44.66 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 C-N-CA 124.617 1.167 . . . . 70.230000000000004 108.314 -177.424 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -101.0 108.45 20.17 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 108.906 -0.776 . . . . 73.409999999999997 108.906 -175.28 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 91.8 t -93.53 108.25 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 N-CA-C 108.062 -1.088 . . . . 70.299999999999997 108.062 179.374 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -112.72 103.47 11.5 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.269 1.028 . . . . 74.019999999999996 108.422 -174.389 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 11.7 tt -120.61 125.92 74.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 CA-C-O 121.337 0.589 . . . . 51.100000000000001 111.156 -171.272 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 19.9 m -98.34 121.38 40.2 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.974 0.909 . . . . 62.439999999999998 109.193 -177.744 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 5.4 t -148.06 131.78 16.94 Favored 'General case' 0 C--O 1.242 0.696 0 N-CA-C 109.579 -0.526 . . . . 72.340000000000003 109.579 179.102 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.648 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 2.8 t-20 78.49 -65.31 0.24 Allowed 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 125.93 1.692 . . . . 73.439999999999998 110.56 172.548 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -170.44 6.82 0.04 OUTLIER Glycine 0 N--CA 1.465 0.586 0 CA-C-N 116.474 -0.33 . . . . 35.149999999999999 112.624 172.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -119.72 154.55 33.96 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.126 0.971 . . . . 74.099999999999994 109.782 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 7.3 m -115.58 122.16 44.81 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 108.073 -1.084 . . . . 75.430000000000007 108.073 175.826 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -106.77 99.9 9.44 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 108.283 -1.006 . . . . 72.299999999999997 108.283 -174.073 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -114.77 146.1 41.36 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 121.063 0.459 . . . . 73.310000000000002 110.014 175.627 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -155.55 132.41 10.61 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 107.812 -1.181 . . . . 71.400000000000006 107.812 -176.859 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 51.7 m -87.47 111.25 20.96 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 109.536 -0.542 . . . . 74.349999999999994 109.536 177.795 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -98.71 140.66 32.58 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.48 0.712 . . . . 72.310000000000002 109.621 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.429 ' HG3' ' OE2' ' A' ' 7' ' ' GLU . 21.5 mp0 -97.21 105.91 18.14 Favored 'General case' 0 C--O 1.24 0.578 0 N-CA-C 107.151 -1.426 . . . . 73.120000000000005 107.151 174.914 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 45.7 mt -107.09 115.28 29.91 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 109.051 -0.722 . . . . 70.120000000000005 109.051 -179.033 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -107.12 123.63 48.52 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 109.21 -0.663 . . . . 75.209999999999994 109.21 177.246 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -145.9 122.05 10.81 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 122.738 0.415 . . . . 73.340000000000003 110.02 175.897 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 60.3 t -73.29 -30.86 31.96 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 C-N-CA 123.815 0.846 . . . . 54.450000000000003 109.774 171.491 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.422 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 58.4 mtt-85 -112.78 150.37 31.72 Favored 'General case' 0 CA--C 1.552 1.033 0 CA-C-N 114.96 -1.018 . . . . 72.200000000000003 110.043 -174.589 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -67.23 -44.85 78.44 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 123.939 0.896 . . . . 72.5 110.937 -178.836 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.403 ' HA ' ' HD3' ' A' ' 34' ' ' LYS . 56.2 mm-40 -61.77 -30.9 71.1 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.801 0.84 . . . . 74.519999999999996 111.633 179.247 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.422 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 35.0 mm-40 -61.7 -46.14 90.97 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 122.705 0.402 . . . . 61.140000000000001 111.293 177.142 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.7 -33.88 75.77 Favored 'General case' 0 CA--C 1.553 1.063 0 N-CA-C 109.871 -0.418 . . . . 62.039999999999999 109.871 -177.842 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.403 ' HD3' ' HA ' ' A' ' 31' ' ' GLU . 54.7 mtpt -54.31 -58.2 8.3 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.131 0.572 . . . . 74.219999999999999 111.395 176.159 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.8 pp20? -66.91 -26.89 67.08 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 115.92 -0.582 . . . . 71.430000000000007 112.354 -177.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 40.2 mttp -71.59 -35.17 70.43 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.129 0.571 . . . . 54.119999999999997 111.048 176.133 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.604 HD13 HD23 ' A' ' 81' ' ' LEU . 81.5 mt -64.23 -45.31 88.77 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 123.334 0.397 . . . . 73.239999999999995 110.058 171.915 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.434 ' HG2' HG13 ' A' ' 84' ' ' VAL . 50.1 mtpt -58.88 -38.11 78.1 Favored 'General case' 0 C--N 1.357 0.917 0 C-N-CA 122.782 0.433 . . . . 74.129999999999995 111.086 174.815 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 43.3 mmtm -60.32 -62.83 1.58 Allowed 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 122.865 0.466 . . . . 62.409999999999997 110.515 175.542 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 93.9 t -59.7 -45.94 93.92 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 123.583 0.753 . . . . 62.340000000000003 111.695 -172.89 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.619 HD21 HD11 ' A' ' 60' ' ' ILE . 68.9 mt -64.95 -58.33 6.4 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.382 0.673 . . . . 74.450000000000003 111.271 -179.252 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -60.32 -38.4 83.59 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 123.357 0.663 . . . . 71.329999999999998 112.054 -176.366 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -67.67 -48.24 67.2 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 122.577 0.351 . . . . 74.439999999999998 111.027 178.207 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -73.55 -32.96 64.47 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 116.342 -0.39 . . . . 72.319999999999993 111.287 -172.724 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.406 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 43.3 mtp -83.62 -11.53 57.18 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 122.972 0.509 . . . . 74.409999999999997 112.059 -177.846 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -61.02 -53.34 64.76 Favored Pre-proline 0 CA--C 1.564 1.484 0 CA-C-O 118.577 -0.725 . . . . 71.510000000000005 111.684 178.116 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.526 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 56.8 Cg_endo -68.47 -25.23 35.53 Favored 'Trans proline' 0 C--N 1.387 2.581 0 CA-C-N 121.169 1.453 . . . . 72.420000000000002 112.435 173.258 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 32.1 mm -63.52 -43.66 98.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 123.434 0.694 . . . . 54.020000000000003 111.398 -178.578 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.406 ' HG3' ' O ' ' A' ' 45' ' ' MET . 48.4 mtmt -67.12 -32.51 73.69 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 121.035 0.445 . . . . 61.310000000000002 110.098 178.968 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -71.57 -29.04 64.27 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.616 1.166 . . . . 71.409999999999997 111.101 176.919 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.526 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 86.9 mt -70.5 -33.86 71.69 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 109.312 -0.625 . . . . 71.430000000000007 109.312 175.774 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 89.58 119.99 1.91 Allowed Glycine 0 C--N 1.344 0.987 0 CA-C-N 115.448 -0.796 . . . . 64.430000000000007 113.315 168.881 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.648 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 72.3 m -153.24 156.11 37.88 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.322 1.049 . . . . 73.120000000000005 108.755 -179.33 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.49 ' H ' ' HD2' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -74.8 -37.2 62.42 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 109.152 -0.685 . . . . 73.140000000000001 109.152 171.377 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 29.0 ttm180 -157.81 148.47 20.9 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 123.951 0.901 . . . . 73.329999999999998 109.102 -175.02 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 15.7 m -114.68 140.47 35.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 123.527 0.731 . . . . 64.120000000000005 109.97 177.277 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 45.5 ttm105 -104.96 103.36 12.91 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 108.25 -1.018 . . . . 61.530000000000001 108.25 173.534 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 40.5 mt -94.76 146.11 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 N-CA-C 107.886 -1.153 . . . . 74.340000000000003 107.886 178.306 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 28.8 m -144.15 103.37 3.99 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 106.836 -1.542 . . . . 63.399999999999999 106.836 177.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.619 HD11 HD21 ' A' ' 41' ' ' LEU . 72.7 mt -101.92 107.44 21.64 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 N-CA-C 108.827 -0.805 . . . . 70.439999999999998 108.827 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 38.1 ttp85 -97.53 121.16 39.11 Favored 'General case' 0 C--O 1.238 0.468 0 N-CA-C 108.036 -1.098 . . . . 74.019999999999996 108.036 176.832 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.445 HG22 HG21 ' A' ' 6' ' ' VAL . 4.1 p -94.85 140.29 17.04 Favored 'Isoleucine or valine' 0 C--O 1.243 0.744 0 N-CA-C 107.49 -1.3 . . . . 74.310000000000002 107.49 178.178 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 19.6 ttpp -81.52 136.39 35.61 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 109.262 -0.644 . . . . 73.340000000000003 109.262 178.603 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 86.2 m-70 -85.89 117.3 24.66 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 108.663 -0.865 . . . . 71.25 108.663 178.444 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 30.7 p -65.79 -62.13 1.68 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.742 0.817 . . . . 62.310000000000002 111.79 -173.813 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -148.29 140.39 24.07 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 107.969 -1.123 . . . . 73.319999999999993 107.969 -177.199 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -53.67 -34.53 58.99 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.939 0.895 . . . . 72.129999999999995 113.379 -172.046 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.6 -42.16 74.79 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 122.783 0.433 . . . . 62.520000000000003 111.272 178.292 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -74.97 -47.63 28.41 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.372 0.669 . . . . 45.299999999999997 111.494 -176.591 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.3 pp20? -68.16 -20.61 64.9 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 114.458 1.281 . . . . 63.009999999999998 114.458 -159.056 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 64.6 mttm -65.48 -42.46 92.2 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-O 121.407 0.623 . . . . 74.219999999999999 109.848 173.748 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -79.71 -40.79 28.15 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 114.858 -1.064 . . . . 63.420000000000002 110.566 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -74.03 -33.4 63.74 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 112.429 0.529 . . . . 75.049999999999997 112.429 -172.225 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.91 -35.93 64.67 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 117.795 0.271 . . . . 64.219999999999999 110.694 177.447 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 65.1 tttp -65.65 -39.85 91.86 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.101 0.56 . . . . 75.219999999999999 110.243 175.005 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 5.6 tmmm? -67.15 -40.06 86.61 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.974 0.909 . . . . 63.509999999999998 109.825 175.037 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -72.76 -23.72 60.86 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.788 0.835 . . . . 73.329999999999998 110.702 -175.681 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.56 -46.15 89.69 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 123.576 0.547 . . . . 71.530000000000001 109.913 173.744 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.439 ' O ' ' HG2' ' A' ' 83' ' ' LYS . . . -65.98 -40.73 91.48 Favored 'General case' 0 CA--C 1.545 0.75 0 CA-C-N 115.531 -0.759 . . . . 43.119999999999997 111.223 177.389 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 37.5 mm -56.09 -47.43 80.47 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 C-N-CA 124.287 1.035 . . . . 74.030000000000001 110.773 176.919 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.604 HD23 HD13 ' A' ' 37' ' ' LEU . 45.8 mt -67.09 -40.02 86.89 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.865 0.866 . . . . 72.239999999999995 111.762 -179.685 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 -60.13 -33.15 71.74 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.259 0.624 . . . . 64.400000000000006 111.433 -178.321 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.439 ' HG2' ' O ' ' A' ' 79' ' ' ALA . 32.9 mmtp -67.2 -49.54 64.18 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 123.697 0.623 . . . . 74.329999999999998 110.706 173.894 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.434 HG13 ' HG2' ' A' ' 38' ' ' LYS . 71.1 t -65.13 -49.26 80.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 123.988 0.915 . . . . 61.310000000000002 111.456 -171.273 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.496 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 26.4 m-85 -63.24 -33.71 76.08 Favored 'General case' 0 N--CA 1.477 0.902 0 O-C-N 123.582 0.552 . . . . 65.340000000000003 111.326 179.062 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -68.06 -30.06 69.18 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.104 0.562 . . . . 73.200000000000003 111.389 175.748 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -85.47 -13.51 48.94 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.905 0.882 . . . . 75.409999999999997 111.89 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 94.3 mt -107.49 -16.04 14.46 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 122.984 0.513 . . . . 64.299999999999997 111.385 -175.778 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 97.57 49.23 1.85 Allowed Glycine 0 C--N 1.345 1.079 0 CA-C-O 120.857 0.143 . . . . 63.299999999999997 113.373 176.796 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.496 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 40.6 m-85 -126.31 134.66 51.06 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 107.889 -1.152 . . . . 75.239999999999995 107.889 174.441 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -78.1 159.27 28.77 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.297 0.639 . . . . 73.540000000000006 111.528 -174.284 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -62.38 -46.06 90.32 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.859 0.864 . . . . 72.150000000000006 112.173 -175.718 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 63.9 p -58.53 -34.82 71.42 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 124.05 0.94 . . . . 74.230000000000004 112.16 177.051 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ASN . . . . . 0.409 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 2.5 m-20 -65.19 -25.66 67.81 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 115.412 -0.813 . . . . 53.439999999999998 110.932 -179.098 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 45.4 t -91.74 114.71 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.87 0 C-N-CA 124.333 1.053 . . . . 63.240000000000002 108.897 178.069 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 32.9 m -144.41 129.62 18.71 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 122.879 0.472 . . . . 74.510000000000005 110.389 178.453 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 66.3 m95 -86.05 137.97 32.3 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.403 0.681 . . . . 72.519999999999996 110.509 177.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -169.17 123.52 0.83 Allowed 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.481 1.112 . . . . 72.0 109.245 179.497 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 69.76 51.97 22.34 Favored Glycine 0 C--N 1.349 1.26 0 O-C-N 123.883 0.739 . . . . 55.539999999999999 113.193 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 46.67 26.09 0.5 Allowed 'General case' 0 N--CA 1.499 2.018 0 C-N-CA 126.444 1.898 . . . . 71.510000000000005 113.537 -176.359 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 50.0 m -135.54 148.01 48.99 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 125.313 1.445 . . . . 72.230000000000004 107.931 -177.235 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' VAL . . . . . 0.601 HG11 HD13 ' A' ' 81' ' ' LEU . 13.4 p -103.35 121.58 54.83 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 N-CA-C 108.709 -0.849 . . . . 64.409999999999997 108.709 171.792 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 24.7 m -97.79 111.31 23.65 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 107.532 -1.284 . . . . 33.049999999999997 107.532 178.68 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.409 ' HA ' ' O ' ' A' ' 94' ' ' ASN . 55.1 t -119.35 125.0 74.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 N-CA-C 108.533 -0.914 . . . . 72.310000000000002 108.533 -178.95 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -107.95 153.83 22.49 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 109.578 -0.527 . . . . 73.140000000000001 109.578 174.485 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -148.51 136.98 6.15 Favored Glycine 0 C--O 1.238 0.368 0 N-CA-C 110.643 -0.983 . . . . 73.540000000000006 110.643 173.515 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 58.9 tp60 . . . . . 0 CA--C 1.543 0.697 0 N-CA-C 108.081 -1.081 . . . . 72.310000000000002 108.081 179.046 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.608 0 N-CA-C 110.225 -0.287 . . . . 71.319999999999993 110.225 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 33.6 ttpt -100.57 117.02 33.86 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.51 0.724 . . . . 72.409999999999997 110.593 -178.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.419 HG21 HG13 ' A' ' 62' ' ' VAL . 3.7 p -101.06 138.83 23.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 107.673 -1.232 . . . . 72.310000000000002 107.673 164.634 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -104.32 111.66 24.38 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 108.07 -1.085 . . . . 72.049999999999997 108.07 174.727 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.624 HG13 HG23 ' A' ' 60' ' ' ILE . 56.7 t -98.98 107.36 20.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 CA-C-N 113.593 -1.639 . . . . 73.409999999999997 108.841 -174.226 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.418 ' HB2' ' HB3' ' A' ' 61' ' ' ARG . 42.1 mt-30 -97.16 101.57 13.16 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 108.16 -1.052 . . . . 75.040000000000006 108.16 -176.537 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 67.0 t -93.23 111.95 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 108.848 -0.797 . . . . 72.209999999999994 108.848 -176.696 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -119.46 103.5 9.51 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.416 1.086 . . . . 61.509999999999998 108.259 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.48 HD13 HG13 ' A' ' 48' ' ' ILE . 12.3 tt -118.53 122.02 68.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 CA-C-O 121.036 0.446 . . . . 62.310000000000002 111.436 -173.648 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 31.9 m -97.39 112.08 24.06 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 108.361 -0.978 . . . . 75.120000000000005 108.361 178.827 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.666 ' SG ' HG23 ' A' ' 48' ' ' ILE . 14.6 t -122.24 115.92 23.22 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.464 1.106 . . . . 54.200000000000003 108.253 179.694 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 40.4 t-20 71.57 -73.1 0.1 Allowed 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 125.222 1.409 . . . . 60.140000000000001 110.29 178.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -161.48 10.18 0.12 Allowed Glycine 0 N--CA 1.469 0.894 0 N-CA-C 111.465 -0.654 . . . . 62.43 111.465 175.107 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.424 ' HA ' ' HE3' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -110.98 123.89 51.06 Favored 'General case' 0 C--N 1.349 0.559 0 C-N-CA 124.197 0.999 . . . . 75.010000000000005 109.264 177.207 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 91.5 m -106.81 123.89 48.81 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.688 0.795 . . . . 73.299999999999997 109.62 -179.398 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -109.64 101.84 10.72 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.487 1.115 . . . . 71.439999999999998 108.316 -176.309 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -114.58 142.42 46.46 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.05 0.54 . . . . 74.450000000000003 110.043 -177.898 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 52.6 ttm-85 -168.05 140.74 3.1 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 122.863 0.465 . . . . 65.140000000000001 111.393 175.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 24.7 m -86.68 109.24 19.06 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.661 1.185 . . . . 43.310000000000002 109.549 174.749 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -97.36 135.44 39.25 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.618 0.767 . . . . 75.439999999999998 109.41 177.463 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -94.48 109.46 21.34 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 107.85 -1.167 . . . . 51.420000000000002 107.85 177.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.417 HD22 ' HB3' ' A' ' 36' ' ' LYS . 58.0 mt -113.7 116.48 29.5 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.561 0.744 . . . . 70.310000000000002 109.344 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -114.79 120.53 40.33 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.438 1.095 . . . . 73.409999999999997 108.969 -176.374 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.498 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -150.98 150.88 31.31 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 122.946 0.499 . . . . 74.409999999999997 110.425 176.776 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.2 t -78.81 -42.94 25.08 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.773 0 CA-C-N 114.957 -1.019 . . . . 70.030000000000001 109.459 174.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.52 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 59.5 mtt-85 -116.83 164.33 14.83 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.846 0.858 . . . . 61.25 111.451 -169.837 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -62.39 -48.65 78.78 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 124.467 1.107 . . . . 61.539999999999999 111.662 178.686 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.425 ' HA ' ' HD3' ' A' ' 34' ' ' LYS . 49.4 mm-40 -64.29 -28.75 69.93 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 115.586 -0.733 . . . . 72.010000000000005 111.453 -176.543 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.52 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 29.1 mm-40 -74.52 -26.2 59.83 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.026 0.53 . . . . 52.409999999999997 111.123 177.719 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.434 HD23 ' HB3' ' A' ' 27' ' ' ALA . 0.2 OUTLIER -81.69 -37.87 26.72 Favored 'General case' 0 CA--C 1.555 1.147 0 N-CA-C 109.788 -0.449 . . . . 71.109999999999999 109.788 178.885 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.462 ' HG2' HG23 ' A' ' 80' ' ' ILE . 56.8 mtpt -56.12 -52.13 65.45 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 124.094 0.958 . . . . 73.239999999999995 112.452 -176.57 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -54.67 -37.87 66.27 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.667 0.787 . . . . 73.400000000000006 111.868 177.008 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.417 ' HB3' HD22 ' A' ' 25' ' ' LEU . 54.2 mttm -70.63 -38.0 73.85 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.232 0.613 . . . . 73.510000000000005 110.811 -178.667 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 57.6 mt -62.35 -40.86 97.79 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.571 0.748 . . . . 75.310000000000002 110.984 175.24 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.501 ' HG2' HG13 ' A' ' 84' ' ' VAL . 57.2 mtpt -63.71 -41.11 98.13 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.544 0.738 . . . . 55.439999999999998 111.326 175.236 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.6 mmmp? -61.61 -53.09 60.85 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.332 0.653 . . . . 73.510000000000005 110.638 176.499 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 46.4 t -60.05 -38.95 78.88 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 124.826 1.25 . . . . 73.430000000000007 111.988 -179.683 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.448 HD21 HD11 ' A' ' 60' ' ' ILE . 23.3 mt -71.28 -50.11 35.97 Favored 'General case' 0 C--O 1.212 -0.877 0 CA-C-O 118.948 -0.549 . . . . 72.019999999999996 110.943 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 56.5 m-80 -66.4 -21.8 66.23 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-N 118.513 0.597 . . . . 72.129999999999995 111.594 177.526 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -74.87 -55.65 5.58 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.048 0.539 . . . . 72.239999999999995 110.252 176.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.419 ' HA ' ' CZ ' ' A' ' 44' ' ' ARG . 0.3 OUTLIER -72.94 -26.28 61.33 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.437 0.695 . . . . 74.349999999999994 111.312 -176.666 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 57.0 mtp -96.43 2.58 52.72 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.191 0.596 . . . . 63.399999999999999 112.326 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -59.37 -55.8 42.44 Favored Pre-proline 0 CA--C 1.566 1.579 0 CA-C-O 118.697 -0.668 . . . . 73.430000000000007 110.973 170.867 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.408 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 56.3 Cg_endo -66.79 -20.93 51.75 Favored 'Trans proline' 0 C--N 1.39 2.718 0 C-N-CA 121.788 1.659 . . . . 75.430000000000007 112.429 176.731 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.666 HG23 ' SG ' ' A' ' 14' ' ' CYS . 48.2 mm -74.46 -40.19 48.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 124.434 1.094 . . . . 73.239999999999995 111.513 -174.446 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -68.44 -32.53 72.61 Favored 'General case' 0 N--CA 1.48 1.028 0 N-CA-C 109.424 -0.584 . . . . 74.400000000000006 109.424 176.27 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -69.45 -28.09 65.82 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 124.357 1.063 . . . . 73.140000000000001 110.959 175.343 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 83.9 mt -72.31 -39.37 68.3 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 109.004 -0.739 . . . . 74.329999999999998 109.004 172.736 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 62.42 62.27 5.76 Favored Glycine 0 C--N 1.352 1.433 0 CA-C-N 115.269 -0.878 . . . . 71.010000000000005 111.833 179.458 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 63.6 m -84.96 152.44 23.49 Favored 'General case' 0 C--O 1.242 0.686 0 C-N-CA 123.069 0.547 . . . . 64.140000000000001 112.145 -174.779 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -67.53 -39.5 85.04 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 115.073 -0.967 . . . . 63.439999999999998 110.018 178.526 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 11.4 ttm180 -142.53 140.77 31.91 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.387 1.075 . . . . 74.540000000000006 109.582 176.109 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 27.0 m -123.76 136.89 58.73 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 C-N-CA 124.471 1.109 . . . . 64.049999999999997 109.0 171.631 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.468 ' O ' ' HA ' ' A' ' 12' ' ' ILE . 47.1 mtt180 -112.09 106.63 15.31 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 108.749 -0.834 . . . . 60.32 108.749 172.944 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.473 HG12 HD12 ' A' ' 12' ' ' ILE . 17.8 mt -94.86 106.96 18.8 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 N-CA-C 108.014 -1.106 . . . . 65.299999999999997 108.014 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.9 m -99.64 102.45 13.94 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 107.045 -1.465 . . . . 75.319999999999993 107.045 179.219 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.624 HG23 HG13 ' A' ' 8' ' ' VAL . 72.2 mt -96.59 107.99 20.65 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 N-CA-C 108.314 -0.995 . . . . 73.340000000000003 108.314 179.22 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.418 ' HB3' ' HB2' ' A' ' 9' ' ' GLN . 0.2 OUTLIER -93.17 106.71 18.64 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 107.204 -1.406 . . . . 73.540000000000006 107.204 -178.713 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.419 HG13 HG21 ' A' ' 6' ' ' VAL . 22.6 t -92.57 114.27 29.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 N-CA-C 107.966 -1.124 . . . . 74.519999999999996 107.966 177.557 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -84.92 105.7 15.88 Favored 'General case' 0 C--O 1.239 0.507 0 N-CA-C 108.118 -1.068 . . . . 72.299999999999997 108.118 177.734 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 25.6 p80 -64.64 139.36 58.76 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 109.336 -0.616 . . . . 75.219999999999999 109.336 177.835 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 30.4 t -80.46 -36.79 33.01 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.208 0.603 . . . . 74.010000000000005 111.389 -174.078 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.525 ' HB2' ' HB2' ' A' ' 69' ' ' GLU . 7.2 m-20 -125.07 137.94 54.2 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.606 0.763 . . . . 74.239999999999995 110.232 -174.555 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -79.68 -15.52 57.41 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.715 0.806 . . . . 41.329999999999998 112.502 -174.208 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -86.22 -44.54 12.08 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.168 0.587 . . . . 63.439999999999998 109.538 171.57 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.525 ' HB2' ' HB2' ' A' ' 66' ' ' ASP . 11.2 mm-40 -76.81 -14.3 59.93 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 114.711 -1.131 . . . . 72.439999999999998 112.821 -175.743 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.601 ' HG3' ' HD2' ' A' ' 71' ' ' LYS . 9.4 pt-20 -50.55 -31.42 15.61 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 114.554 1.316 . . . . 62.049999999999997 114.554 -176.44 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.601 ' HD2' ' HG3' ' A' ' 70' ' ' GLU . 3.7 mptp? -67.15 -42.09 84.93 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 109.418 -0.586 . . . . 64.409999999999997 109.418 176.187 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -71.3 -36.35 71.61 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.421 1.088 . . . . 74.140000000000001 110.664 177.707 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -77.7 -42.81 33.18 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.88 0.872 . . . . 72.219999999999999 112.159 -172.121 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.82 -41.81 67.76 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-O 120.806 0.336 . . . . 70.25 110.272 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -63.59 -33.46 75.66 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.134 0.974 . . . . 75.310000000000002 111.465 172.151 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 20.8 ttmm -60.97 -53.25 59.53 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.675 0.79 . . . . 73.420000000000002 109.703 173.548 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.562 ' HA ' ' HB ' ' A' ' 80' ' ' ILE . 19.1 m-85 -69.67 -20.11 63.58 Favored 'General case' 0 C--O 1.221 -0.443 0 C-N-CA 123.57 0.748 . . . . 74.230000000000004 111.943 -178.076 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.478 ' O ' ' HB2' ' A' ' 82' ' ' ASN . . . -55.55 -55.17 35.08 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 109.765 -0.458 . . . . 72.420000000000002 109.765 171.123 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.434 ' O ' ' HG2' ' A' ' 83' ' ' LYS . . . -69.86 -45.7 67.17 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.503 0.721 . . . . 71.230000000000004 111.389 178.815 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.562 ' HB ' ' HA ' ' A' ' 77' ' ' PHE . 21.6 mm -60.81 -52.38 62.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 C-N-CA 124.624 1.17 . . . . 54.009999999999998 111.823 -175.454 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 37.5 mt -67.09 -36.25 81.58 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 118.97 -0.538 . . . . 74.329999999999998 111.202 177.237 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.478 ' HB2' ' O ' ' A' ' 78' ' ' ALA . 16.8 t-20 -60.55 -36.74 79.19 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 123.413 0.445 . . . . 73.530000000000001 109.892 178.655 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.434 ' HG2' ' O ' ' A' ' 79' ' ' ALA . 75.0 mmtt -61.74 -47.19 86.32 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.014 0.526 . . . . 74.540000000000006 110.261 174.796 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.501 HG13 ' HG2' ' A' ' 38' ' ' LYS . 74.2 t -62.26 -45.44 98.75 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 C-N-CA 124.03 0.932 . . . . 65.140000000000001 110.601 -175.896 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.5 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 20.0 m-85 -62.52 -41.07 98.61 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.617 0.767 . . . . 75.219999999999999 110.731 177.235 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -69.87 -24.76 63.47 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.607 0.763 . . . . 73.310000000000002 111.516 178.626 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -84.78 -11.42 55.79 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.614 0.766 . . . . 64.420000000000002 111.566 176.213 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 82.1 mt -99.71 -32.7 10.92 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 109.519 -0.548 . . . . 75.329999999999998 109.519 177.143 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 131.32 -19.43 4.84 Favored Glycine 0 C--N 1.349 1.268 0 C-N-CA 123.265 0.46 . . . . 45.329999999999998 112.938 -179.016 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.5 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 23.8 m-85 -68.48 145.93 53.61 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.452 0.701 . . . . 70.099999999999994 110.995 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -92.87 159.56 15.3 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.368 0.667 . . . . 72.150000000000006 110.142 -177.575 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -64.85 -25.24 67.82 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.875 0.87 . . . . 72.239999999999995 110.969 172.645 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 80.4 p -67.03 -11.02 55.88 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.933 0.893 . . . . 54.43 112.643 176.48 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -90.91 -19.69 23.05 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.697 0.799 . . . . 64.209999999999994 110.723 175.867 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.52 HG13 HG21 ' A' ' 102' ' ' VAL . 59.3 t -90.71 115.18 29.47 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.975 0 C-N-CA 124.702 1.201 . . . . 74.510000000000005 110.757 -166.862 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 63.7 m -120.89 108.61 14.12 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.603 0.761 . . . . 62.439999999999998 110.299 178.234 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 68.2 m95 -87.91 121.86 30.84 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.367 0.667 . . . . 75.430000000000007 111.672 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -117.92 81.85 1.74 Allowed 'General case' 0 C--O 1.243 0.748 0 C-N-CA 124.621 1.169 . . . . 73.540000000000006 107.895 169.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.05 -115.1 4.38 Favored Glycine 0 C--N 1.345 1.07 0 CA-C-N 114.908 -1.042 . . . . 71.510000000000005 112.535 -178.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -96.72 1.88 51.43 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.888 0.875 . . . . 64.319999999999993 111.363 -178.856 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 43.1 m -118.58 140.29 50.13 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 108.911 -0.774 . . . . 61.140000000000001 108.911 179.181 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' VAL . . . . . 0.52 HG21 HG13 ' A' ' 95' ' ' VAL . 5.9 p -121.19 128.07 75.94 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 C-N-CA 123.22 0.608 . . . . 71.420000000000002 110.087 174.984 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 85.7 m -101.75 104.56 15.36 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 107.375 -1.343 . . . . 73.340000000000003 107.375 172.137 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.401 HG21 ' CZ ' ' A' ' 85' ' ' PHE . 59.1 t -94.01 111.84 25.82 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 N-CA-C 107.639 -1.245 . . . . 65.140000000000001 107.639 178.728 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -113.17 118.79 35.69 Favored 'General case' 0 C--O 1.241 0.658 0 N-CA-C 108.297 -1.001 . . . . 74.219999999999999 108.297 -177.447 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -167.78 -173.62 36.0 Favored Glycine 0 CA--C 1.502 -0.772 0 N-CA-C 110.884 -0.887 . . . . 61.240000000000002 110.884 -178.105 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 . . . . . 0 C--O 1.241 0.634 0 N-CA-C 108.579 -0.897 . . . . 74.530000000000001 108.579 175.216 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.3 tpmt? . . . . . 0 N--CA 1.472 0.638 0 CA-C-O 121.06 0.457 . . . . 72.200000000000003 110.82 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.8 ttmt -86.54 122.43 30.46 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.654 -0.703 . . . . 71.049999999999997 109.147 167.906 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -103.89 136.56 36.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 107.241 -1.392 . . . . 52.32 107.241 167.539 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.421 ' HB2' ' HD3' ' A' ' 63' ' ' LYS . 53.6 mt-10 -107.83 115.04 29.41 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 108.958 -0.756 . . . . 75.25 108.958 -179.75 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 92.2 t -96.34 114.41 33.08 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.688 0 C-N-CA 124.21 1.004 . . . . 75.549999999999997 109.572 -174.482 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -94.62 98.74 11.02 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 108.312 -0.996 . . . . 52.210000000000001 108.312 -177.237 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 90.7 t -93.76 108.23 20.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 N-CA-C 108.693 -0.854 . . . . 73.439999999999998 108.693 -176.948 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -108.04 103.93 13.26 Favored 'General case' 0 C--O 1.216 -0.709 0 N-CA-C 109.065 -0.717 . . . . 74.140000000000001 109.065 179.393 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.514 HD12 ' SD ' ' A' ' 45' ' ' MET . 12.8 tt -107.38 130.19 59.99 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 CA-C-O 121.085 0.469 . . . . 72.230000000000004 111.025 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 11.0 m -99.66 107.66 19.83 Favored 'General case' 0 C--O 1.241 0.61 0 C-N-CA 123.916 0.886 . . . . 75.140000000000001 108.652 177.447 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 37.5 t -130.66 120.31 23.72 Favored 'General case' 0 C--O 1.246 0.899 0 C-N-CA 123.911 0.884 . . . . 75.319999999999993 109.966 -179.024 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 57.9 t30 56.75 53.36 8.39 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.492 1.117 . . . . 60.340000000000003 110.986 178.662 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 68.95 6.87 54.65 Favored Glycine 0 C--N 1.343 0.922 0 CA-C-N 114.85 -1.068 . . . . 71.099999999999994 115.055 174.579 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -117.08 139.67 50.43 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.603 0.761 . . . . 52.240000000000002 110.376 -178.746 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 92.0 m -102.15 118.22 36.43 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.075 0.95 . . . . 62.140000000000001 110.17 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.559 ' HB3' ' NH2' ' A' ' 44' ' ' ARG . 50.4 m-85 -114.28 101.01 8.77 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.123 0.969 . . . . 71.230000000000004 109.0 -178.518 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -116.47 136.85 52.64 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 120.911 0.386 . . . . 71.319999999999993 110.719 178.86 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 51.8 ttt85 -147.43 139.88 24.63 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 123.518 0.727 . . . . 74.5 109.473 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 27.6 m -98.47 108.95 21.77 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 123.91 0.884 . . . . 64.340000000000003 109.671 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -97.37 127.09 43.03 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.094 0.957 . . . . 70.319999999999993 109.339 -176.163 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 26.2 mp0 -87.04 109.33 19.33 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 108.765 -0.828 . . . . 64.109999999999999 108.765 -178.343 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 70.4 mt -113.79 130.45 56.45 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.772 0.829 . . . . 65.099999999999994 109.144 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -121.79 119.06 30.58 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 108.473 -0.936 . . . . 74.239999999999995 108.473 -177.785 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.511 ' HB3' HD23 ' A' ' 33' ' ' LEU . . . -149.45 166.07 30.21 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-O 121.576 0.703 . . . . 71.109999999999999 110.753 177.478 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 41.6 t -106.33 -57.6 4.28 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 CA-C-N 114.38 -1.282 . . . . 65.230000000000004 108.825 176.314 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.663 ' HB2' ' HG3' ' A' ' 32' ' ' GLU . 66.5 mtp180 -87.97 158.29 18.69 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.805 1.242 . . . . 74.109999999999999 109.977 -179.783 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -77.07 -37.12 55.15 Favored 'General case' 0 N--CA 1.493 1.682 0 C-N-CA 124.485 1.114 . . . . 72.530000000000001 110.654 -172.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -64.08 -30.64 71.69 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 114.91 -1.041 . . . . 72.25 111.167 174.112 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.663 ' HG3' ' HB2' ' A' ' 29' ' ' ARG . 49.8 mt-10 -69.35 -23.18 63.72 Favored 'General case' 0 C--N 1.358 0.943 0 C-N-CA 122.161 0.184 . . . . 70.540000000000006 110.698 175.514 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.511 HD23 ' HB3' ' A' ' 27' ' ' ALA . 0.2 OUTLIER -84.24 -34.56 23.83 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-O 119.152 -0.451 . . . . 75.200000000000003 110.1 178.047 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.603 ' HG2' HG23 ' A' ' 80' ' ' ILE . 29.9 mtpt -53.75 -53.52 51.02 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 123.794 0.684 . . . . 62.229999999999997 112.033 -177.982 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.52 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 4.4 pt-20 -50.85 -47.21 60.35 Favored 'General case' 0 N--CA 1.474 0.772 0 O-C-N 124.515 1.135 . . . . 65.219999999999999 111.551 176.503 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 55.3 mttm -63.93 -38.05 89.65 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.415 0.686 . . . . 72.230000000000004 111.365 -173.444 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.456 HD13 HD23 ' A' ' 81' ' ' LEU . 79.8 mt -62.24 -50.48 71.56 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 124.098 0.874 . . . . 74.209999999999994 110.479 175.33 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.423 ' HG2' HG13 ' A' ' 84' ' ' VAL . 7.1 mtpm? -59.72 -34.69 73.25 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.76 0.824 . . . . 74.25 111.535 177.513 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.52 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 32.5 mmmt -65.49 -61.33 2.16 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 123.527 0.517 . . . . 73.030000000000001 110.739 176.152 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 46.4 t -57.6 -39.72 71.2 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.226 0 C-N-CA 124.672 1.189 . . . . 75.319999999999993 111.537 -175.247 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 63.5 mt -63.63 -57.19 10.85 Favored 'General case' 0 C--O 1.217 -0.642 0 CA-C-N 115.732 -0.667 . . . . 75.040000000000006 110.27 175.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -60.5 -26.23 66.68 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 112.58 0.585 . . . . 75.310000000000002 112.58 -179.399 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.4 mm-40 -70.89 -51.86 23.64 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 120.879 0.371 . . . . 73.219999999999999 110.681 174.906 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.559 ' NH2' ' HB3' ' A' ' 19' ' ' TYR . 7.9 tpt180 -76.37 -32.29 58.51 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 115.481 -0.781 . . . . 73.140000000000001 112.139 -172.614 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.514 ' SD ' HD12 ' A' ' 12' ' ' ILE . 97.2 mmm -80.17 -12.8 59.61 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.161 0.584 . . . . 71.209999999999994 111.94 -172.863 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.77 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 9.5 t70 -70.85 -51.7 10.99 Favored Pre-proline 0 CA--C 1.569 1.707 0 CA-C-O 118.525 -0.75 . . . . 62.299999999999997 111.7 -177.901 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -62.04 -23.95 76.2 Favored 'Trans proline' 0 C--N 1.386 2.549 0 C-N-CA 122.031 1.821 . . . . 63.119999999999997 113.927 173.504 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.403 HG21 HD11 ' A' ' 12' ' ' ILE . 46.2 mm -65.27 -37.59 80.51 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 C-N-CA 123.889 0.876 . . . . 74.140000000000001 111.858 -178.32 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.77 ' HE2' ' HA ' ' A' ' 46' ' ' ASP . 45.1 mtmt -62.19 -34.41 76.39 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 122.777 0.431 . . . . 54.109999999999999 110.323 175.375 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -74.86 -29.09 60.92 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.767 0.827 . . . . 54.119999999999997 111.278 177.058 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 82.4 mt -68.28 -23.87 64.81 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 109.476 -0.564 . . . . 64.530000000000001 109.476 173.695 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.56 46.96 5.86 Favored Glycine 0 C--N 1.347 1.168 0 CA-C-N 115.163 -0.926 . . . . 24.109999999999999 112.481 166.314 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 20.8 p -117.03 107.35 14.42 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 123.803 0.841 . . . . 74.450000000000003 108.799 175.231 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -78.0 -12.8 60.02 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 110.293 -0.262 . . . . 71.540000000000006 110.293 177.418 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 37.1 ttt180 -116.7 127.71 54.66 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 108.781 -0.822 . . . . 73.329999999999998 108.781 170.713 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 28.7 m -130.8 142.11 44.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 123.825 0.85 . . . . 70.420000000000002 109.578 178.734 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 42.0 ttm180 -118.0 108.29 15.08 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.434 0.694 . . . . 64.299999999999997 109.819 173.695 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 36.6 mt -105.17 105.76 19.25 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 C-N-CA 124.593 1.157 . . . . 62.020000000000003 109.944 -177.153 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.416 ' HA ' ' O ' ' A' ' 102' ' ' VAL . 29.0 m -96.36 105.5 17.59 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 108.414 -0.958 . . . . 75.010000000000005 108.414 174.305 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 50.8 mt -97.5 125.11 50.7 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 123.017 0.527 . . . . 70.0 110.428 178.877 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 1.4 mpp_? -112.79 121.32 44.35 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 107.243 -1.391 . . . . 72.239999999999995 107.243 178.096 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.4 p -94.59 131.12 42.32 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 N-CA-C 109.563 -0.532 . . . . 55.439999999999998 109.563 -175.429 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.421 ' HD3' ' HB2' ' A' ' 7' ' ' GLU . 53.6 mtpt -95.85 133.3 40.16 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 108.29 -1.004 . . . . 64.129999999999995 108.29 -178.22 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 94.6 m-70 -101.17 155.89 17.75 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 114.009 1.115 . . . . 75.120000000000005 114.009 -161.443 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 34.0 t -69.47 -49.36 55.52 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 113.184 -1.825 . . . . 62.439999999999998 110.863 176.772 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -160.19 162.21 33.77 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 122.682 0.393 . . . . 74.019999999999996 110.688 -177.242 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.32 -37.5 83.49 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.171 0.989 . . . . 74.019999999999996 111.858 177.555 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.17 -39.05 78.96 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.921 -0.581 . . . . 72.209999999999994 111.421 177.86 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -83.01 -25.94 31.7 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 115.322 -0.854 . . . . 75.299999999999997 112.362 -173.78 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -62.58 -36.84 83.98 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 113.204 0.816 . . . . 72.319999999999993 113.204 -167.057 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.504 ' O ' ' HD3' ' A' ' 75' ' ' LYS . 21.3 pttp -67.11 -19.89 65.7 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.941 0.896 . . . . 74.409999999999997 112.139 178.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -86.24 -50.42 6.97 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.029 0.532 . . . . 60.32 110.69 169.312 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -52.44 -48.58 65.69 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 124.427 1.091 . . . . 62.009999999999998 112.132 -173.71 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.88 -49.56 75.74 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.877 0.871 . . . . 61.119999999999997 112.541 -176.387 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.504 ' HD3' ' O ' ' A' ' 71' ' ' LYS . 3.3 mptp? -69.8 -34.12 73.27 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 115.575 -0.738 . . . . 71.200000000000003 111.035 -175.58 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -64.67 -48.04 76.24 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.165 0.586 . . . . 72.0 110.106 171.16 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -70.18 -21.27 63.07 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.481 1.112 . . . . 75.329999999999998 110.111 -173.899 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.487 ' HA ' ' NE1' ' A' ' 97' ' ' TRP . . . -63.72 -48.77 75.71 Favored 'General case' 0 C--N 1.343 0.324 0 C-N-CA 123.955 0.902 . . . . 42.009999999999998 110.722 172.857 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.09 -42.21 85.01 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.573 -0.739 . . . . 44.130000000000003 111.021 176.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.603 HG23 ' HG2' ' A' ' 34' ' ' LYS . 44.0 mm -58.73 -50.33 79.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 123.966 0.907 . . . . 62.439999999999998 110.797 179.633 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.456 HD23 HD13 ' A' ' 37' ' ' LEU . 23.3 mt -68.12 -36.85 80.4 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 122.928 0.491 . . . . 74.129999999999995 111.883 179.027 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -59.74 -36.96 77.67 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.295 0.638 . . . . 75.319999999999993 110.21 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -71.98 -48.55 44.12 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 115.332 -0.849 . . . . 75.019999999999996 111.119 175.069 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.479 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 23.2 t -58.76 -55.33 23.82 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 C-N-CA 123.989 0.916 . . . . 74.510000000000005 111.323 -174.307 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.448 ' CE2' HG21 ' A' ' 104' ' ' VAL . 55.3 m-85 -59.89 -36.43 76.94 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 123.929 0.768 . . . . 64.209999999999994 112.231 179.257 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -71.19 -24.18 62.18 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 122.941 0.496 . . . . 75.109999999999999 111.858 178.669 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -84.8 -5.78 59.34 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.824 0.85 . . . . 70.310000000000002 111.004 175.291 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 68.4 mt -105.41 -31.06 9.2 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 122.701 0.4 . . . . 41.119999999999997 110.873 -179.578 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 143.6 -10.77 2.17 Favored Glycine 0 C--N 1.348 1.234 0 CA-C-O 119.404 -0.665 . . . . 64.109999999999999 114.287 177.864 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.443 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 97.1 m-85 -74.75 126.56 31.16 Favored 'General case' 0 N--CA 1.484 1.229 0 CA-C-N 118.271 1.036 . . . . 73.140000000000001 110.682 176.796 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -95.62 91.72 6.27 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.494 0.718 . . . . 75.109999999999999 111.333 -174.023 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 20.8 t70 54.8 -81.19 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 124.819 1.247 . . . . 73.040000000000006 113.989 165.642 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 20.1 m -66.73 -13.8 61.8 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 124.172 0.989 . . . . 50.210000000000001 113.144 -175.788 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ASN . . . . . 0.459 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 10.6 m120 -55.37 -37.44 67.53 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.175 0.59 . . . . 73.510000000000005 110.671 168.506 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 45.1 t -99.03 118.32 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 125.137 1.375 . . . . 71.450000000000003 110.092 -174.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 45.5 m -144.69 128.05 16.87 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-N 118.442 0.565 . . . . 73.510000000000005 110.568 173.661 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.487 ' NE1' ' HA ' ' A' ' 78' ' ' ALA . 27.7 m95 -87.17 152.49 22.28 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 124.129 0.971 . . . . 73.409999999999997 111.513 -179.317 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -159.72 92.76 1.05 Allowed 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.139 0.975 . . . . 73.030000000000001 109.036 177.528 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 59.25 58.54 13.92 Favored Glycine 0 C--N 1.346 1.105 0 CA-C-N 115.887 -0.597 . . . . 73.25 113.501 177.273 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 71.03 3.41 4.64 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 124.88 1.272 . . . . 61.409999999999997 113.055 179.387 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 37.7 m -119.59 110.75 17.23 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 108.916 -0.772 . . . . 74.239999999999995 108.916 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' VAL . . . . . 0.416 ' O ' ' HA ' ' A' ' 59' ' ' SER . 6.9 p -99.76 119.8 48.3 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 N-CA-C 109.471 -0.566 . . . . 72.129999999999995 109.471 179.842 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 87.0 m -92.35 104.4 16.75 Favored 'General case' 0 C--O 1.241 0.634 0 N-CA-C 108.221 -1.029 . . . . 73.150000000000006 108.221 176.512 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.459 ' HA ' ' O ' ' A' ' 94' ' ' ASN . 48.8 t -108.48 109.49 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 C-N-CA 124.234 1.013 . . . . 72.349999999999994 108.37 179.056 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -135.76 147.24 48.32 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 122.465 0.306 . . . . 62.32 110.269 -176.297 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' GLY . . . . . 0.413 ' HA3' ' ND2' ' A' ' 94' ' ' ASN . . . 168.27 -160.39 33.9 Favored Glycine 0 C--O 1.245 0.782 0 CA-C-N 115.825 -0.625 . . . . 72.120000000000005 112.338 -177.9 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 27.2 pt20 . . . . . 0 CA--C 1.55 0.964 0 CA-C-O 121.758 0.789 . . . . 70.340000000000003 111.623 -174.775 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.9 mmmm . . . . . 0 C--O 1.24 0.604 0 CA-C-O 121.221 0.534 . . . . 72.140000000000001 110.975 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.52 ' HA ' ' HA ' ' A' ' 26' ' ' TYR . 40.5 ttpt -83.05 110.9 18.39 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 106.89 -1.522 . . . . 74.439999999999998 106.89 166.591 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.539 HG21 HG22 ' A' ' 62' ' ' VAL . 7.2 p -98.21 149.91 5.05 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 N-CA-C 108.87 -0.789 . . . . 74.099999999999994 108.87 -176.101 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.446 ' HB3' HG22 ' A' ' 22' ' ' THR . 37.2 mt-10 -109.85 113.19 25.73 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 108.988 -0.745 . . . . 72.409999999999997 108.988 -176.002 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 79.5 t -100.71 118.24 47.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 C-N-CA 124.614 1.166 . . . . 73.430000000000007 109.333 -176.729 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 68.0 mt-30 -96.84 102.48 14.27 Favored 'General case' 0 C--O 1.24 0.588 0 N-CA-C 108.034 -1.099 . . . . 75.430000000000007 108.034 -178.697 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.433 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 48.2 t -93.67 104.65 15.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 N-CA-C 108.442 -0.947 . . . . 44.43 108.442 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -108.17 105.17 14.78 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.946 0.898 . . . . 71.349999999999994 109.009 -175.875 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.546 HD13 HG13 ' A' ' 48' ' ' ILE . 17.6 tt -123.41 118.4 54.36 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-O 121.256 0.551 . . . . 74.109999999999999 110.973 -178.337 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 21.8 m -95.01 121.03 36.21 Favored 'General case' 0 C--O 1.242 0.703 0 N-CA-C 108.676 -0.861 . . . . 64.109999999999999 108.676 177.878 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.422 ' SG ' HG23 ' A' ' 48' ' ' ILE . 26.3 t -145.26 141.92 29.04 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 124.213 1.005 . . . . 62.43 109.756 -178.945 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 46.6 t-20 72.03 -74.02 0.09 Allowed 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 125.182 1.393 . . . . 72.519999999999996 109.471 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -168.2 11.56 0.06 OUTLIER Glycine 0 C--N 1.338 0.662 0 N-CA-C 111.024 -0.83 . . . . 53.039999999999999 111.024 172.018 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 27.8 mmmt -122.3 138.29 54.56 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 124.743 1.217 . . . . 65.400000000000006 109.368 -175.809 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 53.7 m -98.09 122.78 41.65 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 108.819 -0.808 . . . . 63.539999999999999 108.819 174.525 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -106.13 101.47 10.95 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 107.106 -1.442 . . . . 73.329999999999998 107.106 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.433 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 12.8 pt-20 -130.7 141.75 50.41 Favored 'General case' 0 C--O 1.241 0.619 0 CA-C-O 121.217 0.532 . . . . 71.140000000000001 110.17 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 57.9 ttt85 -155.29 148.01 24.28 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 114.805 -1.089 . . . . 74.519999999999996 108.497 174.294 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.446 HG22 ' HB3' ' A' ' 7' ' ' GLU . 22.4 m -93.38 108.69 20.31 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.88 0.872 . . . . 74.030000000000001 108.926 177.694 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 80.3 m-85 -98.76 132.14 44.36 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.121 0.968 . . . . 64.140000000000001 110.169 -174.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.426 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 1.9 mp0 -88.96 107.59 19.11 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 108.365 -0.976 . . . . 61.130000000000003 108.365 178.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 33.5 mt -112.06 106.82 15.56 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.119 0.967 . . . . 73.319999999999993 109.288 179.83 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.52 ' HA ' ' HA ' ' A' ' 5' ' ' LYS . 55.0 t80 -81.07 128.16 33.42 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.165 0.586 . . . . 73.439999999999998 109.844 176.961 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.427 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -141.19 147.88 39.07 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.182 0.593 . . . . 73.030000000000001 110.461 174.096 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 58.7 t -84.85 -40.23 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 CA-C-N 115.645 -0.707 . . . . 53.25 109.163 172.07 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.53 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 40.0 mtt180 -120.16 162.49 19.26 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 115.043 -0.98 . . . . 74.420000000000002 109.841 -178.166 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -63.56 -38.01 89.52 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 115.133 -0.939 . . . . 64.209999999999994 110.797 171.564 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -65.91 -27.49 68.23 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.942 0.897 . . . . 65.209999999999994 111.781 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.53 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 12.4 mm-40 -68.0 -39.13 83.3 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 122.399 0.28 . . . . 72.409999999999997 110.362 177.682 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.572 HD22 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -66.11 -20.19 66.08 Favored 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 123.583 0.753 . . . . 71.5 110.986 -175.136 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.1 mtpp -54.03 -62.97 1.31 Allowed 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.661 0.785 . . . . 73.329999999999998 111.994 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.554 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 2.5 pp20? -65.0 -30.37 71.36 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 116.107 -0.497 . . . . 73.530000000000001 111.471 -176.785 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.572 ' HD2' HD22 ' A' ' 33' ' ' LEU . 53.8 mttm -64.42 -41.69 96.47 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.665 0.786 . . . . 65.400000000000006 110.495 178.691 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.437 HD13 HD23 ' A' ' 81' ' ' LEU . 74.4 mt -56.31 -52.75 63.37 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 124.014 0.821 . . . . 43.130000000000003 109.746 171.885 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.2 mtpm? -56.77 -37.79 71.57 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 124.121 0.888 . . . . 64.209999999999994 112.004 -178.802 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.554 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 29.9 mmtp -61.84 -55.29 31.45 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 122.948 0.499 . . . . 74.140000000000001 110.137 177.105 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 92.7 t -64.55 -34.11 67.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-N 115.008 -0.997 . . . . 73.319999999999993 111.422 -176.468 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.462 HD21 HD11 ' A' ' 60' ' ' ILE . 64.2 mt -72.4 -41.0 66.78 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.358 0.663 . . . . 74.299999999999997 111.023 -177.17 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.8 m-80 -64.94 -40.38 94.95 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 122.356 0.262 . . . . 70.310000000000002 111.109 174.579 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 47.7 mm-40 -65.95 -46.81 76.78 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.262 0.625 . . . . 64.519999999999996 111.4 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? -69.58 -39.26 77.45 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.35 0.66 . . . . 74.25 111.54 -177.631 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.476 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 54.3 mtp -88.45 -7.91 55.81 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 113.169 0.803 . . . . 74.099999999999994 113.169 -175.63 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -63.27 -51.47 68.59 Favored Pre-proline 0 CA--C 1.569 1.693 0 CA-C-O 118.548 -0.739 . . . . 73.299999999999997 111.573 178.048 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -66.49 -23.28 50.58 Favored 'Trans proline' 0 C--N 1.398 3.181 0 C-N-CA 122.383 2.056 . . . . 74.329999999999998 112.801 175.747 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.546 HG13 HD13 ' A' ' 12' ' ' ILE . 51.2 mm -67.07 -29.98 47.95 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 C-N-CA 124.148 0.979 . . . . 71.439999999999998 110.077 179.693 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.476 ' HG3' ' O ' ' A' ' 45' ' ' MET . 92.7 mttt -70.02 -34.5 73.37 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 115.272 -0.877 . . . . 74.439999999999998 110.6 175.625 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.4 ttmp? -74.24 -26.64 60.35 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.088 0.555 . . . . 71.450000000000003 111.319 178.201 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 88.8 mt -70.99 -45.01 64.76 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 108.995 -0.743 . . . . 62.329999999999998 108.995 172.72 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 88.21 17.87 56.64 Favored Glycine 0 C--N 1.342 0.903 0 CA-C-N 115.392 -0.822 . . . . 63.140000000000001 114.671 171.133 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.537 ' SG ' HG12 ' A' ' 56' ' ' VAL . 6.6 p -62.04 122.45 15.54 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 123.602 0.761 . . . . 70.109999999999999 110.131 175.209 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm -62.65 -57.15 12.06 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.212 0.605 . . . . 75.129999999999995 110.445 -177.189 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 33.5 ttp180 -103.48 128.23 50.71 Favored 'General case' 0 C--N 1.345 0.384 0 CA-C-N 115.504 -0.771 . . . . 71.540000000000006 109.11 176.898 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.537 HG12 ' SG ' ' A' ' 53' ' ' CYS . 34.5 m -116.08 142.96 27.32 Favored 'Isoleucine or valine' 0 C--O 1.244 0.785 0 C-N-CA 123.62 0.768 . . . . 75.319999999999993 109.437 176.467 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -100.42 103.1 14.46 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 108.52 -0.918 . . . . 73.049999999999997 108.52 177.497 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 36.9 mt -102.09 140.07 21.56 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 N-CA-C 107.994 -1.113 . . . . 64.030000000000001 107.994 179.065 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 32.4 t -141.9 104.24 4.47 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 107.327 -1.36 . . . . 60.32 107.327 175.74 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.462 HD11 HD21 ' A' ' 41' ' ' LEU . 78.2 mt -103.26 107.55 22.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 N-CA-C 108.511 -0.922 . . . . 74.310000000000002 108.511 -178.308 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 28.0 ttt180 -102.27 131.79 48.62 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 108.518 -0.919 . . . . 71.019999999999996 108.518 173.601 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.539 HG22 HG21 ' A' ' 6' ' ' VAL . 8.0 p -95.04 139.2 19.16 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 N-CA-C 106.979 -1.489 . . . . 75.129999999999995 106.979 174.709 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -82.77 136.99 34.52 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-O 121.134 0.492 . . . . 73.25 109.872 -175.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' HIS . . . . . 0.57 ' HB3' ' HG3' ' A' ' 70' ' ' GLU . 73.7 m80 -105.43 127.61 53.08 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 124.47 1.108 . . . . 61.329999999999998 109.397 -169.498 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 23.3 t -83.35 -47.81 11.07 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.643 0.777 . . . . 64.230000000000004 111.481 -171.631 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -109.29 -105.04 0.36 Allowed 'General case' 0 CA--C 1.56 1.329 0 C-N-CA 123.439 0.696 . . . . 74.230000000000004 109.998 -175.027 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.405 ' O ' ' HG2' ' A' ' 71' ' ' LYS . . . 176.71 -60.25 0.01 OUTLIER 'General case' 0 C--N 1.362 1.111 0 C-N-CA 125.351 1.46 . . . . 75.540000000000006 107.9 -177.883 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.27 -42.79 68.31 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 115.436 -0.802 . . . . 73.519999999999996 110.419 178.679 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -62.19 -36.04 80.69 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 115.572 -0.74 . . . . 43.420000000000002 110.461 173.261 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.57 ' HG3' ' HB3' ' A' ' 64' ' ' HIS . 41.5 mm-40 -73.2 -22.61 60.42 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.23 0.612 . . . . 71.140000000000001 112.137 -175.024 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.405 ' HG2' ' O ' ' A' ' 67' ' ' ALA . 3.1 mmmp? -63.39 -33.58 75.85 Favored 'General case' 0 N--CA 1.483 1.187 0 CA-C-O 121.285 0.564 . . . . 73.0 110.128 172.441 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 34.1 ttpt -84.29 -46.0 12.25 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.764 1.226 . . . . 71.340000000000003 110.96 177.861 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -80.5 -30.81 37.3 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 112.873 0.694 . . . . 70.430000000000007 112.873 -168.293 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -78.62 -30.6 46.58 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 122.594 0.358 . . . . 73.400000000000006 110.279 175.781 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 51.9 tttm -63.39 -40.5 97.39 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.618 0.767 . . . . 61.5 110.201 168.31 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -67.19 -40.69 86.57 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.693 0.797 . . . . 71.430000000000007 110.384 175.054 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -76.47 -19.04 58.43 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.984 0.914 . . . . 72.120000000000005 110.588 -175.215 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.2 -45.74 83.5 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.286 0.634 . . . . 40.530000000000001 110.448 173.221 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.69 -34.17 75.28 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.54 -0.755 . . . . 74.129999999999995 111.255 176.584 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 46.4 mm -67.68 -50.72 58.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 123.86 0.864 . . . . 74.099999999999994 110.918 -179.249 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.437 HD23 HD13 ' A' ' 37' ' ' LEU . 34.4 mt -66.11 -50.72 63.07 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 123.625 0.578 . . . . 72.340000000000003 110.174 -176.154 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -56.89 -41.29 77.78 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 124.029 0.932 . . . . 64.349999999999994 111.543 -177.155 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 19.7 mmmt -64.96 -44.71 88.5 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 123.76 0.663 . . . . 74.349999999999994 111.255 176.735 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.419 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 25.0 t -62.61 -44.7 99.62 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 C-N-CA 123.017 0.527 . . . . 64.200000000000003 110.124 -176.887 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.558 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 20.6 m-85 -60.77 -42.3 97.2 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 124.091 0.869 . . . . 74.420000000000002 110.273 177.741 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.39 -34.13 77.07 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.529 0.731 . . . . 73.510000000000005 111.331 177.558 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -81.27 -8.02 59.67 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.022 0.929 . . . . 74.25 110.85 -178.841 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 93.1 mt -107.22 -9.77 16.01 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.821 0.848 . . . . 70.010000000000005 110.397 176.802 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 109.4 -5.73 31.65 Favored Glycine 0 N--CA 1.478 1.485 0 N-CA-C 114.096 0.399 . . . . 50.140000000000001 114.096 175.83 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.619 ' HB3' HD21 ' A' ' 94' ' ' ASN . 9.9 m-85 -79.66 138.85 37.51 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.374 0.67 . . . . 63.130000000000003 109.438 179.048 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 28.3 m-80 -96.53 168.77 10.34 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.548 0.739 . . . . 71.230000000000004 111.735 -176.167 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -54.45 -45.46 73.11 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.926 1.29 . . . . 75.430000000000007 111.041 177.687 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 23.9 m -57.48 -46.45 83.69 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 124.71 1.204 . . . . 61.310000000000002 113.424 -173.389 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ASN . . . . . 0.619 HD21 ' HB3' ' A' ' 90' ' ' TYR . 3.7 p-10 -83.05 -11.24 58.23 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 122.743 0.417 . . . . 51.350000000000001 111.675 -177.111 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 97.0 t -88.6 102.1 12.48 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 N-CA-C 107.956 -1.127 . . . . 51.5 107.956 172.031 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 22.7 m -108.25 103.78 13.03 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.572 0.749 . . . . 64.140000000000001 110.458 -173.749 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 43.0 m95 -79.94 150.48 30.5 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.347 0.659 . . . . 74.109999999999999 111.65 178.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -144.28 69.88 1.28 Allowed 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 106.966 -1.494 . . . . 72.310000000000002 106.966 170.718 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 52.37 -82.4 0.01 OUTLIER Glycine 0 C--N 1.361 1.955 0 CA-C-N 114.156 -1.384 . . . . 41.119999999999997 114.777 179.483 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -72.55 -39.1 67.75 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 126.041 1.736 . . . . 34.039999999999999 112.776 -174.759 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 35.6 m -131.4 149.65 52.46 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.754 0.822 . . . . 50.43 110.475 -174.422 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 7.4 p -116.82 137.98 48.93 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 C-N-CA 123.329 0.652 . . . . 75.040000000000006 110.361 176.144 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 39.4 m -114.28 108.76 17.36 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.864 1.266 . . . . 71.010000000000005 109.073 176.322 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.4 t -101.04 119.69 49.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 C-N-CA 123.406 0.682 . . . . 73.430000000000007 109.475 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -86.32 113.07 22.01 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 107.333 -1.358 . . . . 75.219999999999999 107.333 171.724 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -105.02 167.31 14.99 Favored Glycine 0 C--N 1.34 0.804 0 N-CA-C 111.815 -0.514 . . . . 43.530000000000001 111.815 -176.693 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.241 0.633 0 C-N-CA 123.79 0.836 . . . . 65.030000000000001 110.179 -175.29 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.7 tppp? . . . . . 0 C--O 1.24 0.593 0 CA-C-O 120.802 0.334 . . . . 72.450000000000003 110.126 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 26.8 ttpt -85.94 111.07 19.9 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-N 115.436 -0.802 . . . . 72.310000000000002 109.12 174.804 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.4 p -99.66 142.38 15.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 N-CA-C 108.122 -1.066 . . . . 61.219999999999999 108.122 171.588 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.548 ' HB3' HG22 ' A' ' 22' ' ' THR . 50.2 mt-10 -113.71 118.91 35.65 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 109.521 -0.548 . . . . 41.119999999999997 109.521 177.507 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 59.2 t -106.75 116.02 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 124.429 1.092 . . . . 62.109999999999999 109.688 -171.166 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.409 ' O ' ' HA ' ' A' ' 60' ' ' ILE . 43.4 tt0 -92.26 102.7 15.2 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 107.987 -1.116 . . . . 54.43 107.987 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 98.0 t -96.89 102.71 13.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 N-CA-C 108.317 -0.994 . . . . 73.349999999999994 108.317 178.401 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.497 ' HA ' ' HB3' ' A' ' 20' ' ' GLU . 22.1 ttmm -104.22 103.56 13.34 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 108.573 -0.899 . . . . 72.109999999999999 108.573 -178.119 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.494 HD13 HG13 ' A' ' 48' ' ' ILE . 11.8 tt -112.55 124.21 69.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 CA-C-O 121.069 0.462 . . . . 75.450000000000003 109.943 179.419 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 11.9 m -98.04 113.5 25.39 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.615 0.766 . . . . 75.340000000000003 109.247 178.386 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.596 ' SG ' HG23 ' A' ' 48' ' ' ILE . 18.4 t -153.81 150.6 28.63 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.914 1.286 . . . . 53.240000000000002 108.849 179.77 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.525 ' HB2' HD13 ' A' ' 51' ' ' LEU . 62.5 t30 69.82 12.77 8.02 Favored 'General case' 0 N--CA 1.504 2.261 0 C-N-CA 124.273 1.029 . . . . 70.439999999999998 111.295 178.715 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 77.94 4.86 86.39 Favored Glycine 0 C--N 1.349 1.291 0 CA-C-N 116.414 -0.357 . . . . 53.219999999999999 112.319 -171.625 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.4 mmpt? -113.53 165.78 12.15 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.583 1.153 . . . . 73.209999999999994 109.526 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 39.8 m -119.36 115.66 24.59 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 109.281 -0.637 . . . . 71.099999999999994 109.281 174.296 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -103.62 106.22 16.67 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 107.131 -1.433 . . . . 73.140000000000001 107.131 -179.4 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.497 ' HB3' ' HA ' ' A' ' 11' ' ' LYS . 16.9 pt-20 -143.29 161.6 37.88 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.523 0.678 . . . . 71.200000000000003 112.212 -176.032 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 35.6 ttm180 -167.21 148.24 5.66 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-N 113.764 -1.562 . . . . 74.519999999999996 108.063 176.635 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.548 HG22 ' HB3' ' A' ' 7' ' ' GLU . 27.8 m -92.37 112.99 25.13 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 107.337 -1.357 . . . . 52.240000000000002 107.337 169.651 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 -97.51 127.26 43.33 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.062 0.945 . . . . 74.040000000000006 109.902 -173.419 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -83.85 106.07 15.24 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 107.502 -1.296 . . . . 73.540000000000006 107.502 178.018 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 81.5 mt -112.98 119.95 39.69 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.292 1.037 . . . . 71.230000000000004 108.337 -179.468 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -109.1 118.81 37.73 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 109.024 -0.732 . . . . 75.540000000000006 109.024 -177.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -124.84 150.91 45.92 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.269 0.628 . . . . 50.140000000000001 110.098 178.438 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 44.9 t -95.01 -26.31 4.39 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 C-N-CA 123.881 0.872 . . . . 75.109999999999999 109.489 175.128 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.6 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 90.3 mtt180 -131.72 157.03 44.86 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 108.158 -1.052 . . . . 73.010000000000005 108.158 174.88 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -67.67 -32.96 74.0 Favored 'General case' 0 N--CA 1.488 1.427 0 CA-C-O 121.239 0.542 . . . . 64.140000000000001 111.012 -178.243 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -70.2 -21.35 63.04 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.138 0.975 . . . . 73.420000000000002 111.343 -179.421 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.6 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 27.6 mm-40 -68.93 -23.7 64.19 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 122.875 0.47 . . . . 73.010000000000005 110.813 174.8 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.61 HD22 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -73.18 -19.29 61.14 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 123.238 0.615 . . . . 65.209999999999994 111.217 -177.386 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -54.86 -59.19 5.06 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.682 0.793 . . . . 74.329999999999998 111.573 178.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -57.5 -36.37 71.45 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.847 0.859 . . . . 54.329999999999998 112.487 -177.769 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.61 ' HD2' HD22 ' A' ' 33' ' ' LEU . 62.0 mttm -67.25 -46.09 74.77 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.298 -0.865 . . . . 73.420000000000002 109.912 -177.327 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.479 HD13 HD23 ' A' ' 81' ' ' LEU . 95.9 mt -65.63 -40.04 92.12 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.411 0.684 . . . . 63.409999999999997 111.874 177.767 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 60.2 mtpt -59.47 -42.44 92.06 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 122.929 0.492 . . . . 62.119999999999997 110.697 177.336 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 34.1 mmtm -67.64 -57.21 6.82 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 123.506 0.504 . . . . 74.200000000000003 111.268 176.79 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 53.0 t -56.07 -44.51 78.9 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.94 0 C-N-CA 123.213 0.605 . . . . 74.109999999999999 111.508 -175.585 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.47 HD21 HD11 ' A' ' 60' ' ' ILE . 83.8 mt -68.99 -59.82 2.79 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.003 0.521 . . . . 70.239999999999995 111.311 179.407 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 60.8 t30 -60.69 -38.42 84.92 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 123.415 0.686 . . . . 70.150000000000006 112.173 -172.883 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 -80.17 -32.55 38.77 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.366 0.666 . . . . 63.350000000000001 111.921 -177.322 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 4.5 tpt180 -68.74 -33.83 74.57 Favored 'General case' 0 N--CA 1.486 1.358 0 CA-C-O 121.318 0.58 . . . . 74.430000000000007 109.506 172.227 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.528 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 58.2 mtp -86.64 -6.35 58.88 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.295 -0.866 . . . . 72.219999999999999 112.058 178.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -63.19 -51.08 72.05 Favored Pre-proline 0 CA--C 1.565 1.549 0 CA-C-O 118.814 -0.612 . . . . 73.510000000000005 111.723 178.197 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -66.72 -22.31 50.23 Favored 'Trans proline' 0 C--N 1.384 2.422 0 C-N-CA 121.423 1.415 . . . . 62.43 112.263 172.096 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.596 HG23 ' SG ' ' A' ' 14' ' ' CYS . 45.3 mm -71.82 -27.13 26.91 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 123.552 0.741 . . . . 71.420000000000002 110.354 179.13 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.528 ' HG3' ' O ' ' A' ' 45' ' ' MET . 90.1 mttt -71.08 -36.58 72.29 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.474 0.71 . . . . 70.319999999999993 110.348 174.513 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.33 -32.73 70.58 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 123.561 0.744 . . . . 63.409999999999997 109.335 175.545 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.525 HD13 ' HB2' ' A' ' 15' ' ' ASN . 92.9 mt -70.07 -34.42 73.17 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 109.655 -0.498 . . . . 54.43 109.655 175.176 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 73.83 45.62 26.72 Favored Glycine 0 C--N 1.342 0.871 0 CA-C-N 115.513 -0.767 . . . . 61.509999999999998 113.285 176.835 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 49.9 m -76.0 112.74 12.75 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 108.918 -0.771 . . . . 73.109999999999999 108.918 169.547 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -58.52 -33.06 69.43 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.254 1.021 . . . . 70.040000000000006 111.084 -179.566 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 43.9 ttp180 -145.7 143.79 29.98 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.452 1.101 . . . . 75.239999999999995 108.489 177.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.476 ' O ' ' HA ' ' A' ' 105' ' ' GLU . 28.7 m -131.42 147.88 32.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 123.953 0.901 . . . . 55.219999999999999 109.488 179.371 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 52.3 ttt85 -102.7 107.22 18.03 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 108.812 -0.81 . . . . 71.450000000000003 108.812 175.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 37.9 mt -107.6 107.91 23.93 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 C-N-CA 123.371 0.668 . . . . 63.340000000000003 109.641 -177.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 18.2 m -98.75 105.67 17.84 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 108.479 -0.934 . . . . 74.430000000000007 108.479 174.803 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.47 HD11 HD21 ' A' ' 41' ' ' LEU . 71.8 mt -100.3 134.27 40.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 123.129 0.572 . . . . 62.009999999999998 109.481 177.908 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 21.9 mtm180 -128.37 136.53 51.06 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.564 0.746 . . . . 55.329999999999998 109.544 174.397 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.7 p -95.78 137.22 24.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 123.542 0.737 . . . . 61.299999999999997 109.203 178.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.419 ' HB3' ' H ' ' A' ' 7' ' ' GLU . 63.8 tttm -83.16 114.8 21.58 Favored 'General case' 0 C--O 1.244 0.798 0 N-CA-C 107.602 -1.258 . . . . 54.240000000000002 107.602 174.527 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' HIS . . . . . 0.597 ' HA ' ' HG2' ' A' ' 73' ' ' GLU . 21.6 m170 -69.71 132.97 46.96 Favored 'General case' 0 C--O 1.234 0.258 0 O-C-N 123.885 0.741 . . . . 73.430000000000007 110.132 -172.214 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 19.7 t -57.04 -52.34 65.65 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 123.836 0.854 . . . . 51.240000000000002 111.529 -179.533 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.603 ' H ' ' HB2' ' A' ' 69' ' ' GLU . 21.8 m-20 -144.99 179.69 7.18 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 124.306 1.043 . . . . 61.509999999999998 109.576 -178.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.26 -51.28 64.36 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.974 0.91 . . . . 71.219999999999999 111.085 176.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.17 -26.27 68.09 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.473 0.709 . . . . 63.520000000000003 111.421 177.896 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.603 ' HB2' ' H ' ' A' ' 66' ' ' ASP . 30.9 mm-40 -73.97 -30.2 62.38 Favored 'General case' 0 C--O 1.204 -1.327 0 CA-C-O 118.136 -0.935 . . . . 71.409999999999997 112.516 179.147 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -49.48 -47.89 48.2 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 114.166 1.173 . . . . 74.400000000000006 114.166 -168.463 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 40.9 mtmt -69.2 -39.71 78.47 Favored 'General case' 0 N--CA 1.479 0.975 0 CA-C-N 115.477 -0.783 . . . . 53.219999999999999 110.585 -177.335 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -69.54 -33.66 73.1 Favored 'General case' 0 C--O 1.212 -0.914 0 CA-C-N 114.581 -1.191 . . . . 74.230000000000004 110.225 175.625 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.597 ' HG2' ' HA ' ' A' ' 64' ' ' HIS . 10.1 tp10 -73.16 -39.32 65.74 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.953 1.301 . . . . 73.420000000000002 110.376 -166.78 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.23 -53.46 56.9 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 115.304 -0.862 . . . . 63.130000000000003 110.841 173.288 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 59.0 mttp -66.44 -39.47 88.93 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 124.396 1.078 . . . . 70.200000000000003 112.447 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -58.32 -54.58 45.45 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 125.387 1.475 . . . . 63.32 109.815 -179.12 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -73.37 -26.5 61.03 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 113.45 -1.705 . . . . 74.540000000000006 110.371 -177.692 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.4 -44.66 90.61 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.433 0.693 . . . . 73.340000000000003 111.076 175.633 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.51 -43.13 99.42 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.351 0.66 . . . . 50.030000000000001 111.219 178.268 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 49.0 mm -66.45 -44.29 90.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 CA-C-N 115.866 -0.606 . . . . 72.510000000000005 110.756 178.166 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.479 HD23 HD13 ' A' ' 37' ' ' LEU . 32.1 mt -64.7 -36.98 86.02 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.368 0.667 . . . . 63.409999999999997 110.975 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -55.53 -44.26 76.51 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.215 1.006 . . . . 54.219999999999999 110.233 179.238 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.421 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 33.7 mmtp -68.05 -45.09 74.89 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 114.841 -1.072 . . . . 75.519999999999996 110.961 177.562 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 77.5 t -66.87 -45.75 86.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 123.312 0.645 . . . . 73.219999999999999 111.151 -172.109 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.467 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 24.1 m-85 -60.75 -38.48 85.34 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.214 0.606 . . . . 72.450000000000003 110.718 176.145 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.32 -28.22 67.81 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.105 0.562 . . . . 65.239999999999995 111.485 176.103 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.421 ' HG3' ' O ' ' A' ' 83' ' ' LYS . 45.0 mt-10 -82.07 -14.96 55.06 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.538 0.735 . . . . 75.219999999999999 110.645 176.912 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 97.2 mt -107.34 -2.77 20.31 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.77 0.828 . . . . 73.420000000000002 110.846 -178.285 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 82.01 19.21 65.64 Favored Glycine 0 C--N 1.348 1.245 0 N-CA-C 114.503 0.561 . . . . 71.430000000000007 114.503 175.58 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.467 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 14.6 m-85 -89.39 137.68 32.11 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 109.419 -0.586 . . . . 71.129999999999995 109.419 173.084 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -80.51 150.69 29.55 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.57 0.748 . . . . 74.530000000000001 110.189 -176.3 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -67.37 -31.63 72.0 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.903 0.881 . . . . 71.329999999999998 112.11 -176.39 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 16.8 m -58.42 -27.02 63.92 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.123 0.569 . . . . 72.25 112.224 174.318 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 42.1 m-20 -75.6 -22.34 57.0 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.071 0.549 . . . . 70.420000000000002 111.116 178.821 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.515 ' HA ' HG22 ' A' ' 104' ' ' VAL . 47.9 t -91.16 105.84 16.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 124.335 1.054 . . . . 71.239999999999995 109.616 -171.395 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 19.3 m -129.75 112.84 14.02 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.059 0.544 . . . . 71.409999999999997 111.318 -174.512 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 65.5 m95 -87.34 119.34 27.51 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.683 0.793 . . . . 72.120000000000005 111.351 177.429 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -137.85 115.06 10.97 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.437 1.095 . . . . 71.430000000000007 108.64 172.127 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 64.26 43.7 96.62 Favored Glycine 0 C--N 1.351 1.404 0 O-C-N 124.05 0.844 . . . . 71.340000000000003 113.63 175.814 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 63.07 17.55 10.23 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 124.97 1.308 . . . . 74.519999999999996 111.672 179.233 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 25.4 m -118.56 119.78 35.53 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 107.087 -1.449 . . . . 71.030000000000001 107.087 175.912 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' VAL . . . . . 0.409 HG11 HD13 ' A' ' 81' ' ' LEU . 7.7 p -99.04 115.65 40.13 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 N-CA-C 109.013 -0.736 . . . . 75.319999999999993 109.013 178.188 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 41.7 m -94.52 118.52 31.79 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 107.913 -1.143 . . . . 70.430000000000007 107.913 177.771 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.515 HG22 ' HA ' ' A' ' 95' ' ' VAL . 55.9 t -128.54 114.97 35.73 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 C-N-CA 123.994 0.917 . . . . 74.310000000000002 108.609 -178.236 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' GLU . . . . . 0.476 ' HA ' ' O ' ' A' ' 56' ' ' VAL . 3.4 mp0 -85.1 110.95 19.33 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 108.007 -1.109 . . . . 73.549999999999997 108.007 171.219 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -104.11 148.14 16.77 Favored Glycine 0 C--N 1.337 0.629 0 N-CA-C 109.747 -1.341 . . . . 64.25 109.747 179.313 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 . . . . . 0 C--O 1.241 0.658 0 CA-C-O 121.216 0.531 . . . . 71.230000000000004 110.518 -173.61 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.53 ' HA ' ' HE3' ' A' ' 4' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.239 0.513 0 CA-C-O 120.956 0.408 . . . . 75.400000000000006 110.801 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.515 ' HA ' ' HA ' ' A' ' 26' ' ' TYR . 5.7 ttpm? -88.8 105.35 17.67 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 107.241 -1.392 . . . . 71.150000000000006 107.241 162.316 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.8 p -97.1 143.18 12.9 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 N-CA-C 108.901 -0.777 . . . . 74.450000000000003 108.901 -178.43 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.52 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 49.6 mt-10 -106.97 111.71 24.33 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 108.107 -1.072 . . . . 63.409999999999997 108.107 176.109 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 95.7 t -101.17 116.27 44.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 C-N-CA 124.773 1.229 . . . . 74.519999999999996 108.952 -175.351 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -96.64 101.34 12.93 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 107.982 -1.118 . . . . 72.299999999999997 107.982 -178.78 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 84.6 t -93.69 108.11 20.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 N-CA-C 108.434 -0.95 . . . . 54.25 108.434 179.127 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.401 ' HG3' ' HB3' ' A' ' 20' ' ' GLU . 39.4 ttmt -108.07 137.81 45.42 Favored 'General case' 0 C--O 1.224 -0.255 0 C-N-CA 124.748 1.219 . . . . 72.120000000000005 107.718 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.484 HD13 HG13 ' A' ' 48' ' ' ILE . 11.9 tt -143.98 136.57 23.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 CA-C-N 118.405 0.548 . . . . 73.349999999999994 110.966 176.642 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 28.0 m -101.9 120.48 40.47 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 108.66 -0.867 . . . . 71.120000000000005 108.66 173.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.614 ' SG ' HG23 ' A' ' 48' ' ' ILE . 0.9 OUTLIER -157.58 137.96 12.8 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.467 1.107 . . . . 75.319999999999993 109.201 -178.99 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.418 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 3.1 t-20 75.89 -46.33 0.55 Allowed 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 126.107 1.763 . . . . 74.519999999999996 112.482 179.378 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 155.44 2.02 0.12 Allowed Glycine 0 CA--C 1.522 0.52 0 N-CA-C 110.949 -0.86 . . . . 73.030000000000001 110.949 -175.167 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 49.3 mtpt -119.13 162.63 18.32 Favored 'General case' 0 C--N 1.355 0.822 0 C-N-CA 123.976 0.91 . . . . 63.520000000000003 109.621 -178.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.0 m -117.74 114.91 24.01 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 108.605 -0.887 . . . . 74.219999999999999 108.605 176.075 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -101.34 100.16 10.62 Favored 'General case' 0 C--O 1.24 0.563 0 N-CA-C 106.536 -1.653 . . . . 73.430000000000007 106.536 -175.039 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.401 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 11.9 pt-20 -134.48 145.2 48.59 Favored 'General case' 0 C--O 1.243 0.724 0 C-N-CA 123.361 0.665 . . . . 64.430000000000007 110.589 -173.337 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.8 ttm180 -167.71 144.71 4.3 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.619 0.768 . . . . 61.43 109.755 -179.144 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 28.1 m -87.6 108.74 19.21 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.645 0.778 . . . . 62.219999999999999 109.484 175.975 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -97.81 128.45 44.46 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.778 0.831 . . . . 75.219999999999999 109.48 -178.424 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.52 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 26.8 mp0 -93.87 109.15 20.86 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 108.414 -0.958 . . . . 74.439999999999998 108.414 -176.34 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 78.5 mt -120.04 106.73 12.27 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.533 1.133 . . . . 55.210000000000001 109.469 -175.243 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.515 ' HA ' ' HA ' ' A' ' 5' ' ' LYS . 61.9 t80 -95.23 142.0 28.17 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 122.745 0.418 . . . . 74.019999999999996 110.312 175.087 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.484 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -148.46 149.16 31.19 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 123.43 0.692 . . . . 72.109999999999999 110.243 174.688 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.0 t -86.13 -21.89 7.41 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.043 0 C-N-CA 124.613 1.165 . . . . 23.32 109.463 175.362 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.63 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 48.2 mtp180 -131.47 141.77 49.85 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 108.025 -1.102 . . . . 72.239999999999995 108.025 171.493 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -64.45 -19.39 65.51 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 122.565 0.346 . . . . 63.149999999999999 111.027 174.727 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 -66.78 -33.36 75.46 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.284 0.634 . . . . 70.010000000000005 111.621 170.782 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.63 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 8.4 mm-40 -68.83 -25.81 64.85 Favored 'General case' 0 N--CA 1.49 1.544 0 CA-C-N 117.871 0.305 . . . . 65.420000000000002 110.47 177.928 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.575 HD22 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -71.37 -25.39 62.35 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 123.426 0.691 . . . . 73.439999999999998 111.146 -177.901 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.451 ' HG2' HG23 ' A' ' 80' ' ' ILE . 57.3 mtpt -56.97 -52.18 66.27 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.786 0.834 . . . . 75.140000000000001 112.28 -176.953 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -61.46 -35.43 77.58 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.095 0.558 . . . . 72.340000000000003 111.645 179.495 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.575 ' HD2' HD22 ' A' ' 33' ' ' LEU . 65.4 mttm -65.88 -45.33 82.45 Favored 'General case' 0 C--N 1.352 0.7 0 C-N-CA 123.573 0.749 . . . . 74.450000000000003 109.988 -178.078 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 71.9 mt -58.39 -47.7 83.01 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 124.518 1.136 . . . . 75.5 110.843 176.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -58.41 -43.02 88.47 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 123.903 0.752 . . . . 63.210000000000001 111.346 178.688 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -70.85 -41.38 71.54 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.585 0.754 . . . . 60.420000000000002 112.52 -178.481 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.455 HG23 ' O ' ' A' ' 36' ' ' LYS . 94.5 t -64.66 -42.15 94.23 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 C-N-CA 123.234 0.614 . . . . 72.230000000000004 110.46 175.591 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.637 HD21 HD11 ' A' ' 60' ' ' ILE . 35.7 mt -64.74 -48.95 72.69 Favored 'General case' 0 C--O 1.212 -0.874 0 CA-C-N 115.481 -0.781 . . . . 64.230000000000004 110.135 179.129 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -63.04 -34.65 78.04 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.18 0.592 . . . . 50.439999999999998 111.678 177.49 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -68.86 -40.19 79.47 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.134 0.574 . . . . 63.43 110.079 178.321 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.41 ' HA ' ' CZ ' ' A' ' 44' ' ' ARG . 0.0 OUTLIER -76.14 -30.14 58.05 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 123.729 0.812 . . . . 74.209999999999994 111.337 179.166 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.459 ' SD ' HD12 ' A' ' 12' ' ' ILE . 87.7 mmm -91.1 -15.8 28.86 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 124.272 1.029 . . . . 74.129999999999995 112.35 -175.85 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.588 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 14.4 t70 -68.24 -50.77 28.1 Favored Pre-proline 0 CA--C 1.555 1.172 0 CA-C-O 118.247 -0.882 . . . . 73.219999999999999 112.038 -175.732 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.49 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 38.8 Cg_endo -63.08 -23.47 73.54 Favored 'Trans proline' 0 C--N 1.391 2.786 0 C-N-CA 121.812 1.675 . . . . 53.240000000000002 111.837 176.339 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.614 HG23 ' SG ' ' A' ' 14' ' ' CYS . 49.1 mm -71.12 -30.34 40.38 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 C-N-CA 124.788 1.235 . . . . 55.140000000000001 111.149 -177.244 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.588 ' HE2' ' HA ' ' A' ' 46' ' ' ASP . 45.7 mtmt -73.31 -36.99 66.33 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 122.87 0.468 . . . . 75.129999999999995 109.994 176.126 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.5 tmmm? -67.03 -31.48 72.05 Favored 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 123.398 0.679 . . . . 73.329999999999998 110.476 173.517 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 81.8 mt -72.6 -36.45 68.11 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 122.671 0.388 . . . . 64.510000000000005 110.021 173.754 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.57 40.51 18.37 Favored Glycine 0 C--N 1.345 1.083 0 CA-C-N 115.672 -0.695 . . . . 74.040000000000006 113.421 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.418 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 94.8 m -77.21 109.77 11.36 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 109.493 -0.558 . . . . 60.439999999999998 109.493 174.4 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -63.53 -51.46 65.37 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.978 0.911 . . . . 61.009999999999998 110.697 -174.516 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 68.5 ttt180 -111.36 133.5 53.63 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 109.313 -0.625 . . . . 74.420000000000002 109.313 174.007 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 31.5 m -126.34 146.11 32.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 124.002 0.921 . . . . 73.239999999999995 109.455 178.313 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 24.7 ttm180 -110.0 104.8 13.75 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 108.663 -0.866 . . . . 73.099999999999994 108.663 173.064 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.418 HD11 ' SD ' ' A' ' 45' ' ' MET . 38.0 mt -101.34 105.91 18.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 N-CA-C 108.697 -0.853 . . . . 73.230000000000004 108.697 -179.248 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 11.7 t -103.85 104.7 14.74 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 108.928 -0.767 . . . . 61.240000000000002 108.928 178.676 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.637 HD11 HD21 ' A' ' 41' ' ' LEU . 73.9 mt -96.51 112.43 28.63 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 124.266 1.026 . . . . 75.319999999999993 108.921 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 70.4 ttt180 -101.08 120.08 39.68 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 108.019 -1.104 . . . . 73.430000000000007 108.019 174.202 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 4.1 p -95.21 144.67 9.46 Favored 'Isoleucine or valine' 0 C--O 1.243 0.729 0 N-CA-C 108.433 -0.951 . . . . 74.140000000000001 108.433 -178.086 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.408 ' HB3' ' H ' ' A' ' 7' ' ' GLU . 60.0 tttm -92.05 144.17 25.72 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 109.137 -0.69 . . . . 70.310000000000002 109.137 177.338 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -117.32 154.87 30.51 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 124.162 0.985 . . . . 75.109999999999999 109.112 -167.725 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 36.7 t -64.54 -56.0 16.88 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 124.311 1.007 . . . . 74.120000000000005 111.598 -175.581 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -149.26 159.63 44.09 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 115.474 -0.784 . . . . 74.510000000000005 109.867 -167.895 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.73 -20.26 65.93 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 114.091 1.145 . . . . 61.43 114.091 -174.758 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -88.05 -31.05 19.48 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.175 0.59 . . . . 72.129999999999995 110.247 170.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 46.0 mm-40 -79.72 -11.25 59.85 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 114.913 -1.04 . . . . 74.549999999999997 113.298 -177.576 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -38.5 -51.45 1.59 Allowed 'General case' 0 N--CA 1.5 2.064 0 C-N-CA 124.381 1.072 . . . . 62.5 112.561 -179.358 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -80.93 -29.63 35.46 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 114.215 -1.357 . . . . 74.099999999999994 111.814 -172.965 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 56.7 tptt -74.46 -35.82 63.33 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.679 0.792 . . . . 72.409999999999997 110.458 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -84.94 -29.11 25.39 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.311 0.644 . . . . 72.040000000000006 110.157 -179.03 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.26 -47.67 75.9 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 123.897 0.748 . . . . 53.299999999999997 110.602 173.21 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp -73.79 -30.28 62.66 Favored 'General case' 0 CA--C 1.551 1.005 0 CA-C-N 116.093 -0.503 . . . . 64.329999999999998 111.395 179.819 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 4.6 ttmp? -57.43 -52.24 66.16 Favored 'General case' 0 N--CA 1.487 1.412 0 CA-C-O 121.438 0.637 . . . . 74.010000000000005 109.783 168.847 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -70.8 -19.2 62.71 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-N 114.742 -1.117 . . . . 74.319999999999993 111.812 179.165 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.439 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -61.61 -43.72 98.33 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 117.942 0.337 . . . . 60.229999999999997 110.665 174.723 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.83 -44.16 77.86 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.222 0.609 . . . . 60.119999999999997 111.569 174.754 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.451 HG23 ' HG2' ' A' ' 34' ' ' LYS . 35.2 mm -61.68 -46.71 95.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 C-N-CA 124.172 0.989 . . . . 74.430000000000007 111.476 -178.048 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.567 HD13 HG11 ' A' ' 102' ' ' VAL . 51.0 mt -76.53 -30.86 57.32 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.835 0.854 . . . . 74.420000000000002 111.118 -178.317 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 61.4 t30 -60.06 -39.27 85.43 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.207 0.603 . . . . 72.209999999999994 109.965 176.444 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -67.35 -43.28 81.92 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 115.104 -0.953 . . . . 60.119999999999997 111.336 175.316 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.419 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 42.8 t -64.36 -50.39 76.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 123.676 0.79 . . . . 71.310000000000002 110.676 -174.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.528 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 20.0 m-85 -66.22 -27.03 67.67 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.611 0.764 . . . . 71.25 111.239 -179.439 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.9 -35.58 78.73 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.324 0.649 . . . . 61.520000000000003 111.199 172.719 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -84.79 -1.99 57.09 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.73 0.812 . . . . 72.200000000000003 110.606 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 96.3 mt -107.21 -29.48 9.31 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.124 0.97 . . . . 71.439999999999998 110.415 176.768 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 103.44 9.28 38.9 Favored Glycine 0 C--N 1.351 1.389 0 C-N-CA 123.179 0.419 . . . . 61.340000000000003 114.121 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.528 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 27.0 m-85 -83.49 135.58 34.61 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.38 0.672 . . . . 74.219999999999999 110.052 174.777 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ASN . . . . . 0.416 ' O ' HG23 ' A' ' 95' ' ' VAL . 15.5 m120 -91.71 168.31 11.57 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 123.814 0.846 . . . . 74.25 110.705 -177.172 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -59.43 -30.65 68.64 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 123.982 0.913 . . . . 63.32 111.254 175.888 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 54.8 p -65.84 -39.56 90.91 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.175 0.99 . . . . 61.520000000000003 111.103 177.209 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -72.17 -22.9 61.22 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.558 0.743 . . . . 74.239999999999995 111.241 178.491 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.416 HG23 ' O ' ' A' ' 91' ' ' ASN . 88.7 t -96.36 128.38 47.61 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 C-N-CA 124.193 0.997 . . . . 62.240000000000002 110.203 -175.442 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 9.0 t -128.36 141.09 51.53 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.08 0.552 . . . . 62.409999999999997 109.885 170.233 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.439 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 59.9 m95 -111.86 136.76 50.74 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.904 0.882 . . . . 64.439999999999998 109.847 178.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -143.11 87.4 1.97 Allowed 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.494 1.118 . . . . 72.140000000000001 108.076 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 72.45 -83.65 0.55 Allowed Glycine 0 C--N 1.348 1.24 0 CA-C-N 115.28 -0.873 . . . . 73.239999999999995 113.613 176.907 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 29.4 p-10 -126.66 -6.4 6.3 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.145 0.978 . . . . 72.329999999999998 111.745 -175.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 25.8 m -116.18 133.08 56.42 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.641 0.776 . . . . 74.319999999999993 109.202 -176.282 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' VAL . . . . . 0.567 HG11 HD13 ' A' ' 81' ' ' LEU . 4.8 p -115.39 123.05 70.52 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 C-N-CA 124.057 0.943 . . . . 74.510000000000005 108.947 176.491 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 61.0 m -107.08 114.83 29.14 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 108.633 -0.877 . . . . 44.299999999999997 108.633 176.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 49.1 t -109.11 110.73 33.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 C-N-CA 123.797 0.839 . . . . 43.130000000000003 108.786 175.011 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -95.56 111.95 23.77 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 107.971 -1.122 . . . . 52.32 107.971 173.313 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -118.72 177.73 16.5 Favored Glycine 0 C--O 1.24 0.526 0 O-C-N 123.801 0.688 . . . . 43.119999999999997 112.24 -176.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 . . . . . 0 C--O 1.243 0.721 0 C-N-CA 123.804 0.842 . . . . 75.420000000000002 108.946 177.418 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.2 tptp . . . . . 0 C--O 1.24 0.602 0 CA-C-O 120.694 0.283 . . . . 74.319999999999993 110.588 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -86.18 121.9 29.42 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 108.455 -0.943 . . . . 43.409999999999997 108.455 169.412 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.461 HG23 HG23 ' A' ' 62' ' ' VAL . 0.9 OUTLIER -113.17 137.62 45.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 C-N-CA 124.662 1.185 . . . . 74.109999999999999 108.108 177.795 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -104.25 112.11 25.0 Favored 'General case' 0 C--O 1.242 0.678 0 N-CA-C 108.181 -1.044 . . . . 75.310000000000002 108.181 171.295 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 62.3 t -96.16 106.08 17.88 Favored 'Isoleucine or valine' 0 C--N 1.345 0.373 0 C-N-CA 125.141 1.376 . . . . 72.430000000000007 107.98 -176.661 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -96.81 99.81 11.37 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 108.063 -1.088 . . . . 72.329999999999998 108.063 -172.754 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.8 t -99.15 112.0 30.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 124.115 0.966 . . . . 70.209999999999994 109.726 -174.842 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.486 ' HB3' ' HB3' ' A' ' 59' ' ' SER . 26.6 ttpp -118.56 103.85 10.11 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 107.874 -1.158 . . . . 72.140000000000001 107.874 177.604 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.441 HD13 HG13 ' A' ' 48' ' ' ILE . 14.6 tt -113.94 129.84 69.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 123.441 0.696 . . . . 74.239999999999995 110.319 -173.38 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 84.8 m -97.82 117.8 32.94 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 109.394 -0.595 . . . . 71.530000000000001 109.394 174.298 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.744 ' SG ' HG23 ' A' ' 48' ' ' ILE . 49.1 t -129.48 118.18 21.69 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.332 1.053 . . . . 52.119999999999997 109.171 -178.581 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.569 ' HB2' ' SG ' ' A' ' 53' ' ' CYS . 6.4 t-20 74.3 -1.28 3.12 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 125.341 1.456 . . . . 74.450000000000003 112.263 170.338 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 123.41 -6.02 9.27 Favored Glycine 0 C--N 1.351 1.368 0 CA-C-O 119.874 -0.404 . . . . 71.049999999999997 113.415 -178.263 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -108.5 147.38 31.79 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.398 0.679 . . . . 64.409999999999997 110.242 179.297 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 40.2 m -112.31 115.45 28.77 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.717 0.807 . . . . 72.099999999999994 110.057 -176.774 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -110.79 112.74 24.82 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.446 1.098 . . . . 74.239999999999995 109.066 -175.406 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -112.93 140.51 47.68 Favored 'General case' 0 N--CA 1.485 1.286 0 CA-C-N 118.329 0.513 . . . . 63.409999999999997 110.537 -179.517 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 17.3 tpt180 -161.23 120.46 2.54 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.357 0.663 . . . . 74.420000000000002 110.059 -175.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 61.8 m -89.27 116.32 27.4 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.551 0.74 . . . . 74.329999999999998 110.013 174.201 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -98.27 136.82 37.91 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.124 0.97 . . . . 71.140000000000001 108.764 176.138 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 25.6 mp0 -101.78 111.71 24.06 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 108.823 -0.806 . . . . 73.319999999999993 108.823 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.428 ' HB2' HG13 ' A' ' 6' ' ' VAL . 89.9 mt -112.52 161.09 17.15 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.061 0.944 . . . . 75.519999999999996 109.893 -179.494 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 86.1 t80 -151.95 129.38 11.36 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 108.752 -0.833 . . . . 72.409999999999997 108.752 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.546 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -150.89 146.21 26.15 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 122.611 0.364 . . . . 64.030000000000001 111.171 -179.311 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 48.6 t -65.66 -52.41 50.89 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 O-C-N 124.506 1.129 . . . . 74.150000000000006 109.802 175.767 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 -113.56 160.99 17.94 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 115.371 -0.832 . . . . 70.340000000000003 110.167 -177.367 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.475 ' HB2' HG13 ' A' ' 80' ' ' ILE . 21.6 p-10 -69.59 -28.42 65.94 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.489 0.715 . . . . 71.040000000000006 109.969 173.518 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -55.09 -39.44 69.3 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.398 1.079 . . . . 62.329999999999998 111.387 170.001 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.546 ' HB2' ' HB1' ' A' ' 27' ' ' ALA . 19.5 mm-40 -77.48 -20.86 53.71 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.271 -0.877 . . . . 73.010000000000005 111.677 -177.876 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.01 -27.86 64.0 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 122.682 0.393 . . . . 70.140000000000001 110.556 178.214 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 20.7 mtpp -54.14 -60.25 3.58 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.225 1.01 . . . . 64.439999999999998 112.823 -177.076 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -53.22 -33.96 55.1 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 124.392 1.077 . . . . 50.32 112.132 178.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 52.4 mttm -77.93 -37.43 47.77 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.643 0.777 . . . . 62.219999999999999 110.819 -175.182 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.558 HD13 HD23 ' A' ' 81' ' ' LEU . 93.7 mt -65.19 -40.6 94.44 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.445 0.698 . . . . 72.310000000000002 111.202 172.868 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 58.1 mtpt -59.69 -40.83 89.16 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.203 0.601 . . . . 74.450000000000003 110.637 174.877 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt -65.91 -53.05 44.55 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 123.562 0.539 . . . . 55.210000000000001 111.42 175.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 20.8 t -53.49 -45.15 58.0 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 C-N-CA 124.14 0.976 . . . . 63.439999999999998 112.134 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.573 HD21 HD11 ' A' ' 60' ' ' ILE . 97.2 mt -72.94 -51.28 19.06 Favored 'General case' 0 CA--C 1.54 0.577 0 O-C-N 123.58 0.55 . . . . 70.219999999999999 111.3 -178.479 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -67.1 -40.39 86.91 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 122.924 0.49 . . . . 73.219999999999999 112.006 -174.569 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -62.05 -43.27 99.19 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.576 0.35 . . . . 61.32 110.079 174.226 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.1 tpp180 -62.12 -41.99 98.78 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.531 0.732 . . . . 73.230000000000004 111.078 176.539 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.509 ' SD ' HD11 ' A' ' 58' ' ' ILE . 83.2 mtp -94.41 6.91 47.31 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 112.822 0.675 . . . . 74.200000000000003 112.822 -169.74 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -75.84 -48.82 3.62 Favored Pre-proline 0 CA--C 1.56 1.363 0 CA-C-O 118.741 -0.647 . . . . 43.329999999999998 110.444 168.81 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.464 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 31.4 Cg_exo -51.97 -37.76 67.99 Favored 'Trans proline' 0 C--N 1.396 3.057 0 C-N-CA 122.146 1.897 . . . . 72.209999999999994 112.72 166.905 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.744 HG23 ' SG ' ' A' ' 14' ' ' CYS . 50.6 mm -66.64 -30.47 49.82 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.35 0 C-N-CA 124.286 1.035 . . . . 74.140000000000001 111.528 -173.015 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -66.91 -45.28 78.43 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 123.399 0.679 . . . . 62.439999999999998 110.191 173.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.4 tmmm? -61.75 -34.74 76.39 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 114.695 -1.138 . . . . 65.140000000000001 111.193 176.167 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.539 HD12 HD13 ' A' ' 48' ' ' ILE . 85.3 mt -72.39 -29.03 63.37 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.192 0.597 . . . . 75.049999999999997 110.811 176.669 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 68.93 83.23 0.17 Allowed Glycine 0 C--N 1.353 1.498 0 O-C-N 123.976 0.798 . . . . 43.140000000000001 112.188 174.211 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.569 ' SG ' ' HB2' ' A' ' 15' ' ' ASN . 89.5 m -123.98 134.51 53.46 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.272 0.629 . . . . 44.310000000000002 110.701 -174.209 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -63.66 -65.5 0.67 Allowed 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.554 0.741 . . . . 72.109999999999999 110.156 177.075 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 31.9 ttt180 -127.99 126.94 42.33 Favored 'General case' 0 C--O 1.241 0.616 0 C-N-CA 124.019 0.928 . . . . 70.519999999999996 108.577 -176.021 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 34.0 m -115.91 140.54 37.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 C-N-CA 123.155 0.582 . . . . 42.229999999999997 109.664 179.192 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 24.4 ttm180 -105.96 106.89 17.61 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 108.417 -0.957 . . . . 72.019999999999996 108.417 177.449 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.509 HD11 ' SD ' ' A' ' 45' ' ' MET . 50.9 mt -93.9 114.0 29.7 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 N-CA-C 107.993 -1.114 . . . . 60.549999999999997 107.993 179.498 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.486 ' HB3' ' HB3' ' A' ' 11' ' ' LYS . 37.2 t -102.86 102.27 12.37 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.21 -1.033 . . . . 62.109999999999999 108.21 -177.96 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.573 HD11 HD21 ' A' ' 41' ' ' LEU . 78.9 mt -104.85 115.83 47.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 123.409 0.684 . . . . 73.150000000000006 109.555 -177.751 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -109.77 129.4 55.63 Favored 'General case' 0 C--O 1.238 0.471 0 N-CA-C 108.518 -0.919 . . . . 74.310000000000002 108.518 171.761 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.461 HG23 HG23 ' A' ' 6' ' ' VAL . 12.4 p -94.97 148.32 5.13 Favored 'Isoleucine or valine' 0 C--O 1.246 0.899 0 N-CA-C 108.293 -1.002 . . . . 63.109999999999999 108.293 177.106 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 24.2 ttmm -80.49 137.5 36.46 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 108.813 -0.81 . . . . 73.140000000000001 108.813 172.21 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 31.8 m170 -85.38 128.97 34.9 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.069 0.948 . . . . 74.420000000000002 110.446 -173.532 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 28.0 m -66.23 -65.79 0.63 Allowed 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.713 0.805 . . . . 71.549999999999997 111.061 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.458 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 29.6 t70 -162.53 151.98 15.66 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.758 0.823 . . . . 74.010000000000005 108.887 -178.634 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.78 -32.33 63.39 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 124.316 1.047 . . . . 42.299999999999997 113.282 -174.298 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.2 -41.9 89.53 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.054 0.541 . . . . 61.329999999999998 110.658 174.749 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -70.71 -50.03 40.73 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-N 115.157 -0.929 . . . . 74.219999999999999 111.592 -177.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.458 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 58.0 mt-10 -43.53 -34.56 1.41 Allowed 'General case' 0 N--CA 1.501 2.081 0 C-N-CA 126.026 1.73 . . . . 75.209999999999994 115.431 -163.503 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -65.44 -51.27 61.38 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.773 0.829 . . . . 73.25 110.77 -178.917 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -81.93 -29.93 32.04 Favored 'General case' 0 CA--C 1.552 1.054 0 CA-C-N 115.103 -0.953 . . . . 72.400000000000006 111.053 177.478 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -68.84 -39.08 80.13 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 124.509 1.124 . . . . 73.430000000000007 110.3 -173.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.08 -49.69 69.06 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 115.517 -0.765 . . . . 72.310000000000002 111.098 177.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -59.97 -40.57 89.51 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.424 1.09 . . . . 72.430000000000007 111.503 177.248 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 68.6 tttt -64.6 -50.59 66.6 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.26 1.424 . . . . 74.040000000000006 110.543 -179.449 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -75.28 -23.69 57.44 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 115.812 -0.631 . . . . 72.049999999999997 110.266 -177.899 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.61 -33.41 72.62 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.584 0.753 . . . . 51.340000000000003 110.784 174.604 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.8 -40.93 83.86 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.422 0.689 . . . . 63.109999999999999 110.829 173.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.475 HG13 ' HB2' ' A' ' 30' ' ' ASP . 46.2 mm -67.86 -41.82 85.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.023 0.929 . . . . 71.329999999999998 110.794 178.614 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.558 HD23 HD13 ' A' ' 37' ' ' LEU . 42.3 mt -63.96 -47.74 79.25 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.54 0.736 . . . . 64.230000000000004 109.533 176.939 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -55.84 -42.95 76.55 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 124.669 1.187 . . . . 53.299999999999997 111.337 -177.194 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.449 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 43.4 mmtm -67.2 -41.59 85.56 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 115.562 -0.745 . . . . 73.319999999999993 111.33 179.291 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.444 HG21 ' HB2' ' A' ' 37' ' ' LEU . 54.4 t -64.68 -40.72 90.02 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.119 0 C-N-CA 123.378 0.671 . . . . 73.400000000000006 110.301 -178.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.534 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 19.6 m-85 -64.95 -39.99 94.34 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.265 -0.88 . . . . 75.329999999999998 110.53 177.51 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -68.11 -24.33 65.02 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.199 0.6 . . . . 65.519999999999996 111.95 176.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.449 ' HG3' ' O ' ' A' ' 83' ' ' LYS . 45.9 mt-10 -80.95 -20.94 40.88 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.651 0.78 . . . . 73.420000000000002 111.018 178.08 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.1 mt -106.68 -22.71 12.66 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 122.968 0.507 . . . . 63.420000000000002 110.923 -173.571 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 103.54 39.97 2.47 Favored Glycine 0 C--N 1.351 1.403 0 C-N-CA 123.153 0.406 . . . . 62.100000000000001 114.054 177.261 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.534 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 10.1 m-85 -112.76 134.6 54.2 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 107.432 -1.322 . . . . 74.209999999999994 107.432 169.625 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 -83.61 158.37 21.93 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.447 0.699 . . . . 62.32 110.092 -175.123 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.79 -39.66 78.04 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 124.491 1.117 . . . . 73.400000000000006 111.539 177.509 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 22.6 t -60.57 -35.64 76.56 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 124.452 1.101 . . . . 73.540000000000006 111.761 178.237 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -65.3 -26.41 68.06 Favored 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 124.222 1.009 . . . . 74.25 111.977 178.68 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.508 HG22 HG13 ' A' ' 104' ' ' VAL . 47.1 t -90.91 117.88 35.04 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 124.219 1.007 . . . . 62.119999999999997 109.174 -177.51 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 20.7 m -134.65 106.78 7.13 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.598 0.759 . . . . 52.039999999999999 109.958 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 69.3 m95 -68.97 109.95 4.2 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 122.731 0.413 . . . . 70.239999999999995 110.167 176.062 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -107.73 96.92 6.73 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 107.993 -1.114 . . . . 74.0 107.993 177.532 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 68.37 -120.32 11.51 Favored Glycine 0 C--N 1.343 0.927 0 O-C-N 123.675 0.609 . . . . 52.119999999999997 112.415 -178.394 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -79.67 -32.55 41.5 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 124.663 1.185 . . . . 73.420000000000002 110.335 -178.016 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 20.2 m -105.84 148.8 27.14 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.946 0.899 . . . . 71.450000000000003 110.129 -169.407 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.9 p -104.06 136.49 37.03 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 CA-C-O 121.274 0.559 . . . . 62.450000000000003 110.012 177.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 27.6 m -103.67 100.02 9.83 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.467 1.507 . . . . 70.530000000000001 108.198 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.508 HG13 HG22 ' A' ' 95' ' ' VAL . 42.0 t -108.71 109.6 28.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 N-CA-C 108.23 -1.026 . . . . 62.43 108.23 -179.612 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -106.49 109.58 21.54 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 109.855 -0.424 . . . . 73.409999999999997 109.855 -176.579 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -115.12 137.41 13.91 Favored Glycine 0 C--N 1.333 0.373 0 N-CA-C 110.552 -1.019 . . . . 70.540000000000006 110.552 179.163 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 . . . . . 0 C--O 1.242 0.674 0 N-CA-C 108.823 -0.806 . . . . 74.209999999999994 108.823 173.028 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt . . . . . 0 C--O 1.239 0.523 0 N-CA-C 110.788 -0.078 . . . . 75.310000000000002 110.788 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 25.3 ttpt -88.49 98.61 11.73 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 107.062 -1.459 . . . . 51.340000000000003 107.062 163.816 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.546 HG23 HG23 ' A' ' 62' ' ' VAL . 0.2 OUTLIER -99.23 126.62 52.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 107.54 -1.282 . . . . 73.439999999999998 107.54 -179.745 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -102.25 113.8 27.4 Favored 'General case' 0 C--O 1.24 0.554 0 N-CA-C 108.29 -1.004 . . . . 72.340000000000003 108.29 179.437 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 64.0 t -100.67 109.18 24.68 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 C-N-CA 124.933 1.293 . . . . 74.010000000000005 108.658 -172.694 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.433 ' O ' ' HA ' ' A' ' 60' ' ' ILE . 41.7 mt-30 -96.45 98.17 10.03 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 107.7 -1.222 . . . . 44.200000000000003 107.7 -176.113 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 48.6 t -94.07 104.63 15.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 N-CA-C 108.525 -0.917 . . . . 70.5 108.525 -175.629 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.419 ' HE3' HG21 ' A' ' 18' ' ' THR . 1.7 tmtp? -111.98 102.82 11.03 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 107.573 -1.269 . . . . 62.240000000000002 107.573 -176.721 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.409 ' HA ' ' O ' ' A' ' 57' ' ' ARG . 8.7 tt -119.47 124.34 72.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 122.902 0.481 . . . . 75.230000000000004 110.451 -172.047 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 39.0 m -91.5 121.71 33.44 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.269 0.628 . . . . 51.509999999999998 109.493 178.057 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.662 ' SG ' HG23 ' A' ' 48' ' ' ILE . 1.3 t -158.43 143.13 16.13 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.709 1.204 . . . . 53.520000000000003 109.878 -177.543 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.401 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 63.3 t30 62.44 25.32 15.1 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 124.182 0.993 . . . . 71.019999999999996 111.526 172.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 85.86 -8.19 73.95 Favored Glycine 0 C--N 1.345 1.054 0 CA-C-N 115.766 -0.652 . . . . 73.239999999999995 113.498 179.572 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -108.66 169.51 8.61 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.677 0.791 . . . . 75.140000000000001 110.738 -179.287 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.419 HG21 ' HE3' ' A' ' 11' ' ' LYS . 87.0 m -115.03 123.96 50.4 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 114.905 -1.043 . . . . 62.140000000000001 108.771 171.298 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -110.28 100.77 9.59 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 107.718 -1.216 . . . . 50.329999999999998 107.718 178.151 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.7 pp20? -106.27 146.39 30.42 Favored 'General case' 0 C--O 1.242 0.704 0 N-CA-C 108.982 -0.747 . . . . 72.099999999999994 108.982 177.68 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.1 tpt180 -157.21 124.64 5.27 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 123.305 0.378 . . . . 53.140000000000001 110.204 174.546 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 44.0 m -89.17 109.57 20.42 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 108.962 -0.755 . . . . 75.450000000000003 108.962 173.546 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -98.01 135.79 39.21 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 108.814 -0.81 . . . . 54.420000000000002 108.814 178.561 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -97.12 108.69 21.47 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 107.732 -1.21 . . . . 74.040000000000006 107.732 175.851 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 94.7 mt -115.24 137.83 51.6 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 108.233 -1.025 . . . . 52.340000000000003 108.233 -178.291 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -132.18 132.55 43.28 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 109.334 -0.617 . . . . 73.209999999999994 109.334 -175.703 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -156.27 149.86 24.76 Favored 'General case' 0 C--O 1.239 0.509 0 C-N-CA 123.323 0.649 . . . . 61.43 109.626 173.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 51.7 t -63.41 -37.69 80.2 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 C-N-CA 124.215 1.006 . . . . 71.230000000000004 109.869 174.691 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 53.4 mtt180 -130.12 145.31 51.69 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.442 0.697 . . . . 74.319999999999993 110.848 175.625 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 35.2 p-10 -69.53 -23.26 63.56 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.063 0.945 . . . . 73.0 111.333 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -59.26 -37.75 78.4 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.224 0.61 . . . . 73.329999999999998 110.731 170.568 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -81.94 -22.24 36.81 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.486 0.715 . . . . 75.439999999999998 111.348 179.26 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.576 HD22 ' HD2' ' A' ' 36' ' ' LYS . 0.7 OUTLIER -70.4 -22.55 62.73 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.411 1.084 . . . . 75.439999999999998 110.265 178.189 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.568 ' HG2' HG23 ' A' ' 80' ' ' ILE . 50.1 mtpt -52.79 -53.59 46.13 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 124.004 0.922 . . . . 64.409999999999997 113.168 -178.495 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -61.1 -30.14 70.18 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 123.41 0.444 . . . . 63.240000000000002 111.717 -177.017 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.576 ' HD2' HD22 ' A' ' 33' ' ' LEU . 58.0 mttm -67.58 -45.35 75.78 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 123.503 0.502 . . . . 51.32 110.355 174.797 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.438 HD13 HD23 ' A' ' 81' ' ' LEU . 95.8 mt -58.63 -44.77 90.12 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.735 0.814 . . . . 74.120000000000005 111.439 177.124 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.525 ' HG2' HG13 ' A' ' 84' ' ' VAL . 51.2 mtpt -61.25 -47.45 86.0 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 123.764 0.665 . . . . 75.409999999999997 111.044 -178.813 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -62.42 -52.46 63.48 Favored 'General case' 0 N--CA 1.476 0.83 0 O-C-N 123.607 0.567 . . . . 64.439999999999998 110.982 178.094 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 22.4 t -58.0 -42.18 82.08 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 C-N-CA 124.894 1.278 . . . . 72.0 112.52 -178.774 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.454 HD21 HD11 ' A' ' 60' ' ' ILE . 39.4 mt -70.35 -37.75 74.7 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.341 0.657 . . . . 61.32 110.965 179.688 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -68.06 -35.76 78.73 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 119.426 -0.321 . . . . 55.340000000000003 111.473 175.822 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -72.93 -45.29 58.93 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.373 0.669 . . . . 73.340000000000003 110.818 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.7 tpm_? -60.25 -41.39 93.11 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.86 0.864 . . . . 73.239999999999995 110.235 176.022 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.436 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 64.4 mtp -92.67 2.81 56.52 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 115.64 -0.709 . . . . 61.409999999999997 112.821 -178.222 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -65.47 -49.57 62.11 Favored Pre-proline 0 CA--C 1.553 1.07 0 CA-C-O 118.603 -0.713 . . . . 71.530000000000001 111.404 178.565 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.49 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 37.9 Cg_endo -63.69 -27.42 68.66 Favored 'Trans proline' 0 C--N 1.389 2.699 0 C-N-CA 121.391 1.394 . . . . 55.219999999999999 111.756 172.366 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.662 HG23 ' SG ' ' A' ' 14' ' ' CYS . 45.0 mm -74.19 -34.06 36.7 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.02 0 C-N-CA 124.149 0.979 . . . . 72.430000000000007 110.729 -173.534 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.436 ' HG3' ' O ' ' A' ' 45' ' ' MET . 93.0 mttt -73.9 -31.36 63.07 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.276 0.63 . . . . 73.5 110.086 176.856 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.8 tmmm? -76.14 -29.06 57.66 Favored 'General case' 0 CA--C 1.548 0.903 0 CA-C-N 115.108 -0.951 . . . . 73.310000000000002 109.654 175.906 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 92.1 mt -71.89 -32.28 67.26 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 109.08 -0.711 . . . . 54.219999999999999 109.08 173.805 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.38 40.32 33.57 Favored Glycine 0 C--N 1.349 1.253 0 CA-C-N 115.834 -0.621 . . . . 72.420000000000002 112.369 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.401 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 68.5 m -71.44 97.11 1.58 Allowed 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 109.415 -0.587 . . . . 73.340000000000003 109.415 174.952 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -50.9 -39.7 55.03 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 125.792 1.637 . . . . 73.409999999999997 112.539 -169.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 9.5 ttp180 -134.21 130.76 37.68 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 107.796 -1.187 . . . . 53.210000000000001 107.796 179.154 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 23.0 m -124.86 145.19 32.55 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 C-N-CA 122.897 0.479 . . . . 71.439999999999998 110.669 -178.784 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.512 ' HG3' HG23 ' A' ' 103' ' ' THR . 21.1 ttt180 -104.39 108.55 20.02 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 108.237 -1.024 . . . . 74.430000000000007 108.237 170.857 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 37.7 mt -101.62 104.25 16.08 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 N-CA-C 108.253 -1.017 . . . . 74.219999999999999 108.253 176.033 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 70.3 m -101.91 103.48 14.15 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 107.839 -1.171 . . . . 75.120000000000005 107.839 177.893 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.454 HD11 HD21 ' A' ' 41' ' ' LEU . 61.5 mt -98.93 130.25 48.09 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 123.258 0.623 . . . . 70.230000000000004 109.83 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 27.8 ttm-85 -115.92 120.04 37.89 Favored 'General case' 0 C--O 1.239 0.506 0 N-CA-C 107.726 -1.212 . . . . 70.010000000000005 107.726 174.132 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.546 HG23 HG23 ' A' ' 6' ' ' VAL . 7.6 p -94.73 139.09 19.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 N-CA-C 108.636 -0.875 . . . . 61.520000000000003 108.636 -178.856 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -81.08 121.56 26.24 Favored 'General case' 0 C--O 1.24 0.596 0 N-CA-C 108.904 -0.776 . . . . 72.129999999999995 108.904 -177.005 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -95.19 149.99 20.7 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.626 0.77 . . . . 71.019999999999996 110.35 -176.363 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 23.5 m -77.32 -44.41 29.66 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.2 1.0 . . . . 71.230000000000004 111.455 -178.575 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -156.39 158.0 36.59 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.189 0.596 . . . . 72.430000000000007 110.473 -174.08 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.52 -44.15 89.44 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 124.599 1.16 . . . . 74.329999999999998 112.984 -176.353 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -75.6 -22.26 57.07 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 122.9 0.48 . . . . 72.129999999999995 110.892 178.085 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -84.6 -17.38 38.92 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 118.894 -0.574 . . . . 74.239999999999995 112.034 178.099 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -57.35 -44.01 83.94 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.096 0.558 . . . . 63.43 111.785 -179.318 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.75 -33.98 76.28 Favored 'General case' 0 N--CA 1.479 1.018 0 O-C-N 124.001 0.813 . . . . 73.230000000000004 111.17 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -70.55 -59.42 2.85 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 109.524 -0.547 . . . . 51.310000000000002 109.524 176.833 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -63.4 -30.21 71.37 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.055 1.342 . . . . 64.120000000000005 112.784 -173.888 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.34 -55.63 15.02 Favored 'General case' 0 C--O 1.213 -0.841 0 N-CA-C 109.313 -0.625 . . . . 73.319999999999993 109.313 179.041 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 5.5 tmtm? -62.24 -43.8 98.0 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 125.241 1.416 . . . . 64.239999999999995 110.711 179.265 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 60.3 tttm -64.1 -55.44 21.97 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.427 1.491 . . . . 73.450000000000003 111.637 -175.589 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -75.04 -19.12 60.18 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 115.207 -0.906 . . . . 42.32 110.603 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.15 -43.18 99.03 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 122.887 0.475 . . . . 73.439999999999998 110.89 172.324 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.463 ' O ' ' HG2' ' A' ' 83' ' ' LYS . . . -60.1 -41.92 93.58 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 124.0 0.812 . . . . 60.200000000000003 110.482 176.22 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.568 HG23 ' HG2' ' A' ' 34' ' ' LYS . 42.8 mm -63.09 -50.64 78.58 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 124.385 1.074 . . . . 64.319999999999993 111.604 178.549 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.438 HD23 HD13 ' A' ' 37' ' ' LEU . 34.1 mt -64.35 -43.36 94.8 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.279 0.632 . . . . 72.319999999999993 110.315 -179.198 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 60.8 t30 -59.5 -40.08 85.91 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 124.505 1.122 . . . . 73.5 110.854 -177.359 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.463 ' HG2' ' O ' ' A' ' 79' ' ' ALA . 74.7 mmtt -69.26 -41.86 76.36 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 115.588 -0.733 . . . . 73.140000000000001 111.213 176.237 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.55 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 37.4 t -62.11 -50.64 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 123.343 0.657 . . . . 72.239999999999995 109.884 -178.839 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.471 ' CE2' HG21 ' A' ' 104' ' ' VAL . 28.3 m-85 -61.28 -36.19 79.37 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.099 0.96 . . . . 72.409999999999997 111.544 178.736 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.83 -31.91 73.01 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.426 0.691 . . . . 73.420000000000002 111.449 175.242 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -85.39 -12.86 51.1 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.139 0.976 . . . . 65.209999999999994 111.117 178.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 54.6 mt -98.69 0.24 44.23 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 122.783 0.433 . . . . 75.549999999999997 110.11 -178.535 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 96.13 -1.62 62.97 Favored Glycine 0 C--N 1.35 1.355 0 O-C-N 123.443 0.464 . . . . 35.420000000000002 113.374 177.677 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -82.25 140.34 33.71 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 109.603 -0.517 . . . . 72.150000000000006 109.603 178.814 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -70.36 147.33 49.71 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.062 0.545 . . . . 72.310000000000002 110.093 178.348 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -50.67 -55.99 13.97 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 125.288 1.435 . . . . 73.409999999999997 111.515 178.524 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 11.6 t -59.37 -19.92 50.67 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 124.287 1.035 . . . . 72.140000000000001 113.543 -174.035 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -74.09 -19.07 60.71 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.104 0.561 . . . . 72.140000000000001 112.139 -179.077 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.502 ' HA ' HG22 ' A' ' 104' ' ' VAL . 49.0 t -74.29 101.2 1.69 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 N-CA-C 107.058 -1.46 . . . . 75.010000000000005 107.058 175.62 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 8.1 m -111.43 94.16 4.83 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 109.496 -0.557 . . . . 65.239999999999995 109.496 -172.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 65.7 m95 -72.04 107.43 4.74 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 109.003 -0.74 . . . . 73.230000000000004 109.003 174.346 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -101.63 75.57 1.59 Allowed 'General case' 0 C--O 1.238 0.478 0 C-N-CA 124.556 1.143 . . . . 74.420000000000002 108.402 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 64.9 -88.14 0.08 OUTLIER Glycine 0 C--N 1.346 1.092 0 CA-C-N 114.988 -1.005 . . . . 72.010000000000005 112.789 -178.602 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -82.97 -61.3 1.9 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.461 1.105 . . . . 34.109999999999999 109.779 -178.737 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 11.5 m -102.5 144.26 31.17 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 114.947 -1.024 . . . . 55.100000000000001 110.302 -167.001 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 6.3 p -103.44 120.05 52.87 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 C-N-CA 123.032 0.533 . . . . 74.409999999999997 110.255 -178.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.512 HG23 ' HG3' ' A' ' 57' ' ' ARG . 52.5 m -99.72 110.61 23.0 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.453 1.101 . . . . 73.329999999999998 108.812 177.862 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.502 HG22 ' HA ' ' A' ' 95' ' ' VAL . 46.2 t -112.41 112.66 41.43 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 124.266 1.026 . . . . 64.409999999999997 108.381 -176.843 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -92.38 114.34 26.87 Favored 'General case' 0 C--O 1.24 0.599 0 N-CA-C 109.206 -0.664 . . . . 73.239999999999995 109.206 -179.283 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -107.79 137.96 14.32 Favored Glycine 0 C--N 1.342 0.872 0 CA-C-N 115.972 -0.558 . . . . 64.420000000000002 112.981 -176.009 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 23.6 tm0? . . . . . 0 N--CA 1.471 0.588 0 N-CA-C 107.98 -1.118 . . . . 73.230000000000004 107.98 171.364 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.4 tmtm? . . . . . 0 C--O 1.243 0.716 0 N-CA-C 107.18 -1.415 . . . . 74.200000000000003 107.18 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -71.96 101.39 2.68 Favored 'General case' 0 C--N 1.351 0.657 0 CA-C-O 121.192 0.52 . . . . 52.100000000000001 109.612 178.38 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.3 p -100.35 150.23 5.64 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 124.129 0.972 . . . . 75.239999999999995 109.805 -178.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -100.5 113.61 26.53 Favored 'General case' 0 C--O 1.239 0.536 0 N-CA-C 108.463 -0.94 . . . . 71.340000000000003 108.463 172.101 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.413 HG21 HD12 ' A' ' 25' ' ' LEU . 88.8 t -101.39 107.49 21.54 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 124.833 1.253 . . . . 43.100000000000001 108.688 -177.21 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -94.93 101.08 12.83 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 107.862 -1.162 . . . . 75.209999999999994 107.862 -177.396 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 92.2 t -96.14 111.07 25.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 N-CA-C 108.907 -0.775 . . . . 51.520000000000003 108.907 -177.563 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.3 ttmm -107.49 102.92 12.15 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.265 1.026 . . . . 44.130000000000003 108.329 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.418 HD11 HG21 ' A' ' 48' ' ' ILE . 15.2 tt -111.11 121.52 63.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 CA-C-O 121.3 0.571 . . . . 70.310000000000002 110.515 -177.998 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 30.2 m -95.16 119.78 34.25 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.031 0.933 . . . . 73.209999999999994 109.364 178.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.675 ' SG ' HG23 ' A' ' 48' ' ' ILE . 21.7 t -150.72 134.98 16.97 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.926 1.29 . . . . 64.439999999999998 108.835 -175.405 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.572 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 4.0 t30 65.56 29.87 10.85 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 125.014 1.326 . . . . 73.230000000000004 110.473 177.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.19 0.03 75.63 Favored Glycine 0 C--N 1.353 1.52 0 CA-C-N 115.487 -0.779 . . . . 74.239999999999995 113.879 -178.343 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -112.71 164.54 13.24 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.918 0.887 . . . . 74.400000000000006 110.645 -177.151 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 82.3 m -115.84 119.86 37.37 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.569 0.748 . . . . 62.450000000000003 110.487 176.581 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -109.93 120.75 43.45 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 107.115 -1.439 . . . . 73.329999999999998 107.115 176.678 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -143.36 156.46 44.69 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 118.433 0.56 . . . . 74.310000000000002 111.994 -177.451 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 39.3 ttp180 -166.49 134.9 2.85 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-N 114.9 -1.045 . . . . 73.219999999999999 108.721 -174.245 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 57.4 m -91.62 118.6 30.77 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.729 0.812 . . . . 73.109999999999999 109.813 178.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 67.7 m-85 -100.41 137.57 38.65 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.203 1.001 . . . . 73.010000000000005 109.041 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -100.18 107.89 19.87 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 106.776 -1.565 . . . . 73.120000000000005 106.776 173.688 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.413 HD12 HG21 ' A' ' 8' ' ' VAL . 67.3 mt -111.23 98.28 7.39 Favored 'General case' 0 C--O 1.239 0.513 0 C-N-CA 123.514 0.726 . . . . 65.510000000000005 109.304 -175.225 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 68.5 t80 -92.36 140.59 29.44 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 115.568 -0.742 . . . . 73.109999999999999 109.464 172.874 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.553 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -141.5 171.62 13.81 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.883 0.873 . . . . 71.319999999999993 109.498 178.078 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 48.1 t -101.81 -28.65 3.14 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 C-N-CA 123.255 0.622 . . . . 73.040000000000006 109.455 173.349 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.587 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 95.2 mtt180 -130.86 174.24 10.17 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.941 0.897 . . . . 74.109999999999999 109.745 176.567 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.454 ' HB3' ' HE3' ' A' ' 76' ' ' LYS . 14.0 p-10 -72.46 -39.18 67.95 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.549 0.74 . . . . 74.340000000000003 109.91 173.817 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -64.11 -26.72 68.66 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.089 0.956 . . . . 72.439999999999998 111.455 -178.588 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.587 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 38.2 mm-40 -67.84 -32.74 73.48 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.642 0.777 . . . . 71.430000000000007 111.293 178.632 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.404 ' HA ' ' HD2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -67.67 -20.08 65.26 Favored 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 123.759 0.824 . . . . 64.010000000000005 110.689 -177.391 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.434 ' HE2' ' HB3' ' A' ' 34' ' ' LYS . 36.2 mtpt -56.83 -61.22 2.59 Favored 'General case' 0 C--N 1.362 1.15 0 C-N-CA 123.2 0.6 . . . . 64.129999999999995 112.344 179.577 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -57.46 -31.84 66.34 Favored 'General case' 0 N--CA 1.481 1.122 0 O-C-N 124.0 0.812 . . . . 55.409999999999997 111.657 -176.826 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.404 ' HD2' ' HA ' ' A' ' 33' ' ' LEU . 65.9 mttm -67.13 -47.31 71.47 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.907 0.883 . . . . 75.540000000000006 110.29 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.533 HD13 HD23 ' A' ' 81' ' ' LEU . 97.2 mt -63.9 -48.17 77.68 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.72 0.808 . . . . 70.430000000000007 111.916 177.242 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -60.25 -41.14 92.56 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.605 0.762 . . . . 73.209999999999994 111.514 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.426 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 30.2 mmmt -66.93 -51.89 49.7 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 122.611 0.365 . . . . 64.239999999999995 111.195 175.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 20.6 t -56.02 -44.11 77.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 C-N-CA 123.381 0.672 . . . . 70.120000000000005 111.578 -179.078 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 82.4 mt -69.69 -52.62 24.06 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.051 0.541 . . . . 75.019999999999996 110.993 -179.009 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -63.97 -42.74 97.15 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 113.196 0.813 . . . . 71.299999999999997 113.196 -177.313 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 23.2 mm-40 -67.44 -46.14 73.97 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 122.223 0.209 . . . . 72.430000000000007 110.59 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 36.1 tpt85 -70.08 -35.15 73.98 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 122.647 0.379 . . . . 65.25 111.518 -176.791 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.42 ' SD ' HD11 ' A' ' 58' ' ' ILE . 60.4 mtp -86.93 -7.79 57.85 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 113.11 0.782 . . . . 71.200000000000003 113.11 -176.342 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.4 ' HA ' ' HD3' ' A' ' 49' ' ' LYS . 24.2 t70 -61.49 -48.13 91.43 Favored Pre-proline 0 CA--C 1.569 1.683 0 CA-C-O 118.843 -0.599 . . . . 60.130000000000003 111.608 177.863 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -68.92 -19.17 40.55 Favored 'Trans proline' 0 C--N 1.391 2.811 0 C-N-CA 122.182 1.922 . . . . 71.349999999999994 113.554 170.755 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.675 HG23 ' SG ' ' A' ' 14' ' ' CYS . 46.8 mm -74.68 -34.29 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 C-N-CA 123.624 0.77 . . . . 71.129999999999995 110.466 177.135 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.4 ' HD3' ' HA ' ' A' ' 46' ' ' ASP . 5.2 mtpm? -72.85 -32.71 65.65 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.924 0.889 . . . . 71.439999999999998 109.626 173.359 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.34 -27.72 68.79 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.549 1.14 . . . . 73.129999999999995 110.718 172.641 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.521 HD12 ' SG ' ' A' ' 14' ' ' CYS . 68.3 mt -76.18 -35.09 59.29 Favored 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 109.712 -0.477 . . . . 75.010000000000005 109.712 171.755 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 79.11 35.95 29.07 Favored Glycine 0 C--N 1.345 1.069 0 O-C-N 123.822 0.701 . . . . 22.539999999999999 112.374 177.967 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.572 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 80.8 m -69.99 99.3 1.41 Allowed 'General case' 0 C--N 1.345 0.411 0 N-CA-C 109.285 -0.635 . . . . 61.200000000000003 109.285 176.614 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 44.0 mtmt -55.16 -32.84 62.44 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.954 1.301 . . . . 64.120000000000005 112.203 -169.86 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -125.28 136.63 53.71 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 108.01 -1.107 . . . . 74.239999999999995 108.01 168.011 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.426 ' O ' ' HA ' ' A' ' 105' ' ' GLU . 17.1 m -121.16 134.89 63.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 123.603 0.761 . . . . 44.240000000000002 109.058 174.664 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -100.55 107.53 19.23 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 108.716 -0.846 . . . . 74.310000000000002 108.716 172.719 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.42 HD11 ' SD ' ' A' ' 45' ' ' MET . 35.7 mt -104.18 103.42 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 N-CA-C 108.904 -0.776 . . . . 71.5 108.904 177.881 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 51.4 m -99.91 102.73 14.21 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 108.3 -1.0 . . . . 72.420000000000002 108.3 176.73 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 73.8 mt -97.24 109.54 23.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 C-N-CA 124.021 0.928 . . . . 75.510000000000005 108.73 179.242 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -92.07 134.7 34.59 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 107.952 -1.129 . . . . 73.150000000000006 107.952 171.405 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.8 p -94.02 146.96 5.94 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 N-CA-C 106.813 -1.551 . . . . 55.539999999999999 106.813 174.822 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.5 tmtm? -80.43 125.29 29.74 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 107.934 -1.135 . . . . 63.509999999999998 107.934 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 14.7 m170 -92.21 106.09 18.17 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 114.874 -1.057 . . . . 54.210000000000001 108.312 -178.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 13.6 p -63.85 -43.7 95.35 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.084 0.954 . . . . 73.530000000000001 111.35 -178.533 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -163.83 157.26 18.65 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.551 1.141 . . . . 74.200000000000003 108.766 -179.545 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.43 -26.77 68.08 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.553 0.741 . . . . 74.239999999999995 112.844 -174.71 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -86.38 -45.84 10.82 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.406 0.682 . . . . 64.340000000000003 110.44 176.422 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -68.66 -29.36 67.82 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.838 0.855 . . . . 74.239999999999995 112.095 -173.744 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -67.06 -27.27 67.24 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.412 0.685 . . . . 74.409999999999997 111.071 -177.286 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 71.0 mmtt -67.61 -33.09 74.29 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.82 0.448 . . . . 73.409999999999997 109.91 -177.14 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -74.16 -58.08 3.53 Favored 'General case' 0 C--N 1.347 0.469 0 CA-C-N 115.674 -0.694 . . . . 54.340000000000003 109.74 172.592 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 48.9 mm-40 -67.06 -31.42 71.91 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 113.735 1.013 . . . . 63.219999999999999 113.735 -167.858 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -78.85 -42.49 27.39 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 118.082 0.401 . . . . 33.130000000000003 110.949 -177.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 53.8 tptt -68.74 -38.63 80.28 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.61 0.764 . . . . 74.519999999999996 111.128 177.259 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.454 ' HE3' ' HB3' ' A' ' 30' ' ' ASP . 76.6 tttt -59.18 -50.04 75.56 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 125.483 1.513 . . . . 55.130000000000003 110.387 172.51 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -70.12 -29.08 65.93 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 114.934 -1.03 . . . . 74.030000000000001 110.48 -177.917 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.87 -43.71 87.54 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.925 0.89 . . . . 41.140000000000001 110.521 178.369 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.82 -41.95 99.53 Favored 'General case' 0 C--N 1.354 0.798 0 O-C-N 123.987 0.805 . . . . 31.43 110.903 176.429 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.402 HG22 HD12 ' A' ' 37' ' ' LEU . 50.0 mm -62.78 -41.83 93.95 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 C-N-CA 123.66 0.784 . . . . 45.130000000000003 110.894 175.899 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.533 HD23 HD13 ' A' ' 37' ' ' LEU . 47.1 mt -64.76 -37.92 89.23 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.764 0.826 . . . . 75.140000000000001 110.921 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -57.25 -45.14 84.25 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.771 0.828 . . . . 72.310000000000002 110.49 178.146 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 9.7 mmpt? -66.97 -41.26 87.13 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 114.892 -1.049 . . . . 64.439999999999998 110.495 -178.241 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.494 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 54.6 t -65.69 -56.71 13.82 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 C-N-CA 124.071 0.949 . . . . 63.210000000000001 110.571 -177.928 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.518 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 22.0 m-85 -60.13 -38.1 82.05 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 124.098 0.959 . . . . 64.450000000000003 111.569 -177.345 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.74 -30.04 71.18 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.577 0.751 . . . . 71.140000000000001 111.835 177.84 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -87.59 -9.03 55.5 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.491 0.716 . . . . 62.210000000000001 111.949 177.216 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 59.8 mt -105.0 -15.32 15.14 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 122.724 0.409 . . . . 62.32 110.543 -178.695 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 95.11 13.83 51.07 Favored Glycine 0 C--N 1.348 1.213 0 CA-C-N 116.257 -0.429 . . . . 54.109999999999999 113.484 178.535 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.518 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 14.3 m-85 -87.5 124.32 33.34 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 108.518 -0.919 . . . . 61.32 108.518 173.699 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 38.6 t-20 -81.87 146.84 29.63 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.708 0.803 . . . . 74.219999999999999 110.008 -171.193 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -53.15 -36.15 60.53 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 125.257 1.423 . . . . 75.200000000000003 111.425 173.331 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 17.2 m -57.15 -21.23 31.24 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 124.706 1.202 . . . . 75.430000000000007 113.378 178.572 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -105.89 -10.48 16.63 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.425 1.09 . . . . 70.540000000000006 111.896 -173.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.404 HG13 HG22 ' A' ' 104' ' ' VAL . 60.9 t -87.43 103.43 13.37 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 C-N-CA 123.628 0.771 . . . . 74.5 109.696 -175.196 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 30.8 m -108.89 115.49 30.18 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.015 0.926 . . . . 64.140000000000001 110.798 -172.783 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 55.5 m95 -97.81 144.1 27.76 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.007 0.523 . . . . 73.319999999999993 111.314 177.554 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -132.41 66.54 1.55 Allowed 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 108.172 -1.047 . . . . 73.319999999999993 108.172 170.033 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 42.06 22.7 0.12 Allowed Glycine 0 N--CA 1.488 2.135 0 N-CA-C 118.023 1.969 . . . . 61.420000000000002 118.023 174.766 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -175.04 -52.73 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.418 0 CA-C-N 118.148 0.974 . . . . 64.349999999999994 110.615 -168.149 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 52.7 m -117.58 151.8 36.42 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.393 1.077 . . . . 73.150000000000006 109.483 -177.402 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 6.5 p -126.05 113.47 34.31 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.198 0 C-N-CA 123.275 0.63 . . . . 74.040000000000006 111.074 176.784 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 53.6 m -92.8 101.21 13.59 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.693 1.197 . . . . 75.349999999999994 109.082 175.859 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.479 HG21 ' CE2' ' A' ' 85' ' ' PHE . 55.8 t -104.9 112.33 38.09 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 C-N-CA 124.623 1.169 . . . . 74.439999999999998 108.419 177.856 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' GLU . . . . . 0.426 ' HA ' ' O ' ' A' ' 56' ' ' VAL . 47.4 mt-10 -96.12 156.67 16.24 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.048 -0.723 . . . . 75.219999999999999 109.048 175.0 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -154.05 142.37 9.06 Favored Glycine 0 C--O 1.241 0.541 0 C-N-CA 121.387 -0.435 . . . . 72.239999999999995 112.332 176.973 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 23.0 tp60 . . . . . 0 C--N 1.351 0.644 0 N-CA-C 106.897 -1.52 . . . . 64.329999999999998 106.897 171.525 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.807 0 CA-C-O 121.172 0.51 . . . . 74.420000000000002 110.674 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -97.06 101.95 13.63 Favored 'General case' 0 C--O 1.239 0.513 0 N-CA-C 106.659 -1.608 . . . . 75.109999999999999 106.659 167.168 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.2 p -100.23 134.42 39.93 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 C-N-CA 124.148 0.979 . . . . 63.210000000000001 108.642 -178.698 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.443 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 34.6 mt-10 -106.29 113.51 27.08 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 108.058 -1.09 . . . . 74.519999999999996 108.058 175.684 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 77.6 t -97.25 107.74 20.46 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 114.827 -1.079 . . . . 65.340000000000003 108.331 -176.579 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -94.52 99.75 11.85 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 107.26 -1.385 . . . . 74.120000000000005 107.26 -177.464 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 97.2 t -94.56 103.31 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 N-CA-C 108.113 -1.069 . . . . 74.120000000000005 108.113 -177.808 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.442 ' HG3' ' HB3' ' A' ' 20' ' ' GLU . 34.7 ttmt -115.0 101.21 8.79 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 107.732 -1.21 . . . . 75.239999999999995 107.732 -176.965 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.445 HD13 HG13 ' A' ' 48' ' ' ILE . 11.3 tt -116.24 125.95 73.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 C-N-CA 123.376 0.67 . . . . 74.530000000000001 110.373 -169.913 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 55.5 m -92.07 122.47 34.61 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 109.944 -0.391 . . . . 72.420000000000002 109.944 176.935 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.523 ' SG ' HG23 ' A' ' 48' ' ' ILE . 14.6 t -155.86 147.99 23.45 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.462 1.505 . . . . 52.439999999999998 108.644 -178.88 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.448 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 11.6 t30 67.17 18.51 10.39 Favored 'General case' 0 N--CA 1.499 1.994 0 CA-C-O 121.791 0.805 . . . . 54.030000000000001 110.682 174.881 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.5 7.11 88.73 Favored Glycine 0 C--N 1.358 1.772 0 CA-C-N 115.495 -0.775 . . . . 73.140000000000001 113.586 -176.855 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.9 mtpm? -124.98 169.2 12.34 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.114 0.965 . . . . 72.239999999999995 110.397 -178.852 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.4 m -120.05 115.0 22.84 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 109.923 -0.399 . . . . 72.340000000000003 109.923 -178.361 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.409 ' HB3' ' NH2' ' A' ' 44' ' ' ARG . 61.9 m-85 -104.45 102.97 12.6 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.717 1.207 . . . . 75.329999999999998 108.996 -175.423 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.442 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -105.57 161.25 14.53 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 122.84 0.456 . . . . 75.439999999999998 111.282 -179.261 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 20.2 ttt180 -169.15 130.11 1.13 Allowed 'General case' 0 N--CA 1.477 0.888 0 O-C-N 123.893 0.746 . . . . 72.040000000000006 109.778 174.303 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 26.0 m -93.16 111.82 23.57 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.006 0.923 . . . . 74.219999999999999 109.692 178.551 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.428 ' O ' ' HA ' ' A' ' 7' ' ' GLU . 87.5 m-85 -98.69 122.49 41.98 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.646 0.778 . . . . 74.140000000000001 110.363 -177.394 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 24.9 mp0 -88.69 111.07 21.52 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 107.972 -1.122 . . . . 72.239999999999995 107.972 174.479 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.532 HD11 HG21 ' A' ' 40' ' ' VAL . 80.9 mt -124.77 119.26 28.39 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.215 1.006 . . . . 75.040000000000006 108.459 -177.715 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 87.2 t80 -113.74 138.87 49.64 Favored 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 109.751 -0.462 . . . . 53.350000000000001 109.751 179.139 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -156.7 149.79 24.04 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.125 0.57 . . . . 73.239999999999995 110.187 175.073 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 26.7 t -68.48 -26.94 34.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 124.627 1.171 . . . . 64.129999999999995 110.417 175.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.543 ' HB3' ' HG2' ' A' ' 31' ' ' GLU . 74.4 mtt180 -135.35 137.71 42.65 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.111 0.964 . . . . 71.329999999999998 110.017 178.254 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -71.82 -17.78 62.13 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 123.269 0.628 . . . . 63.200000000000003 111.717 176.385 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.543 ' HG2' ' HB3' ' A' ' 29' ' ' ARG . 13.5 pt-20 -70.74 -27.68 64.14 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 122.621 0.368 . . . . 73.230000000000004 110.876 172.116 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.474 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 31.5 mm-40 -83.47 -23.04 32.39 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.22 0.608 . . . . 74.200000000000003 110.476 177.323 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.01 -21.29 65.95 Favored 'General case' 0 CA--C 1.56 1.364 0 C-N-CA 124.168 0.987 . . . . 71.340000000000003 110.106 178.031 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -48.29 -56.56 7.73 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 124.289 1.036 . . . . 74.120000000000005 112.505 178.856 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.419 ' HA ' ' HD3' ' A' ' 38' ' ' LYS . 1.9 pp20? -60.33 -31.87 70.71 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.215 0.606 . . . . 74.329999999999998 112.08 -176.711 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -70.59 -40.6 73.14 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.378 0.671 . . . . 73.340000000000003 110.59 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.47 HD13 HD23 ' A' ' 81' ' ' LEU . 77.6 mt -63.33 -33.65 75.99 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.717 0.807 . . . . 71.019999999999996 111.067 174.625 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.531 ' HA ' HD11 ' A' ' 88' ' ' LEU . 57.3 mtpt -65.3 -41.85 93.67 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.383 0.673 . . . . 63.409999999999997 110.93 175.54 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.405 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 42.7 mmtm -61.5 -51.51 68.35 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 109.392 -0.596 . . . . 74.400000000000006 109.392 175.762 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.532 HG21 HD11 ' A' ' 25' ' ' LEU . 38.7 t -54.05 -50.86 51.47 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 C-N-CA 124.781 1.232 . . . . 71.430000000000007 111.863 -178.64 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 80.1 mt -67.41 -51.53 50.65 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.165 0.586 . . . . 53.329999999999998 111.534 -177.366 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -66.1 -38.9 89.37 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.088 0.555 . . . . 71.439999999999998 112.296 -174.407 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -70.72 -42.54 70.46 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.022 0.529 . . . . 72.310000000000002 110.736 176.592 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.409 ' NH2' ' HB3' ' A' ' 19' ' ' TYR . 18.6 tpt180 -69.93 -34.49 73.53 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 122.658 0.383 . . . . 72.129999999999995 111.743 -178.23 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 62.0 mtp -91.88 -8.24 46.98 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.532 0.567 . . . . 73.030000000000001 112.532 -177.141 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -59.05 -49.29 94.04 Favored Pre-proline 0 CA--C 1.569 1.674 0 CA-C-O 118.9 -0.572 . . . . 73.340000000000003 111.673 174.692 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -67.54 -25.53 40.99 Favored 'Trans proline' 0 C--N 1.394 2.967 0 C-N-CA 122.035 1.824 . . . . 61.009999999999998 112.571 174.549 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.523 HG23 ' SG ' ' A' ' 14' ' ' CYS . 50.9 mm -72.64 -33.89 45.96 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.114 0 C-N-CA 124.169 0.988 . . . . 70.219999999999999 110.918 -177.831 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -71.09 -31.98 68.5 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.753 0.821 . . . . 75.019999999999996 110.073 176.043 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.7 tmmm? -71.7 -33.11 68.51 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 115.112 -0.949 . . . . 71.5 110.699 172.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 91.2 mt -69.43 -30.68 68.66 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 109.345 -0.613 . . . . 73.549999999999997 109.345 177.009 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 93.28 19.19 36.52 Favored Glycine 0 C--N 1.345 1.067 0 CA-C-N 115.446 -0.797 . . . . 75.400000000000006 113.787 172.16 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.448 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 71.6 m -71.35 102.82 2.7 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.837 0.319 . . . . 73.140000000000001 111.055 -177.856 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -55.67 -56.62 18.31 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.87 1.268 . . . . 72.340000000000003 110.016 176.567 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 14.1 tpp85 -103.23 125.54 49.95 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 114.781 -1.1 . . . . 73.340000000000003 109.366 176.021 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 26.8 m -122.09 142.97 36.31 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.03 0.932 . . . . 74.109999999999999 109.212 172.82 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.3 ttm105 -111.17 106.11 15.02 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 108.006 -1.109 . . . . 63.32 108.006 172.174 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 24.5 mt -101.57 112.46 34.7 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 N-CA-C 108.203 -1.036 . . . . 73.219999999999999 108.203 -179.431 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 46.5 m -100.73 104.61 15.89 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 107.859 -1.163 . . . . 75.129999999999995 107.859 176.302 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 75.8 mt -100.38 115.31 41.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 N-CA-C 109.081 -0.711 . . . . 74.0 109.081 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -101.66 123.97 46.54 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 108.518 -0.919 . . . . 75.420000000000002 108.518 172.383 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 7.8 p -93.19 130.5 42.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 N-CA-C 107.683 -1.229 . . . . 73.549999999999997 107.683 178.304 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.443 ' HB3' ' H ' ' A' ' 7' ' ' GLU . 12.2 tmtt? -81.76 118.79 23.15 Favored 'General case' 0 C--O 1.243 0.713 0 N-CA-C 107.11 -1.441 . . . . 55.109999999999999 107.11 179.429 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 23.1 m170 -72.5 131.65 42.82 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 115.328 -0.851 . . . . 73.200000000000003 108.989 -177.806 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 40.6 t -59.81 -45.05 93.57 Favored 'General case' 0 CA--C 1.55 0.963 0 O-C-N 123.948 0.78 . . . . 52.140000000000001 110.933 -179.73 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -154.97 163.83 39.75 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 123.523 0.729 . . . . 73.109999999999999 110.672 -178.488 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -56.66 -47.69 79.22 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.397 1.479 . . . . 43.100000000000001 112.817 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.43 -31.31 68.44 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 122.642 0.377 . . . . 74.519999999999996 111.015 177.699 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -76.79 -15.98 59.59 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 115.36 -0.837 . . . . 64.209999999999994 112.747 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -54.0 -54.84 33.51 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.901 0.48 . . . . 63.109999999999999 112.197 -174.632 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -66.85 -44.72 80.28 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.442 0.697 . . . . 53.049999999999997 111.196 -174.361 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 24.4 ttmm -63.62 -59.54 4.48 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 115.47 -0.786 . . . . 73.299999999999997 110.529 -178.946 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -74.14 -20.66 60.16 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 113.301 0.852 . . . . 71.040000000000006 113.301 -172.024 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.16 -43.34 64.74 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-N 119.386 0.994 . . . . 50.520000000000003 109.559 175.587 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -65.44 -37.91 88.28 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.115 0.966 . . . . 73.019999999999996 111.681 176.016 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -71.11 -44.24 66.05 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.048 0.539 . . . . 64.430000000000007 110.65 177.627 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -76.88 -18.73 58.15 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.253 0.621 . . . . 75.439999999999998 109.784 -176.728 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.12 -45.96 92.53 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.346 0.659 . . . . 75.430000000000007 109.904 169.886 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -73.03 -32.9 65.39 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 124.047 0.842 . . . . 54.030000000000001 111.391 178.313 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.459 ' O ' HG23 ' A' ' 84' ' ' VAL . 46.3 mm -62.81 -54.24 36.37 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 C-N-CA 123.095 0.558 . . . . 74.019999999999996 109.825 174.847 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.47 HD23 HD13 ' A' ' 37' ' ' LEU . 32.2 mt -60.41 -44.99 95.17 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.8 0.84 . . . . 52.100000000000001 110.339 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 57.5 t30 -64.27 -33.7 76.41 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.602 0.761 . . . . 73.430000000000007 110.721 -175.446 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.473 ' O ' ' HG2' ' A' ' 87' ' ' GLU . 27.7 mmtp -73.04 -35.16 66.69 Favored 'General case' 0 C--O 1.213 -0.843 0 CA-C-O 119.007 -0.52 . . . . 71.230000000000004 111.485 174.15 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 80' ' ' ILE . 69.0 t -66.81 -36.44 77.22 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 CA-C-O 121.388 0.614 . . . . 73.420000000000002 110.604 177.286 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.562 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 24.2 m-85 -62.38 -43.24 99.28 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 114.9 -1.045 . . . . 65.219999999999999 109.623 173.33 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -69.45 -28.53 66.19 Favored 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 122.851 0.46 . . . . 74.340000000000003 111.461 175.933 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.473 ' HG2' ' O ' ' A' ' 83' ' ' LYS . 58.0 mm-40 -65.11 -34.75 79.14 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 124.084 0.954 . . . . 73.109999999999999 110.84 177.65 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.531 HD11 ' HA ' ' A' ' 38' ' ' LYS . 70.9 mt -107.27 -6.6 17.14 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 122.994 0.518 . . . . 74.109999999999999 112.204 -170.188 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 93.28 54.9 1.65 Allowed Glycine 0 C--N 1.346 1.09 0 CA-C-O 121.331 0.406 . . . . 52.420000000000002 113.267 176.083 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.562 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 72.9 m-85 -118.16 145.96 44.55 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 106.816 -1.55 . . . . 73.239999999999995 106.816 169.236 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -76.83 158.44 30.82 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 122.949 0.5 . . . . 63.229999999999997 110.273 178.242 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -64.82 -35.94 82.74 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.333 0.653 . . . . 71.030000000000001 110.359 176.515 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 18.1 m -51.11 -35.38 35.02 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 124.938 1.295 . . . . 72.120000000000005 112.975 174.664 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ASN . . . . . 0.433 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 3.2 m-20 -58.96 -37.88 77.79 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 124.057 0.943 . . . . 75.530000000000001 110.973 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 17.6 t -83.73 110.24 18.23 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 C-N-CA 124.183 0.993 . . . . 54.350000000000001 109.502 -169.758 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 51.8 m -139.26 113.98 9.24 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 122.867 0.467 . . . . 42.329999999999998 109.972 174.035 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.443 ' HA ' ' HA ' ' A' ' 102' ' ' VAL . 60.7 m95 -79.04 121.77 25.38 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.197 0.599 . . . . 72.329999999999998 110.597 176.709 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -101.07 87.9 3.38 Favored 'General case' 0 C--O 1.242 0.678 0 C-N-CA 124.79 1.236 . . . . 75.299999999999997 107.71 168.623 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.87 -103.1 0.78 Allowed Glycine 0 C--N 1.343 0.956 0 CA-C-N 115.82 -0.627 . . . . 64.420000000000002 112.196 -174.924 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -106.4 -8.51 17.13 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.405 0.682 . . . . 70.239999999999995 111.645 -176.561 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 37.3 m -109.71 127.21 54.44 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 108.881 -0.785 . . . . 51.420000000000002 108.881 178.694 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' VAL . . . . . 0.443 ' HA ' ' HA ' ' A' ' 97' ' ' TRP . 8.1 p -95.32 118.4 41.43 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 N-CA-C 108.841 -0.8 . . . . 71.420000000000002 108.841 176.458 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 39.4 m -92.72 100.41 12.91 Favored 'General case' 0 C--O 1.242 0.67 0 N-CA-C 107.576 -1.268 . . . . 64.310000000000002 107.576 176.695 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.451 HG21 ' CZ ' ' A' ' 85' ' ' PHE . 60.8 t -103.69 110.3 29.66 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 N-CA-C 108.301 -1.0 . . . . 72.349999999999994 108.301 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -101.71 111.46 23.71 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 108.526 -0.916 . . . . 71.239999999999995 108.526 176.66 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -116.57 155.16 16.37 Favored Glycine 0 C--N 1.342 0.876 0 CA-C-N 115.421 -0.809 . . . . 70.420000000000002 112.594 -172.692 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 . . . . . 0 C--O 1.243 0.75 0 C-N-CA 123.475 0.71 . . . . 60.32 109.217 170.413 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 57.2 mttm . . . . . 0 C--O 1.245 0.858 0 CA-C-O 120.891 0.376 . . . . 71.510000000000005 110.61 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -80.35 102.67 9.71 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 105.432 -2.062 . . . . 65.209999999999994 105.432 160.959 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.1 p -102.42 134.29 43.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 124.373 1.069 . . . . 53.039999999999999 108.44 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.569 ' HB2' ' HG3' ' A' ' 63' ' ' LYS . 46.8 mt-10 -107.96 115.2 29.69 Favored 'General case' 0 C--O 1.243 0.728 0 N-CA-C 107.876 -1.157 . . . . 71.420000000000002 107.876 175.9 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 99.1 t -95.72 109.27 22.33 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 CA-C-N 114.025 -1.443 . . . . 64.120000000000005 108.333 -174.843 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.46 ' HG2' HG23 ' A' ' 22' ' ' THR . 36.5 mt-30 -94.21 100.97 12.95 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 107.933 -1.136 . . . . 74.150000000000006 107.933 -176.151 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 98.5 t -95.77 104.2 15.56 Favored 'Isoleucine or valine' 0 C--O 1.243 0.753 0 N-CA-C 108.779 -0.823 . . . . 51.229999999999997 108.779 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.491 ' HG3' ' HB3' ' A' ' 20' ' ' GLU . 39.0 ttpt -108.64 102.54 11.59 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 108.042 -1.095 . . . . 73.430000000000007 108.042 -179.261 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.5 HD13 HG13 ' A' ' 48' ' ' ILE . 15.8 tt -111.48 120.19 61.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 C-N-CA 123.364 0.666 . . . . 75.519999999999996 110.29 -176.142 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 7.0 m -92.28 108.46 19.97 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 108.605 -0.887 . . . . 62.43 108.605 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.669 ' SG ' HG23 ' A' ' 48' ' ' ILE . 52.5 t -128.7 119.34 24.46 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.947 0.899 . . . . 75.540000000000006 108.986 -175.157 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.496 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 22.1 t-20 77.3 -8.61 1.65 Allowed 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 126.327 1.851 . . . . 74.340000000000003 112.602 173.619 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 124.17 -4.43 8.96 Favored Glycine 0 C--N 1.341 0.857 0 CA-C-O 119.861 -0.41 . . . . 44.039999999999999 112.588 -175.0 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -106.25 144.97 32.19 Favored 'General case' 0 C--O 1.241 0.642 0 C-N-CA 123.084 0.554 . . . . 74.140000000000001 109.672 179.485 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 47.2 m -94.32 108.32 20.22 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.809 0.844 . . . . 75.420000000000002 108.731 177.171 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 70.6 m-85 -101.65 101.35 11.86 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 107.843 -1.169 . . . . 75.109999999999999 107.843 177.191 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.491 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 0.2 OUTLIER -123.23 141.84 51.56 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 122.846 0.458 . . . . 75.510000000000005 111.049 -178.146 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 41.1 ttm180 -154.94 135.8 13.69 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.374 -0.83 . . . . 72.209999999999994 108.94 177.055 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.46 HG23 ' HG2' ' A' ' 9' ' ' GLN . 29.8 m -94.6 117.13 29.65 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.377 1.071 . . . . 75.349999999999994 108.31 177.668 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -99.17 120.28 39.24 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.111 0.964 . . . . 71.209999999999994 110.034 -176.644 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -83.33 109.24 17.11 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 108.204 -1.036 . . . . 73.299999999999997 108.204 178.104 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 96.6 mt -119.49 148.36 43.36 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.02 0.928 . . . . 75.340000000000003 109.101 179.718 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 54.0 t80 -136.39 139.86 42.79 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 108.42 -0.955 . . . . 72.299999999999997 108.42 174.372 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.58 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -162.72 151.81 15.12 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 123.683 0.793 . . . . 73.340000000000003 109.377 174.877 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 43.5 t -76.0 -71.14 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 N-CA-C 108.633 -0.877 . . . . 72.530000000000001 108.633 175.377 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.488 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 57.1 mtp85 -82.18 155.36 25.0 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.352 0.596 . . . . 73.540000000000006 110.977 -179.52 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -68.63 -28.65 67.09 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 114.952 -1.022 . . . . 70.140000000000001 110.955 175.857 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 60.8 mm-40 -58.61 -36.07 73.47 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.529 0.732 . . . . 73.530000000000001 111.644 171.801 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.58 ' HB2' ' HB1' ' A' ' 27' ' ' ALA . 9.2 mm-40 -67.58 -34.09 76.34 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 123.717 0.807 . . . . 74.319999999999993 110.822 -179.443 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.424 HD23 ' HB3' ' A' ' 27' ' ' ALA . 0.2 OUTLIER -73.07 -25.26 60.84 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.554 0.742 . . . . 70.549999999999997 110.871 -177.633 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -53.94 -59.73 4.25 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.766 0.826 . . . . 65.310000000000002 112.252 -178.855 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -57.65 -33.46 68.32 Favored 'General case' 0 N--CA 1.479 0.987 0 O-C-N 124.088 0.868 . . . . 63.439999999999998 111.894 -178.884 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.407 ' O ' HG23 ' A' ' 40' ' ' VAL . 64.6 mttm -68.66 -44.9 73.12 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 123.418 0.687 . . . . 74.530000000000001 109.912 -179.467 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 89.6 mt -65.08 -36.84 85.61 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.767 0.827 . . . . 64.319999999999993 111.482 178.241 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.541 ' HA ' HD11 ' A' ' 88' ' ' LEU . 59.2 mtpt -63.58 -43.22 97.61 Favored 'General case' 0 C--N 1.357 0.897 0 C-N-CA 122.778 0.431 . . . . 71.349999999999994 110.138 177.18 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -66.92 -47.91 70.27 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 123.467 0.479 . . . . 72.109999999999999 111.623 176.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.412 ' O ' ' HB2' ' A' ' 44' ' ' ARG . 54.8 t -57.86 -41.87 80.88 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.227 0 C-N-CA 123.57 0.748 . . . . 64.010000000000005 110.747 -178.552 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.574 HD21 HD11 ' A' ' 60' ' ' ILE . 74.6 mt -72.21 -51.12 22.53 Favored 'General case' 0 C--O 1.217 -0.633 0 CA-C-O 118.755 -0.64 . . . . 75.0 111.425 178.977 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -55.69 -50.21 70.88 Favored 'General case' 0 N--CA 1.496 1.851 0 C-N-CA 122.901 0.48 . . . . 64.510000000000005 112.027 -179.027 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 56.3 mm-40 -63.01 -34.77 78.27 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 115.966 -0.561 . . . . 63.409999999999997 110.827 178.837 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.412 ' HB2' ' O ' ' A' ' 40' ' ' VAL . 20.5 tpt180 -65.7 -45.52 82.48 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.296 0.638 . . . . 75.120000000000005 110.954 176.887 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.471 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 94.6 mmm -80.57 -21.83 41.33 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.698 0.799 . . . . 63.420000000000002 112.379 -170.13 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -57.38 -55.73 41.38 Favored Pre-proline 0 CA--C 1.565 1.531 0 O-C-N 123.721 0.638 . . . . 63.340000000000003 111.521 -178.212 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.418 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 60.8 Cg_endo -69.27 -24.71 31.61 Favored 'Trans proline' 0 C--N 1.389 2.689 0 C-N-CA 121.623 1.549 . . . . 62.119999999999997 112.334 177.942 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.669 HG23 ' SG ' ' A' ' 14' ' ' CYS . 44.7 mm -69.99 -34.42 59.7 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.015 0 C-N-CA 123.938 0.895 . . . . 61.43 111.506 -177.964 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 58.4 mtpt -67.14 -35.6 80.07 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 109.998 -0.371 . . . . 55.229999999999997 109.998 173.591 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.32 -35.65 79.85 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 123.772 0.829 . . . . 73.209999999999994 109.376 176.088 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.452 HD12 HD13 ' A' ' 48' ' ' ILE . 91.7 mt -70.79 -23.29 62.35 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 122.86 0.464 . . . . 72.25 110.008 175.973 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 71.88 39.63 59.0 Favored Glycine 0 C--N 1.343 0.97 0 CA-C-N 115.667 -0.697 . . . . 75.099999999999994 113.968 168.78 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.496 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 72.8 m -79.03 111.76 15.55 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 122.498 0.319 . . . . 64.049999999999997 111.03 -178.462 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -46.74 -37.22 8.16 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 126.177 1.791 . . . . 71.310000000000002 112.864 178.986 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.472 ' HD2' ' N ' ' A' ' 56' ' ' VAL . 0.0 OUTLIER -146.2 136.86 24.16 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 107.469 -1.308 . . . . 75.310000000000002 107.469 175.096 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.472 ' N ' ' HD2' ' A' ' 55' ' ' ARG . 31.0 m -124.66 142.14 42.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 124.472 1.109 . . . . 71.25 109.879 177.075 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 -111.01 105.5 14.28 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 109.056 -0.72 . . . . 72.129999999999995 109.056 176.357 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.44 HD11 ' SD ' ' A' ' 45' ' ' MET . 52.0 mt -94.79 109.59 22.51 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 125.312 1.445 . . . . 71.140000000000001 108.184 176.954 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 27.4 m -107.19 105.48 15.48 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 108.229 -1.026 . . . . 73.0 108.229 177.069 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.574 HD11 HD21 ' A' ' 41' ' ' LEU . 79.8 mt -97.6 122.83 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 123.564 0.746 . . . . 75.150000000000006 109.341 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 79.6 mtt-85 -110.68 138.01 47.62 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.515 0.726 . . . . 73.109999999999999 109.604 174.712 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.5 p -99.39 139.64 20.62 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 N-CA-C 108.21 -1.033 . . . . 73.549999999999997 108.21 170.235 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.569 ' HG3' ' HB2' ' A' ' 7' ' ' GLU . 10.6 mmpt? -81.97 127.48 33.09 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 122.641 0.376 . . . . 75.349999999999994 110.438 178.81 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 20.2 p80 -147.16 154.16 40.74 Favored 'General case' 0 C--O 1.24 0.564 0 C-N-CA 123.896 0.878 . . . . 55.240000000000002 110.598 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 71.8 p -164.91 32.66 0.06 Allowed 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.981 0.912 . . . . 62.240000000000002 109.056 174.414 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -135.85 82.11 1.93 Allowed 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 107.509 -1.293 . . . . 53.420000000000002 107.509 -175.904 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.61 -6.23 5.04 Favored 'General case' 0 N--CA 1.483 1.181 0 N-CA-C 113.911 1.078 . . . . 44.530000000000001 113.911 -166.08 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -78.48 -66.99 0.78 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.231 0.612 . . . . 74.510000000000005 110.205 170.766 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.414 ' O ' ' HG2' ' A' ' 73' ' ' GLU . 44.5 mm-40 -84.35 -27.65 27.58 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 113.384 0.883 . . . . 75.349999999999994 113.384 -168.876 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -59.73 -29.39 68.11 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 112.943 0.72 . . . . 71.310000000000002 112.943 -172.437 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -76.36 -30.23 57.51 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.029 0.932 . . . . 73.329999999999998 110.496 -178.521 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -72.94 -41.72 64.2 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.417 1.087 . . . . 61.030000000000001 109.884 172.513 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.414 ' HG2' ' O ' ' A' ' 69' ' ' GLU . 10.7 mm-40 -79.92 -23.0 42.06 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 115.781 -0.645 . . . . 72.120000000000005 111.946 -173.345 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -76.48 -40.3 50.71 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 122.824 0.449 . . . . 44.140000000000001 109.947 174.755 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.3 ttmm -57.26 -41.71 80.19 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 124.238 1.015 . . . . 74.239999999999995 110.587 170.603 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -66.75 -45.02 79.88 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 114.423 -1.262 . . . . 50.520000000000003 110.712 178.603 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -72.7 -22.35 60.91 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.411 1.084 . . . . 74.120000000000005 110.089 -176.609 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.423 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -63.87 -46.51 84.6 Favored 'General case' 0 C--N 1.354 0.761 0 C-N-CA 123.812 0.845 . . . . 33.25 110.472 173.861 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.38 -34.96 73.18 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 115.372 -0.831 . . . . 63.009999999999998 111.533 178.531 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.402 ' O ' HG23 ' A' ' 84' ' ' VAL . 31.9 mm -62.13 -54.76 30.1 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 123.636 0.775 . . . . 72.219999999999999 111.224 177.096 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 16.2 mt -67.78 -26.97 66.37 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 122.564 0.345 . . . . 75.230000000000004 111.535 178.076 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -61.63 -37.54 84.34 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.045 0.538 . . . . 63.049999999999997 110.074 174.898 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.1 mmmp? -69.07 -47.37 65.45 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 115.9 -0.591 . . . . 53.009999999999998 110.931 172.322 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.43 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 71.8 t -61.01 -55.96 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 123.745 0.818 . . . . 70.010000000000005 111.083 -172.314 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.458 ' CZ ' HG21 ' A' ' 104' ' ' VAL . 35.0 m-85 -56.6 -44.26 80.93 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 124.218 0.949 . . . . 74.349999999999994 111.607 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.41 -32.06 73.39 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.19 0.596 . . . . 75.319999999999993 111.633 -179.268 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -86.15 -12.34 50.19 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.858 0.863 . . . . 43.329999999999998 111.77 -179.921 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.541 HD11 ' HA ' ' A' ' 38' ' ' LYS . 41.7 mt -106.64 8.97 31.42 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.126 0.57 . . . . 70.540000000000006 111.253 -179.213 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 86.54 14.8 65.05 Favored Glycine 0 C--N 1.347 1.172 0 N-CA-C 114.221 0.448 . . . . 55.130000000000003 114.221 174.082 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.434 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 63.4 m-85 -94.94 134.66 37.35 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.285 0.634 . . . . 72.450000000000003 110.304 174.636 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -88.47 162.03 16.69 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.001 0.92 . . . . 73.400000000000006 108.957 178.665 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -60.94 -28.29 68.85 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.635 0.774 . . . . 64.0 111.9 177.137 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 35.9 t -59.56 -31.36 69.35 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.087 0.955 . . . . 74.030000000000001 111.466 177.634 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ASN . . . . . 0.574 HD22 ' HA2' ' A' ' 106' ' ' GLY . 18.7 m120 -76.04 -32.89 59.55 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 122.902 0.481 . . . . 71.049999999999997 111.019 178.196 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 44.5 t -106.42 116.21 49.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 123.515 0.726 . . . . 60.32 111.287 -165.336 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 10.6 t -126.07 122.93 37.21 Favored 'General case' 0 CA--C 1.556 1.199 0 C-N-CA 123.06 0.544 . . . . 74.310000000000002 110.065 173.388 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.423 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 37.8 m95 -91.12 146.05 24.17 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.567 0.747 . . . . 64.349999999999994 112.086 -177.795 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -152.31 73.93 1.06 Allowed 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 115.303 -0.862 . . . . 51.530000000000001 109.129 172.404 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 61.47 -93.41 0.08 OUTLIER Glycine 0 C--N 1.352 1.444 0 CA-C-N 114.443 -1.253 . . . . 32.340000000000003 114.656 173.425 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -69.23 -43.99 72.93 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.831 1.253 . . . . 75.519999999999996 111.251 -176.587 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 16.8 m -121.37 139.73 53.05 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.354 -0.839 . . . . 71.430000000000007 110.053 -171.57 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 6.7 p -107.04 126.67 63.09 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 N-CA-C 108.593 -0.891 . . . . 60.549999999999997 108.593 166.785 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 33.5 m -96.23 104.03 15.96 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 107.947 -1.131 . . . . 72.109999999999999 107.947 177.406 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.458 HG21 ' CZ ' ' A' ' 85' ' ' PHE . 58.9 t -105.38 110.6 31.61 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.516 0 N-CA-C 107.623 -1.251 . . . . 75.040000000000006 107.623 178.327 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' GLU . . . . . 0.409 ' HB3' ' HD3' ' A' ' 55' ' ' ARG . 46.3 mt-10 -109.96 110.03 20.83 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 107.728 -1.212 . . . . 73.340000000000003 107.728 173.433 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 106' ' ' GLY . . . . . 0.574 ' HA2' HD22 ' A' ' 94' ' ' ASN . . . -118.78 135.22 11.32 Favored Glycine 0 C--N 1.342 0.909 0 N-CA-C 111.437 -0.665 . . . . 71.519999999999996 111.437 -179.286 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 4.3 pm0 . . . . . 0 C--O 1.24 0.58 0 N-CA-C 108.047 -1.094 . . . . 65.329999999999998 108.047 172.167 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.611 0 N-CA-C 109.847 -0.427 . . . . 74.349999999999994 109.847 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.486 ' HA ' ' HA ' ' A' ' 26' ' ' TYR . 5.8 ttpm? -86.71 113.1 22.28 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 108.931 -0.766 . . . . 71.549999999999997 108.931 173.398 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.462 HG21 HG23 ' A' ' 62' ' ' VAL . 1.6 p -100.35 138.09 25.75 Favored 'Isoleucine or valine' 0 C--O 1.241 0.636 0 N-CA-C 107.544 -1.28 . . . . 65.540000000000006 107.544 170.165 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.514 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 40.2 mt-10 -100.16 113.12 25.54 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 107.445 -1.317 . . . . 60.009999999999998 107.445 176.024 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.414 HG13 HG23 ' A' ' 60' ' ' ILE . 90.0 t -95.38 107.25 19.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 N-CA-C 108.033 -1.099 . . . . 74.120000000000005 108.033 -176.898 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -95.08 100.1 11.98 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 108.294 -1.002 . . . . 74.219999999999999 108.294 -175.526 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 64.1 t -95.09 107.98 20.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 N-CA-C 108.968 -0.753 . . . . 60.43 108.968 -177.28 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.0 ttmm -109.82 103.65 12.49 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 108.356 -0.979 . . . . 71.0 108.356 -179.48 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.496 HD13 HG13 ' A' ' 48' ' ' ILE . 15.0 tt -112.29 123.35 67.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 CA-C-O 121.22 0.534 . . . . 74.409999999999997 110.618 -176.997 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 17.4 m -100.16 103.3 14.77 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 108.726 -0.842 . . . . 75.420000000000002 108.726 -179.033 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 35.1 t -113.73 129.17 56.61 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.784 0.833 . . . . 73.239999999999995 110.004 -178.717 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 72.08 -72.64 0.11 Allowed 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 125.584 1.553 . . . . 61.140000000000001 110.934 176.278 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -163.93 16.54 0.11 Allowed Glycine 0 C--N 1.34 0.793 0 CA-C-O 119.924 -0.375 . . . . 61.420000000000002 112.21 176.512 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -127.92 156.05 43.24 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.741 0.816 . . . . 73.319999999999993 110.638 -179.098 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 62.2 m -104.23 121.72 43.88 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.166 0.986 . . . . 62.119999999999997 109.814 179.151 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 39.6 m-85 -116.11 105.28 12.43 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 108.084 -1.08 . . . . 70.019999999999996 108.084 178.424 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -135.76 154.61 51.18 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 112.291 0.478 . . . . 70.219999999999999 112.291 -173.8 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 75.4 ttt180 -161.52 140.81 10.06 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 114.942 -1.026 . . . . 61.100000000000001 109.65 177.116 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 88.4 m -90.86 114.52 26.97 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 123.818 0.847 . . . . 73.349999999999994 109.208 174.448 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -98.17 129.77 44.94 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.549 0.74 . . . . 74.530000000000001 109.871 -178.162 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -89.95 108.31 19.64 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 108.104 -1.073 . . . . 71.040000000000006 108.104 178.84 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 82.9 mt -122.96 100.95 7.15 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.326 0.65 . . . . 62.509999999999998 109.83 -173.87 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.486 ' HA ' ' HA ' ' A' ' 5' ' ' LYS . 80.0 t80 -84.18 131.95 34.71 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 109.637 -0.505 . . . . 75.219999999999999 109.637 172.886 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.567 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -132.63 149.89 52.24 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.399 0.68 . . . . 74.140000000000001 109.445 175.97 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 60.6 t -87.76 -36.66 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-O 122.035 0.921 . . . . 75.340000000000003 109.442 176.69 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.42 ' O ' ' HB1' ' A' ' 27' ' ' ALA . 84.0 mtt180 -121.31 155.93 33.65 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 107.217 -1.401 . . . . 72.230000000000004 107.217 170.121 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -56.51 -30.28 62.84 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.265 0.626 . . . . 74.540000000000006 110.602 166.561 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -65.3 -28.95 69.68 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.646 1.178 . . . . 65.430000000000007 112.086 176.673 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.567 ' HB2' ' HB1' ' A' ' 27' ' ' ALA . 19.9 mm-40 -67.98 -32.78 73.44 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 110.511 -0.181 . . . . 65.310000000000002 110.511 176.936 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.722 HD22 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -71.34 -16.81 62.45 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.585 0.754 . . . . 72.420000000000002 111.334 -177.08 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -53.51 -64.89 0.68 Allowed 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.554 0.741 . . . . 65.319999999999993 111.949 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -59.67 -30.16 68.56 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 124.218 0.949 . . . . 62.130000000000003 112.383 -178.943 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.722 ' HD2' HD22 ' A' ' 33' ' ' LEU . 50.4 mttm -66.1 -47.09 75.35 Favored 'General case' 0 C--N 1.355 0.814 0 C-N-CA 123.099 0.56 . . . . 75.230000000000004 110.06 178.31 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.581 HD13 HD23 ' A' ' 81' ' ' LEU . 85.1 mt -59.54 -43.74 93.43 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 124.128 0.893 . . . . 72.450000000000003 110.993 177.456 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.599 ' HA ' HD11 ' A' ' 88' ' ' LEU . 54.3 mtpt -58.3 -50.95 71.8 Favored 'General case' 0 C--N 1.358 0.939 0 O-C-N 123.999 0.812 . . . . 73.310000000000002 111.1 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -66.18 -47.0 75.38 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 123.537 0.523 . . . . 64.439999999999998 111.328 -178.761 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 40.3 t -54.68 -43.73 67.18 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 C-N-CA 123.73 0.812 . . . . 64.310000000000002 111.542 179.269 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.65 HD21 HD11 ' A' ' 60' ' ' ILE . 46.7 mt -66.15 -48.51 70.54 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.206 0.603 . . . . 73.430000000000007 111.246 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -58.61 -49.21 78.3 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.229 0.611 . . . . 74.25 111.439 179.389 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -66.8 -40.02 87.94 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.407 1.083 . . . . 71.310000000000002 111.565 -176.203 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -66.09 -41.14 91.05 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 123.452 0.47 . . . . 75.409999999999997 110.714 176.325 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.473 ' SD ' ' OH ' ' A' ' 90' ' ' TYR . 48.1 mtp -92.49 -7.98 45.88 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 113.905 1.076 . . . . 62.43 113.905 -172.072 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -67.24 -44.8 49.34 Favored Pre-proline 0 CA--C 1.564 1.494 0 CA-C-O 118.995 -0.526 . . . . 73.019999999999996 111.581 -179.695 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.409 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 59.5 Cg_endo -71.2 -22.93 25.07 Favored 'Trans proline' 0 C--N 1.386 2.536 0 C-N-CA 121.692 1.595 . . . . 60.130000000000003 113.139 169.979 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.521 HD13 HD12 ' A' ' 51' ' ' LEU . 43.5 mm -66.64 -32.67 59.09 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 C-N-CA 123.494 0.717 . . . . 74.230000000000004 110.487 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.435 ' HG3' ' O ' ' A' ' 45' ' ' MET . 90.2 mttt -55.97 -50.45 70.76 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-O 121.512 0.672 . . . . 65.109999999999999 109.268 172.882 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -65.55 -29.34 69.94 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 114.044 -1.434 . . . . 64.510000000000005 111.48 -177.383 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.521 HD12 HD13 ' A' ' 48' ' ' ILE . 87.8 mt -71.76 -29.5 64.57 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 122.588 0.355 . . . . 72.239999999999995 110.759 175.605 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 72.13 84.25 0.23 Allowed Glycine 0 C--N 1.35 1.336 0 O-C-N 123.763 0.664 . . . . 53.219999999999999 113.082 170.427 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 1.2 p -131.64 134.08 45.6 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.322 0.649 . . . . 61.43 111.234 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -72.3 -37.07 69.07 Favored 'General case' 0 C--N 1.356 0.869 0 C-N-CA 124.302 1.041 . . . . 71.140000000000001 110.586 -178.634 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 41.8 ttm180 -127.42 131.96 50.17 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 109.627 -0.509 . . . . 72.25 109.627 175.642 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 31.5 m -120.37 137.66 53.44 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 124.961 1.304 . . . . 73.540000000000006 108.385 171.129 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.422 ' O ' ' HA ' ' A' ' 12' ' ' ILE . 24.9 ttm180 -108.26 106.61 16.85 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 108.304 -0.999 . . . . 75.349999999999994 108.304 173.191 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.432 HD11 ' SD ' ' A' ' 45' ' ' MET . 30.9 mt -96.72 105.38 17.03 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 N-CA-C 108.187 -1.042 . . . . 71.030000000000001 108.187 178.062 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 27.7 t -105.13 103.21 12.71 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 107.844 -1.169 . . . . 72.329999999999998 107.844 -179.558 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.65 HD11 HD21 ' A' ' 41' ' ' LEU . 66.6 mt -101.2 121.67 52.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 123.625 0.77 . . . . 75.549999999999997 109.829 -176.809 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -102.14 134.72 44.93 Favored 'General case' 0 C--O 1.241 0.611 0 N-CA-C 109.35 -0.611 . . . . 55.25 109.35 175.771 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.462 HG23 HG21 ' A' ' 6' ' ' VAL . 7.3 p -95.93 116.44 37.72 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.047 0 N-CA-C 106.975 -1.491 . . . . 74.319999999999993 106.975 173.147 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.514 ' HB3' ' H ' ' A' ' 7' ' ' GLU . 24.2 tptm -90.57 110.36 21.5 Favored 'General case' 0 C--O 1.239 0.529 0 O-C-N 121.366 -0.834 . . . . 75.219999999999999 108.903 -176.849 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 18.7 p80 -110.56 111.5 22.77 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.356 1.063 . . . . 63.100000000000001 108.558 178.719 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 27.7 t -70.9 -30.72 67.16 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 122.979 0.512 . . . . 70.140000000000001 110.425 177.4 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -85.64 155.44 21.12 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.009 0.924 . . . . 62.119999999999997 110.276 177.248 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.05 -8.65 11.19 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.143 0.977 . . . . 23.219999999999999 112.375 -176.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -86.22 -68.67 0.72 Allowed 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.068 0.547 . . . . 64.150000000000006 111.652 -175.822 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -76.1 -17.63 59.52 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.385 1.074 . . . . 75.209999999999994 112.685 -174.107 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -58.12 -26.07 62.18 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 114.14 1.163 . . . . 72.530000000000001 114.14 -170.785 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.5 pttp -66.56 -38.42 87.05 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 123.409 0.684 . . . . 74.510000000000005 110.943 174.246 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -70.5 -44.8 66.89 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.794 0.838 . . . . 51.32 109.322 173.031 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.504 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 24.3 mm-40 -68.52 -17.89 64.26 Favored 'General case' 0 C--N 1.353 0.746 0 O-C-N 124.389 1.055 . . . . 71.120000000000005 111.97 -176.018 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.14 -54.77 18.15 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 122.766 0.426 . . . . 64.319999999999993 110.538 174.298 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 50.3 mtpt -63.77 -41.14 98.03 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 124.265 0.978 . . . . 74.319999999999993 111.178 177.437 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.504 ' HB3' ' HA ' ' A' ' 73' ' ' GLU . 50.2 tttm -65.93 -42.16 90.43 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.257 1.423 . . . . 73.219999999999999 111.232 -178.03 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -79.1 -21.85 46.06 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.485 0.714 . . . . 74.510000000000005 110.815 176.561 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.2 -42.73 99.37 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 122.664 0.386 . . . . 60.030000000000001 110.418 176.275 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.64 -35.39 77.79 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.359 0.664 . . . . 64.140000000000001 111.259 176.351 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 49.3 mm -64.57 -46.31 92.95 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.801 0 C-N-CA 124.212 1.005 . . . . 74.420000000000002 110.297 174.863 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.581 HD23 HD13 ' A' ' 37' ' ' LEU . 48.1 mt -64.67 -48.1 76.0 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.683 0.793 . . . . 72.140000000000001 111.52 -178.872 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 61.9 m-80 -62.35 -34.14 76.08 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 123.669 0.606 . . . . 72.430000000000007 111.446 -173.807 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.8 mmmm -72.64 -37.28 68.05 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 123.261 0.351 . . . . 75.239999999999995 111.785 176.674 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.496 HG13 ' HG2' ' A' ' 38' ' ' LYS . 40.4 t -66.61 -52.54 44.69 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.121 0 C-N-CA 123.474 0.71 . . . . 73.310000000000002 110.168 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.572 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 29.9 m-85 -56.25 -42.98 78.25 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 124.36 1.038 . . . . 74.319999999999993 111.229 176.746 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -59.87 -34.0 72.56 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.788 0.835 . . . . 52.310000000000002 112.4 179.574 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -86.37 -15.44 40.44 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.353 0.661 . . . . 55.420000000000002 112.429 -176.278 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.599 HD11 ' HA ' ' A' ' 38' ' ' LYS . 78.2 mt -106.57 -9.51 16.56 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 112.474 0.546 . . . . 72.430000000000007 112.474 -171.949 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 118.51 14.4 6.36 Favored Glycine 0 N--CA 1.478 1.44 0 N-CA-C 113.918 0.327 . . . . 62.310000000000002 113.918 174.388 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.572 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 12.6 m-85 -109.2 150.08 28.43 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 108.745 -0.835 . . . . 74.209999999999994 108.745 174.651 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -86.12 166.89 15.43 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 109.697 -0.483 . . . . 75.25 109.697 171.029 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -88.48 32.38 0.78 Allowed 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 121.541 0.686 . . . . 31.309999999999999 110.062 174.359 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 79.2 p -110.46 -28.36 8.57 Favored 'General case' 0 C--N 1.343 0.325 0 C-N-CA 125.065 1.346 . . . . 43.219999999999999 108.112 176.018 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -76.97 -9.54 58.76 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.122 -0.944 . . . . 73.510000000000005 110.957 178.342 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 23.3 t -89.34 99.26 9.05 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.796 0 N-CA-C 108.751 -0.833 . . . . 73.329999999999998 108.751 -175.331 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 59.5 m -126.22 106.14 9.33 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.609 0.763 . . . . 60.350000000000001 109.636 -176.556 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 56.1 m95 -77.04 111.88 13.08 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.318 0.647 . . . . 73.120000000000005 110.461 177.028 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -108.44 95.17 5.48 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 105.437 -2.06 . . . . 73.120000000000005 105.437 170.053 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 64.95 -121.87 22.76 Favored Glycine 0 C--N 1.345 1.035 0 O-C-N 123.741 0.65 . . . . 61.240000000000002 112.106 -172.3 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -90.89 0.33 57.52 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.763 0.825 . . . . 52.32 111.444 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 63.5 m -119.48 118.95 32.46 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.543 0.737 . . . . 45.200000000000003 110.362 -169.834 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' VAL . . . . . 0.476 HG11 HD13 ' A' ' 81' ' ' LEU . 7.2 p -91.9 128.02 43.82 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.184 0 N-CA-C 109.052 -0.722 . . . . 64.040000000000006 109.052 173.96 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 40.5 m -105.08 112.24 25.29 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.567 0.747 . . . . 64.439999999999998 109.129 178.799 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 78.7 t -114.91 113.01 42.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 125.262 1.425 . . . . 75.340000000000003 108.112 179.54 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.4 145.65 46.98 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 109.217 -0.66 . . . . 72.439999999999998 109.217 -179.614 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 161.77 -147.91 14.78 Favored Glycine 0 C--N 1.332 0.35 0 N-CA-C 110.917 -0.873 . . . . 31.210000000000001 110.917 -173.41 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 5.0 pm0 . . . . . 0 N--CA 1.471 0.584 0 CA-C-N 117.226 0.513 . . . . 62.130000000000003 110.103 177.76 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 63.4 mttm . . . . . 0 N--CA 1.469 0.522 0 CA-C-O 120.953 0.406 . . . . 51.350000000000001 111.397 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.437 ' HE3' ' HB3' ' A' ' 5' ' ' LYS . 1.0 OUTLIER -101.13 105.25 16.38 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 106.635 -1.617 . . . . 75.099999999999994 106.635 169.664 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.3 p -98.79 144.77 11.22 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 N-CA-C 109.083 -0.71 . . . . 72.409999999999997 109.083 176.341 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.485 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 41.0 mt-10 -100.46 110.6 22.79 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 107.49 -1.3 . . . . 73.519999999999996 107.49 170.03 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.454 HG21 HD12 ' A' ' 25' ' ' LEU . 77.2 t -99.54 106.68 19.41 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 125.072 1.349 . . . . 63.450000000000003 108.282 -179.372 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -98.73 100.28 11.48 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 107.824 -1.176 . . . . 72.319999999999993 107.824 -176.404 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.443 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 95.8 t -93.69 103.08 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 N-CA-C 108.605 -0.887 . . . . 74.420000000000002 108.605 -176.875 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.432 ' HA ' ' HB3' ' A' ' 20' ' ' GLU . 22.5 ttmm -109.61 102.85 11.65 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 108.021 -1.103 . . . . 74.109999999999999 108.021 -178.111 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.528 HD13 HG13 ' A' ' 48' ' ' ILE . 13.7 tt -112.82 141.83 27.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 109.46 -0.57 . . . . 71.519999999999996 109.46 -179.332 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 45.0 m -121.22 133.05 55.15 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.591 0.756 . . . . 75.239999999999995 110.031 -178.888 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 19.6 t -160.31 133.88 6.95 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.599 1.16 . . . . 40.210000000000001 110.015 176.952 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 29.7 m120 63.92 23.45 13.34 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 124.705 1.202 . . . . 75.329999999999998 112.17 -178.977 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 74.72 16.21 80.37 Favored Glycine 0 C--N 1.35 1.333 0 CA-C-N 116.307 -0.406 . . . . 70.420000000000002 113.013 -174.908 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.3 mmpt? -118.71 122.26 42.06 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.977 0.911 . . . . 74.010000000000005 109.859 178.765 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 89.9 m -98.46 121.5 40.47 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 123.15 0.58 . . . . 75.239999999999995 110.122 178.395 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.1 m-85 -106.17 111.11 23.59 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 107.364 -1.347 . . . . 63.140000000000001 107.364 176.736 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.443 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 0.8 OUTLIER -140.51 155.47 46.63 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 112.393 0.516 . . . . 54.210000000000001 112.393 -173.575 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 40.8 ttm180 -168.32 145.06 3.93 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.003 0.921 . . . . 74.200000000000003 109.549 175.108 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 53.5 m -85.47 112.29 20.76 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.669 0.787 . . . . 71.340000000000003 109.05 172.047 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -98.88 138.85 35.41 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.761 0.824 . . . . 72.540000000000006 109.111 178.623 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 26.2 mp0 -104.89 109.43 21.4 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 107.616 -1.253 . . . . 75.129999999999995 107.616 -178.512 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.454 HD12 HG21 ' A' ' 8' ' ' VAL . 81.6 mt -117.02 102.6 9.47 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.865 0.866 . . . . 64.120000000000005 109.322 -175.266 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.427 ' O ' ' HE3' ' A' ' 36' ' ' LYS . 72.5 t80 -94.67 126.27 39.86 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.308 0.643 . . . . 73.219999999999999 109.612 176.741 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.502 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -139.95 153.21 46.85 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.808 0.843 . . . . 72.400000000000006 109.5 175.171 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 47.2 t -74.86 -58.68 4.26 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 N-CA-C 108.664 -0.865 . . . . 72.129999999999995 108.664 174.792 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.505 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 79.2 mtt180 -101.42 168.21 9.66 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 115.571 -0.74 . . . . 54.530000000000001 111.223 -178.874 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.8 -46.15 76.11 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.448 1.499 . . . . 75.109999999999999 110.038 -178.885 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -60.22 -30.15 69.2 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 113.774 -1.557 . . . . 75.219999999999999 111.766 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.505 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 37.4 mm-40 -71.34 -24.58 62.13 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.49 0.716 . . . . 65.209999999999994 111.645 -178.738 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.68 -28.31 61.68 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 122.917 0.487 . . . . 74.239999999999995 110.034 178.843 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.433 ' HE2' ' HB3' ' A' ' 34' ' ' LYS . 39.5 mtpt -52.59 -56.85 12.43 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 123.351 0.66 . . . . 74.420000000000002 112.477 -176.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.461 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 2.8 pp20? -59.65 -32.62 70.63 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 123.993 0.808 . . . . 73.329999999999998 112.153 -175.511 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.427 ' HE3' ' O ' ' A' ' 26' ' ' TYR . 55.3 mttm -67.85 -46.49 71.62 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.296 0.639 . . . . 74.040000000000006 110.206 177.825 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 72.5 mt -58.38 -42.42 87.0 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.168 0.987 . . . . 73.510000000000005 110.844 177.755 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -62.41 -40.98 98.29 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.095 0.958 . . . . 61.149999999999999 111.266 178.866 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 74.3 mmtt -63.46 -51.68 64.65 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 123.434 0.459 . . . . 73.340000000000003 110.837 175.707 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 92.3 t -60.36 -37.95 76.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 124.171 0.988 . . . . 73.230000000000004 111.629 -177.473 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.472 HD21 HD11 ' A' ' 60' ' ' ILE . 65.2 mt -68.46 -51.15 46.75 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 122.901 0.48 . . . . 55.240000000000002 110.257 178.8 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -61.76 -30.51 70.83 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.169 0.588 . . . . 71.409999999999997 111.725 178.906 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -67.56 -53.13 30.98 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.243 0.617 . . . . 72.430000000000007 110.721 175.082 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.417 ' HA ' ' NE ' ' A' ' 44' ' ' ARG . 0.0 OUTLIER -74.97 -26.92 59.93 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 123.324 0.39 . . . . 64.219999999999999 111.763 -173.073 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.578 ' HB3' ' HE3' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -82.04 -27.92 32.75 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.594 0.758 . . . . 64.099999999999994 112.014 -179.405 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -56.99 -52.48 73.77 Favored Pre-proline 0 CA--C 1.562 1.438 0 N-CA-C 113.025 0.75 . . . . 63.450000000000003 113.025 -173.691 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.426 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 41.9 Cg_endo -64.24 -30.99 64.31 Favored 'Trans proline' 0 C--N 1.385 2.453 0 C-N-CA 121.775 1.65 . . . . 44.439999999999998 111.793 176.191 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.528 HG13 HD13 ' A' ' 12' ' ' ILE . 44.8 mm -74.9 -33.34 29.77 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.046 0 C-N-CA 123.999 0.919 . . . . 65.420000000000002 111.003 -174.408 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.578 ' HE3' ' HB3' ' A' ' 45' ' ' MET . 98.9 mttt -70.17 -34.36 72.89 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.39 0.676 . . . . 73.510000000000005 109.743 175.429 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -72.87 -29.22 63.01 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.884 0.874 . . . . 73.340000000000003 110.901 175.371 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 73.6 mt -71.81 -29.74 64.76 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 109.317 -0.623 . . . . 72.019999999999996 109.317 173.642 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 71.52 54.11 9.14 Favored Glycine 0 C--N 1.351 1.4 0 O-C-N 123.791 0.682 . . . . 73.439999999999998 111.982 176.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.492 ' SG ' HG23 ' A' ' 48' ' ' ILE . 12.7 m -73.35 122.0 21.34 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 122.98 0.512 . . . . 72.519999999999996 110.391 -179.321 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -67.4 -25.1 65.78 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.763 0.825 . . . . 75.129999999999995 110.807 177.75 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 16.8 tpp180 -140.38 129.15 23.11 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.132 0.973 . . . . 72.140000000000001 108.931 175.535 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 19.7 m -118.22 143.53 28.78 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 123.298 0.639 . . . . 70.019999999999996 109.601 170.747 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.491 ' HG3' ' HG2' ' A' ' 105' ' ' GLU . 52.0 ttt-85 -131.52 106.43 8.21 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 108.814 -0.81 . . . . 71.25 108.814 172.381 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.418 ' HB ' ' HB ' ' A' ' 104' ' ' VAL . 39.3 mt -99.6 129.42 50.18 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 C-N-CA 124.922 1.289 . . . . 62.450000000000003 107.539 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.2 m -120.68 103.3 9.02 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 107.464 -1.309 . . . . 70.319999999999993 107.464 179.531 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.472 HD11 HD21 ' A' ' 41' ' ' LEU . 73.2 mt -98.77 104.95 16.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 N-CA-C 108.884 -0.784 . . . . 72.329999999999998 108.884 -177.409 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.23 109.99 22.36 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 108.4 -0.963 . . . . 73.109999999999999 108.4 -176.339 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 21.9 t -95.03 127.0 47.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 C-N-CA 124.468 1.107 . . . . 61.420000000000002 110.089 -174.222 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.485 ' HB3' ' H ' ' A' ' 7' ' ' GLU . 3.9 tppp? -87.6 102.52 14.69 Favored 'General case' 0 C--O 1.24 0.565 0 N-CA-C 108.717 -0.845 . . . . 72.430000000000007 108.717 177.627 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 36.7 m80 -71.61 140.92 49.96 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 123.402 0.439 . . . . 75.310000000000002 110.114 178.444 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 17.2 m -62.39 -46.57 88.01 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.698 1.199 . . . . 71.019999999999996 112.532 -166.339 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -141.71 153.24 44.51 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 122.723 0.409 . . . . 62.049999999999997 110.992 -172.763 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -74.57 -15.44 60.84 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 124.196 0.999 . . . . 74.439999999999998 112.803 -175.121 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -86.14 -44.93 11.82 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 122.763 0.425 . . . . 64.319999999999993 109.887 171.43 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -66.28 -35.14 79.63 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-N 115.575 -0.738 . . . . 75.219999999999999 112.551 -177.318 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -43.59 -38.43 2.99 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 115.038 1.496 . . . . 54.140000000000001 115.038 -167.492 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -67.11 -41.97 85.31 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.412 0.685 . . . . 71.409999999999997 111.039 -177.436 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 18.2 tppt? -77.53 -35.74 53.04 Favored 'General case' 0 C--O 1.241 0.642 0 C-N-CA 123.72 0.808 . . . . 75.219999999999999 109.837 174.954 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.676 ' HG3' ' HD2' ' A' ' 76' ' ' LYS . 34.9 tt0 -74.29 -15.19 60.97 Favored 'General case' 0 C--N 1.351 0.673 0 CA-C-N 115.533 -0.758 . . . . 73.329999999999998 111.345 -175.124 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.77 -62.2 1.64 Allowed 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 108.685 -0.857 . . . . 63.030000000000001 108.685 171.004 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 57.8 tttm -65.1 -24.56 67.47 Favored 'General case' 0 N--CA 1.481 1.1 0 O-C-N 123.514 0.508 . . . . 72.430000000000007 111.715 -179.516 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.676 ' HD2' ' HG3' ' A' ' 73' ' ' GLU . 3.4 ttmp? -59.54 -60.45 3.83 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.93 0.892 . . . . 65.549999999999997 110.685 172.938 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -77.31 -21.73 53.05 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 115.549 -0.75 . . . . 73.040000000000006 109.961 -174.565 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.42 ' HA ' ' CE2' ' A' ' 97' ' ' TRP . . . -64.11 -43.47 95.24 Favored 'General case' 0 C--N 1.345 0.406 0 C-N-CA 123.488 0.715 . . . . 62.020000000000003 110.142 172.938 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.88 -48.26 79.75 Favored 'General case' 0 C--N 1.349 0.561 0 O-C-N 124.142 0.901 . . . . 42.219999999999999 110.752 175.532 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.419 ' O ' HG23 ' A' ' 84' ' ' VAL . 38.1 mm -62.54 -50.59 79.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 O-C-N 123.944 0.778 . . . . 71.430000000000007 111.41 -175.204 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 10.7 mt -67.03 -39.11 86.92 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-O 119.253 -0.403 . . . . 74.109999999999999 111.035 -179.312 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -61.09 -36.87 80.81 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 122.967 0.507 . . . . 73.010000000000005 110.65 -179.274 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.494 ' O ' ' HG2' ' A' ' 87' ' ' GLU . 33.2 mmtp -71.31 -37.33 71.81 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 115.482 -0.781 . . . . 44.25 111.04 175.907 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 80' ' ' ILE . 53.8 t -64.64 -38.57 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 123.539 0.736 . . . . 61.32 110.402 178.576 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.565 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 22.0 m-85 -64.34 -36.02 82.78 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 114.955 -1.021 . . . . 73.420000000000002 110.431 174.907 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -73.77 -23.5 59.72 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 123.683 0.793 . . . . 75.319999999999993 111.652 175.693 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 83' ' ' LYS . 37.6 mm-40 -74.71 -29.72 61.29 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.024 0.53 . . . . 64.400000000000006 111.718 176.35 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 82.1 mt -108.35 -18.87 13.64 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.174 0.59 . . . . 74.230000000000004 111.781 -168.44 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 107.18 11.44 25.81 Favored Glycine 0 C--N 1.347 1.174 0 N-CA-C 114.6 0.6 . . . . 50.539999999999999 114.6 174.22 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.565 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 87.7 m-85 -72.1 120.21 17.39 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 108.807 -0.812 . . . . 74.430000000000007 108.807 171.682 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ASN . . . . . 0.411 ' O ' HG23 ' A' ' 95' ' ' VAL . 35.2 m-80 -77.6 165.07 24.75 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.671 0.788 . . . . 61.399999999999999 110.329 -173.532 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -53.06 -44.42 67.46 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.771 0.828 . . . . 51.100000000000001 111.701 173.023 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 34.5 t -66.56 -8.51 27.4 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.231 1.012 . . . . 62.439999999999998 112.215 179.191 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ASN . . . . . 0.435 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 12.8 m120 -104.26 -11.03 17.44 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.409 0.684 . . . . 73.409999999999997 111.176 178.921 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 91' ' ' ASN . 57.6 t -109.87 113.46 44.28 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 C-N-CA 123.483 0.713 . . . . 64.340000000000003 109.925 -175.236 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 7.9 m -123.13 97.58 5.49 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.303 0.641 . . . . 71.25 110.159 175.192 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.42 ' CE2' ' HA ' ' A' ' 78' ' ' ALA . 5.1 m95 -74.17 150.08 40.59 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 122.892 0.477 . . . . 75.219999999999999 110.967 178.903 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -159.4 81.76 0.75 Allowed 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.361 0.664 . . . . 73.219999999999999 110.29 -178.703 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 70.08 -101.06 0.83 Allowed Glycine 0 CA--C 1.533 1.194 0 CA-C-N 115.237 -0.892 . . . . 72.25 113.581 174.856 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -90.77 -20.97 21.78 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.678 0.791 . . . . 62.5 111.093 177.791 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 17.0 m -114.64 128.81 56.52 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.198 0.599 . . . . 73.019999999999996 110.74 -169.918 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' VAL . . . . . 0.411 HG12 ' HB ' ' A' ' 60' ' ' ILE . 10.3 p -99.91 130.87 48.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 N-CA-C 108.048 -1.093 . . . . 73.400000000000006 108.048 166.476 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 15.1 m -108.1 102.54 11.69 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.495 -0.928 . . . . 73.510000000000005 108.495 179.537 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.435 ' HA ' ' O ' ' A' ' 94' ' ' ASN . 41.0 t -92.91 109.01 21.06 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 N-CA-C 108.008 -1.108 . . . . 71.439999999999998 108.008 -179.184 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' GLU . . . . . 0.491 ' HG2' ' HG3' ' A' ' 57' ' ' ARG . 42.1 mt-10 -121.55 112.43 18.47 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 107.21 -1.404 . . . . 72.340000000000003 107.21 -176.872 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -164.75 -167.23 24.99 Favored Glycine 0 C--O 1.246 0.88 0 C-N-CA 120.93 -0.652 . . . . 54.520000000000003 113.254 -173.527 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 27.4 pt20 . . . . . 0 C--O 1.24 0.575 0 C-N-CA 124.499 1.12 . . . . 74.120000000000005 109.833 -178.545 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.546 ' HE2' ' HA ' ' A' ' 4' ' ' LYS . 8.1 mmpt? . . . . . 0 N--CA 1.474 0.758 0 CA-C-O 121.111 0.481 . . . . 73.409999999999997 111.503 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -88.35 98.43 11.6 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 108.163 -1.051 . . . . 53.210000000000001 108.163 178.075 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.448 HG23 HG23 ' A' ' 62' ' ' VAL . 0.2 OUTLIER -98.42 137.4 26.04 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 CA-C-N 114.104 -1.407 . . . . 74.120000000000005 107.516 177.69 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -107.29 114.06 27.85 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 108.412 -0.958 . . . . 75.519999999999996 108.412 176.87 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.447 HG13 HG23 ' A' ' 60' ' ' ILE . 93.5 t -98.98 107.73 21.04 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 C-N-CA 125.628 1.571 . . . . 70.319999999999993 108.987 -171.982 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.53 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 63.6 mt-30 -95.27 100.89 12.61 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 108.277 -1.008 . . . . 72.400000000000006 108.277 -174.951 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.529 HG13 HG23 ' A' ' 58' ' ' ILE . 88.4 t -93.02 104.66 15.95 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 C-N-CA 123.579 0.751 . . . . 62.240000000000002 109.382 -175.373 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.4 ttmm -102.91 102.27 12.34 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 107.714 -1.217 . . . . 55.32 107.714 178.932 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.519 HD11 HG21 ' A' ' 48' ' ' ILE . 12.4 tt -115.9 118.5 58.99 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 CA-C-O 121.157 0.503 . . . . 65.230000000000004 110.889 -174.606 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 19.8 m -97.09 102.97 14.86 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 108.879 -0.785 . . . . 75.450000000000003 108.879 178.826 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.616 ' SG ' HG23 ' A' ' 48' ' ' ILE . 42.2 t -120.0 125.75 49.13 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.876 1.27 . . . . 75.310000000000002 109.46 178.81 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.533 HD21 ' HB3' ' A' ' 51' ' ' LEU . 88.1 m-20 61.43 25.56 15.48 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 125.051 1.341 . . . . 71.409999999999997 112.115 -177.008 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.98 10.96 85.7 Favored Glycine 0 C--N 1.348 1.195 0 CA-C-N 115.718 -0.674 . . . . 72.450000000000003 113.467 -177.777 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -108.23 133.33 52.61 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.245 1.018 . . . . 64.439999999999998 108.982 176.041 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 49.6 m -106.24 118.03 35.58 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.072 0.549 . . . . 54.520000000000003 110.032 -173.503 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -111.56 101.96 10.33 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 107.243 -1.391 . . . . 75.25 107.243 179.279 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.416 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 14.1 pt-20 -116.95 134.51 54.66 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 122.038 -0.414 . . . . 74.319999999999993 110.46 179.249 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.8 ttt180 -155.35 141.05 18.02 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.657 -0.701 . . . . 74.129999999999995 110.075 -178.097 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 42.9 m -92.28 118.55 31.0 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 124.555 1.142 . . . . 63.009999999999998 110.151 178.432 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 89.6 m-85 -103.91 131.98 50.61 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.937 0.895 . . . . 64.430000000000007 110.332 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -91.49 110.13 21.44 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 108.814 -0.81 . . . . 71.140000000000001 108.814 -179.444 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 80.6 mt -118.98 112.89 20.16 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.674 0.79 . . . . 72.109999999999999 109.843 -179.559 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 88.0 t80 -110.2 138.79 46.1 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.619 0.767 . . . . 73.200000000000003 109.133 172.248 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.514 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -135.96 172.08 13.53 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.726 0.81 . . . . 70.510000000000005 110.075 177.644 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 24.0 t -98.01 -44.14 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 N-CA-C 108.749 -0.834 . . . . 72.129999999999995 108.749 168.78 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.592 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 92.9 mtt180 -116.71 158.3 24.05 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 115.464 -0.789 . . . . 72.019999999999996 110.501 178.977 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.437 ' HB2' HD11 ' A' ' 80' ' ' ILE . 15.9 p-10 -68.6 -29.14 67.59 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.909 0.883 . . . . 53.32 110.772 178.357 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.552 ' HA ' ' HD3' ' A' ' 34' ' ' LYS . 60.5 mm-40 -60.37 -40.87 92.35 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.488 0.715 . . . . 75.120000000000005 110.925 170.933 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.592 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 34.6 mm-40 -65.81 -28.16 68.79 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 116.082 -0.508 . . . . 75.109999999999999 110.601 178.96 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.43 -33.16 60.89 Favored 'General case' 0 CA--C 1.56 1.341 0 C-N-CA 122.917 0.487 . . . . 65.030000000000001 110.272 -179.108 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.552 ' HD3' ' HA ' ' A' ' 31' ' ' GLU . 53.3 mtpt -54.08 -55.47 27.18 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.924 0.89 . . . . 52.530000000000001 111.867 179.614 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.504 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 11.6 pt-20 -60.85 -35.98 77.98 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 115.293 -0.867 . . . . 73.299999999999997 111.384 -179.418 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.41 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 64.7 mttm -66.64 -41.05 88.91 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.259 0.624 . . . . 72.409999999999997 111.127 -178.314 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.542 HD13 HD23 ' A' ' 81' ' ' LEU . 94.3 mt -62.81 -40.93 98.91 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 123.746 0.654 . . . . 61.329999999999998 110.767 174.55 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -62.12 -41.71 98.5 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 122.765 0.426 . . . . 40.049999999999997 111.02 175.304 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.504 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 72.8 mmtt -63.94 -55.45 22.46 Favored 'General case' 0 N--CA 1.478 0.961 0 O-C-N 123.415 0.447 . . . . 75.299999999999997 110.275 178.607 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 51.7 t -54.56 -46.66 72.12 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.391 0 C-N-CA 124.541 1.136 . . . . 63.119999999999997 111.524 -178.883 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.431 ' O ' ' HG2' ' A' ' 45' ' ' MET . 67.1 mt -68.34 -41.0 81.36 Favored 'General case' 0 C--O 1.207 -1.14 0 CA-C-O 118.751 -0.643 . . . . 74.349999999999994 110.926 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -61.91 -43.02 99.7 Favored 'General case' 0 N--CA 1.492 1.662 0 CA-C-N 118.531 0.605 . . . . 35.439999999999998 111.857 176.171 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.493 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 21.6 mm-40 -61.32 -46.32 90.75 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 109.526 -0.546 . . . . 60.350000000000001 109.526 177.586 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -67.66 -41.1 84.3 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 114.989 -1.005 . . . . 74.140000000000001 111.481 -176.752 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.634 ' SD ' HD11 ' A' ' 58' ' ' ILE . 92.1 mmm -79.02 -21.36 47.07 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.025 0.53 . . . . 74.230000000000004 111.183 -175.715 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.501 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 13.9 t70 -57.67 -52.4 74.65 Favored Pre-proline 0 CA--C 1.565 1.556 0 N-CA-C 112.929 0.715 . . . . 73.409999999999997 112.929 -171.905 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.433 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 73.3 Cg_endo -71.75 -22.97 23.16 Favored 'Trans proline' 0 C--N 1.39 2.712 0 C-N-CA 121.805 1.67 . . . . 72.340000000000003 112.204 175.089 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.616 HG23 ' SG ' ' A' ' 14' ' ' CYS . 46.9 mm -74.21 -31.67 29.87 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 C-N-CA 124.58 1.152 . . . . 74.209999999999994 110.784 -175.771 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.501 ' HE2' ' HA ' ' A' ' 46' ' ' ASP . 49.2 mtmt -73.77 -34.58 64.75 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.216 0.606 . . . . 75.129999999999995 110.021 175.003 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -65.83 -27.21 68.08 Favored 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 124.343 1.057 . . . . 53.219999999999999 109.575 174.024 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.533 ' HB3' HD21 ' A' ' 15' ' ' ASN . 83.7 mt -75.27 -39.5 59.69 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 109.617 -0.512 . . . . 54.329999999999998 109.617 173.183 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 77.63 36.49 33.23 Favored Glycine 0 C--N 1.346 1.135 0 CA-C-N 115.237 -0.892 . . . . 65.120000000000005 114.076 174.741 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 2.0 p -71.65 119.69 16.17 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 109.55 -0.537 . . . . 75.450000000000003 109.55 171.84 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.404 ' H ' ' HD2' ' A' ' 54' ' ' LYS . 8.9 mptt -70.36 -25.02 63.08 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 124.105 0.962 . . . . 74.5 110.804 -170.437 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 33.0 ttp-105 -129.07 125.74 37.9 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.173 0.989 . . . . 74.209999999999994 108.354 178.148 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 15.3 m -122.17 137.08 56.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 123.419 0.687 . . . . 60.219999999999999 109.44 177.679 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.486 ' O ' ' HA ' ' A' ' 12' ' ' ILE . 18.3 ttm180 -111.19 104.1 12.58 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 108.532 -0.914 . . . . 53.520000000000003 108.532 172.98 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.634 HD11 ' SD ' ' A' ' 45' ' ' MET . 59.4 mt -98.45 105.2 16.96 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 N-CA-C 108.029 -1.1 . . . . 71.25 108.029 174.259 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 27.1 m -101.85 104.34 15.07 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 107.713 -1.217 . . . . 61.219999999999999 107.713 179.106 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.447 HG23 HG13 ' A' ' 8' ' ' VAL . 50.7 mt -95.14 116.03 35.53 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 C-N-CA 123.641 0.776 . . . . 72.340000000000003 109.369 -177.13 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.53 ' HB2' ' HB2' ' A' ' 9' ' ' GLN . 33.1 mtm180 -100.87 113.94 27.34 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 107.395 -1.335 . . . . 71.430000000000007 107.395 174.941 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.448 HG23 HG23 ' A' ' 6' ' ' VAL . 3.2 p -92.43 126.92 44.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 N-CA-C 108.129 -1.063 . . . . 75.439999999999998 108.129 -178.89 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.8 ttpp -81.94 109.36 16.22 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 109.021 -0.733 . . . . 73.099999999999994 109.021 -177.558 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' HIS . . . . . 0.484 ' ND1' ' HB2' ' A' ' 70' ' ' GLU . 31.6 m170 -86.0 108.52 18.26 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 124.073 0.949 . . . . 63.32 109.055 -178.629 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 13.4 m -74.98 -25.87 59.16 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.181 0.992 . . . . 63.439999999999998 112.798 -169.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -146.15 128.01 15.39 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.041 0.536 . . . . 63.049999999999997 109.695 -175.729 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.29 -27.51 68.67 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 113.813 1.042 . . . . 65.349999999999994 113.813 -172.563 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -84.86 -36.58 21.46 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 122.658 0.383 . . . . 52.229999999999997 110.822 -179.845 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -77.51 -28.08 51.97 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 116.093 -0.503 . . . . 63.229999999999997 112.061 -178.693 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.624 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 0.1 OUTLIER -70.27 -13.11 62.02 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 113.865 1.061 . . . . 64.510000000000005 113.865 -169.301 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 49.0 mtmt -67.68 -51.75 46.01 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-O 121.735 0.779 . . . . 75.230000000000004 109.162 171.839 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -74.9 -31.36 61.54 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.414 1.486 . . . . 75.200000000000003 110.857 -179.011 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.624 ' HB3' ' HA ' ' A' ' 70' ' ' GLU . 0.1 OUTLIER -73.65 -49.23 27.01 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.77 0.828 . . . . 73.209999999999994 110.435 -177.678 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.417 ' HB2' ' CE1' ' A' ' 64' ' ' HIS . . . -64.61 -34.24 77.8 Favored 'General case' 0 N--CA 1.483 1.223 0 O-C-N 123.591 0.557 . . . . 73.109999999999999 111.571 177.525 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 54.8 tptt -58.79 -50.9 72.21 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 124.37 1.044 . . . . 73.239999999999995 109.346 174.862 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.503 ' O ' HG12 ' A' ' 80' ' ' ILE . 39.3 ttmt -68.28 -39.68 82.05 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 114.377 -1.283 . . . . 70.230000000000004 110.838 -178.68 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -75.02 -22.39 58.51 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.314 1.045 . . . . 74.430000000000007 110.071 -171.613 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -67.13 -43.3 82.73 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.483 0.713 . . . . 52.539999999999999 110.616 172.423 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.15 -37.35 85.46 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 115.667 -0.697 . . . . 74.329999999999998 110.763 175.934 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.503 HG12 ' O ' ' A' ' 76' ' ' LYS . 43.4 mm -62.7 -47.86 90.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 123.893 0.877 . . . . 72.400000000000006 110.188 177.481 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.542 HD23 HD13 ' A' ' 37' ' ' LEU . 39.8 mt -67.71 -33.78 75.58 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.692 0.797 . . . . 74.010000000000005 111.618 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -60.88 -40.84 94.51 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.01 0.524 . . . . 74.420000000000002 110.155 -178.885 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 49.0 mmtm -64.95 -45.02 87.48 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.672 -0.694 . . . . 65.239999999999995 110.957 176.229 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.511 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 77.4 t -64.81 -59.75 3.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 C-N-CA 123.342 0.657 . . . . 74.439999999999998 110.302 -172.459 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.541 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 30.4 m-85 -57.79 -42.67 84.64 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.116 0.967 . . . . 64.349999999999994 112.342 -177.506 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.02 -34.61 77.94 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.21 0.604 . . . . 55.009999999999998 111.323 179.36 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -89.1 1.14 56.04 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.05 0.94 . . . . 70.140000000000001 111.672 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 37.8 mt -106.11 -26.08 11.76 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.226 0.611 . . . . 74.340000000000003 110.73 175.043 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 124.49 -9.99 8.16 Favored Glycine 0 C--N 1.345 1.072 0 CA-C-O 119.913 -0.382 . . . . 62.299999999999997 112.989 -179.253 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.541 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 70.9 m-85 -79.12 127.8 32.47 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 122.774 0.43 . . . . 71.239999999999995 110.011 177.062 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -84.36 171.02 13.02 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.796 0.838 . . . . 72.439999999999998 109.877 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -56.77 -42.54 79.56 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.031 0.932 . . . . 74.349999999999994 111.642 178.617 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 30.9 t -56.23 -31.64 63.71 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.277 1.031 . . . . 54.340000000000003 112.949 178.856 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ASN . . . . . 0.458 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 14.1 m120 -65.24 -32.21 73.76 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 122.662 0.385 . . . . 71.329999999999998 111.653 179.492 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 58.9 t -88.86 127.35 41.7 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 C-N-CA 124.02 0.928 . . . . 70.219999999999999 110.427 -172.322 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 63.5 m -143.72 122.38 12.56 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.468 0.707 . . . . 74.450000000000003 110.665 172.562 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 75.2 m95 -87.89 124.47 33.71 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 123.522 0.729 . . . . 72.349999999999994 111.349 177.904 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -120.81 91.89 3.64 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 107.955 -1.128 . . . . 71.510000000000005 107.955 169.195 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 70.69 -125.81 13.89 Favored Glycine 0 C--N 1.346 1.086 0 CA-C-N 115.79 -0.641 . . . . 64.400000000000006 112.095 -177.72 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -81.96 -6.73 59.36 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.76 0.824 . . . . 72.019999999999996 111.389 178.797 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 76.6 m -103.07 149.73 24.3 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.816 0.846 . . . . 73.510000000000005 109.564 -179.01 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.8 p -130.38 116.73 37.07 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.942 0 C-N-CA 123.975 0.91 . . . . 64.209999999999994 108.604 169.67 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 57.0 m -93.71 117.3 29.92 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 108.219 -1.03 . . . . 72.420000000000002 108.219 176.658 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.458 ' HA ' ' O ' ' A' ' 94' ' ' ASN . 89.9 t -114.57 110.97 33.99 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 C-N-CA 124.258 1.023 . . . . 71.120000000000005 108.261 177.615 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -123.59 116.16 22.68 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 109.118 -0.697 . . . . 72.129999999999995 109.118 178.729 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -141.15 173.74 23.14 Favored Glycine 0 C--N 1.342 0.873 0 O-C-N 123.477 0.485 . . . . 42.439999999999998 112.425 -177.988 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 . . . . . 0 N--CA 1.469 0.504 0 C-N-CA 122.592 0.357 . . . . 71.219999999999999 110.101 177.872 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp . . . . . 0 N--CA 1.475 0.819 0 CA-C-O 120.517 0.198 . . . . 62.310000000000002 110.741 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.404 ' HA ' ' HA ' ' A' ' 26' ' ' TYR . 0.9 OUTLIER -90.42 103.32 16.02 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 107.598 -1.26 . . . . 71.439999999999998 107.598 167.06 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.5 p -99.68 142.09 15.81 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 123.987 0.915 . . . . 72.140000000000001 109.238 177.762 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.561 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 34.1 mt-10 -109.67 113.85 26.96 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 108.034 -1.099 . . . . 74.329999999999998 108.034 176.043 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 90.1 t -99.25 110.6 26.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 C-N-CA 124.516 1.126 . . . . 52.109999999999999 109.998 -171.631 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.531 ' O ' ' HA ' ' A' ' 60' ' ' ILE . 77.8 mt-30 -82.43 99.74 9.61 Favored 'General case' 0 C--N 1.347 0.474 0 N-CA-C 107.67 -1.233 . . . . 72.040000000000006 107.67 178.952 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 64.0 t -93.38 114.48 30.18 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 N-CA-C 107.237 -1.394 . . . . 52.200000000000003 107.237 173.787 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.7 ttpm? -122.35 103.89 9.04 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 107.818 -1.178 . . . . 74.420000000000002 107.818 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 14.1 tt -122.33 125.69 73.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 122.759 0.424 . . . . 73.310000000000002 110.542 -174.333 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 51.4 m -102.2 116.54 32.87 Favored 'General case' 0 C--O 1.241 0.657 0 C-N-CA 123.83 0.852 . . . . 75.150000000000006 109.569 176.537 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 54.1 t -138.89 135.15 34.17 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 124.16 0.984 . . . . 74.430000000000007 109.5 175.654 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.488 ' HB2' ' HB3' ' A' ' 51' ' ' LEU . 67.0 t30 70.22 30.29 3.46 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 124.836 1.254 . . . . 72.230000000000004 110.959 175.079 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 83.65 -7.27 69.98 Favored Glycine 0 C--N 1.353 1.487 0 CA-C-N 115.588 -0.733 . . . . 71.019999999999996 113.231 -178.053 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 44.9 mtpt -105.4 131.08 53.28 Favored 'General case' 0 C--N 1.348 0.516 0 C-N-CA 123.954 0.902 . . . . 72.519999999999996 110.252 -173.085 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 85.8 m -95.34 131.45 41.42 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 108.696 -0.853 . . . . 71.230000000000004 108.696 174.729 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -115.93 144.58 43.86 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 107.046 -1.465 . . . . 75.310000000000002 107.046 171.739 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -148.81 130.89 15.36 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 123.105 0.562 . . . . 75.510000000000005 109.798 175.358 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 69.9 ttt180 -154.33 134.85 13.46 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 108.471 -0.936 . . . . 72.409999999999997 108.471 178.8 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.411 HG22 ' HB3' ' A' ' 7' ' ' GLU . 16.6 m -101.47 116.82 33.64 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 123.66 0.784 . . . . 74.120000000000005 109.808 179.109 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 -97.65 128.71 44.55 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.22 1.008 . . . . 72.409999999999997 110.477 -173.362 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.498 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 25.2 mp0 -90.12 108.35 19.68 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 108.029 -1.1 . . . . 73.420000000000002 108.029 -178.136 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.471 HD11 HG21 ' A' ' 40' ' ' VAL . 89.8 mt -121.92 110.11 15.45 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.623 1.169 . . . . 74.430000000000007 108.921 -174.104 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.433 ' O ' ' HE3' ' A' ' 36' ' ' LYS . 82.3 t80 -92.53 134.58 34.84 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 122.732 0.413 . . . . 72.319999999999993 109.977 173.896 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.554 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -146.65 148.66 32.29 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.415 0.686 . . . . 75.109999999999999 110.65 177.686 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 88.5 t -76.38 -56.83 7.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 123.884 0.873 . . . . 75.299999999999997 109.56 175.346 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.554 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 94.5 mtt180 -102.32 164.97 11.38 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 115.534 -0.757 . . . . 72.409999999999997 110.012 175.618 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -69.72 -27.07 64.67 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 123.147 0.579 . . . . 53.009999999999998 110.636 170.605 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -62.34 -35.2 78.37 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.242 1.017 . . . . 53.219999999999999 111.147 176.504 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.554 ' HB2' ' HB1' ' A' ' 27' ' ' ALA . 13.5 mm-40 -70.51 -29.92 66.56 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.358 -0.837 . . . . 71.129999999999995 110.135 -178.924 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.75 HD22 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -75.69 -22.01 57.05 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.107 0.563 . . . . 72.450000000000003 110.741 -178.032 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.513 ' HG2' HG23 ' A' ' 80' ' ' ILE . 53.8 mtpt -57.19 -55.83 29.64 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 122.979 0.512 . . . . 64.129999999999995 111.13 179.807 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.503 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 2.4 pp20? -61.96 -30.11 70.7 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 115.648 -0.705 . . . . 74.120000000000005 112.14 179.7 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.75 ' HD2' HD22 ' A' ' 33' ' ' LEU . 64.3 mttm -70.39 -40.35 74.0 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.197 0.599 . . . . 75.329999999999998 110.857 179.454 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.564 HD13 HD23 ' A' ' 81' ' ' LEU . 95.7 mt -62.11 -39.69 93.37 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 123.73 0.643 . . . . 53.329999999999998 110.803 174.157 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -64.26 -37.68 88.36 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 122.997 0.519 . . . . 62.240000000000002 111.479 175.238 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.503 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 45.0 mmtm -62.88 -55.66 24.18 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 110.054 -0.35 . . . . 73.049999999999997 110.054 174.69 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.471 HG21 HD11 ' A' ' 25' ' ' LEU . 55.2 t -54.66 -49.22 69.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 124.808 1.243 . . . . 75.030000000000001 111.711 -178.542 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 40.5 mt -66.32 -45.59 79.78 Favored 'General case' 0 C--O 1.215 -0.712 0 C-N-CA 123.293 0.637 . . . . 73.109999999999999 111.601 -176.551 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -65.91 -42.16 90.54 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 112.247 0.462 . . . . 72.430000000000007 112.247 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.7 mm-40 -63.13 -50.82 68.94 Favored 'General case' 0 N--CA 1.486 1.344 0 CA-C-O 121.28 0.562 . . . . 52.439999999999998 110.634 177.176 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 15.4 tpt180 -63.7 -41.84 98.06 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.512 1.125 . . . . 73.299999999999997 111.37 -177.796 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.501 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 58.0 mtp -92.23 8.21 39.18 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.682 0.623 . . . . 74.409999999999997 112.682 -174.733 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -73.42 -51.2 5.76 Favored Pre-proline 0 CA--C 1.559 1.295 0 CA-C-O 118.447 -0.787 . . . . 75.439999999999998 111.565 174.262 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -69.4 -16.6 39.19 Favored 'Trans proline' 0 C--N 1.389 2.674 0 C-N-CA 121.452 1.435 . . . . 75.109999999999999 111.894 174.696 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 48.7 mm -72.58 -32.69 42.35 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.132 0 C-N-CA 124.42 1.088 . . . . 73.109999999999999 110.309 176.087 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.501 ' HG3' ' O ' ' A' ' 45' ' ' MET . 55.1 mttp -62.3 -41.33 98.41 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 109.387 -0.597 . . . . 73.140000000000001 109.387 171.304 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.7 tmmm? -65.58 -32.55 74.2 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.175 0.99 . . . . 43.509999999999998 110.993 178.254 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.488 ' HB3' ' HB2' ' A' ' 15' ' ' ASN . 83.6 mt -70.47 -30.73 67.61 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 110.106 -0.331 . . . . 74.120000000000005 110.106 175.352 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 71.81 56.75 6.31 Favored Glycine 0 C--N 1.348 1.24 0 O-C-N 124.014 0.821 . . . . 52.100000000000001 113.448 170.055 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.435 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 89.4 m -88.72 125.54 34.91 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 122.674 0.39 . . . . 62.020000000000003 111.303 177.637 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 53.5 tptt -59.91 -39.38 85.23 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.475 1.11 . . . . 72.200000000000003 110.256 170.53 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 25.3 ttm180 -139.85 136.44 33.98 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 109.303 -0.629 . . . . 75.0 109.303 174.306 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 15.5 m -114.3 144.2 22.39 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 C-N-CA 124.087 0.955 . . . . 63.200000000000003 109.241 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.533 ' NH1' ' HG2' ' A' ' 105' ' ' GLU . 23.3 tpp180 -100.25 103.64 15.09 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 107.52 -1.289 . . . . 74.230000000000004 107.52 175.04 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 59.6 mt -100.06 133.26 43.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 N-CA-C 107.718 -1.215 . . . . 74.230000000000004 107.718 177.509 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 36.5 t -137.5 102.72 4.85 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 107.529 -1.285 . . . . 72.129999999999995 107.529 -176.626 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.531 ' HA ' ' O ' ' A' ' 9' ' ' GLN . 45.0 mt -115.86 114.28 45.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 C-N-CA 123.214 0.606 . . . . 72.319999999999993 111.061 -172.299 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 80.0 ttt180 -105.74 140.44 38.79 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 109.079 -0.712 . . . . 65.120000000000005 109.079 176.958 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.1 p -94.86 141.41 15.07 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 N-CA-C 109.227 -0.657 . . . . 60.25 109.227 178.275 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.561 ' HB3' ' H ' ' A' ' 7' ' ' GLU . 5.3 tppp? -90.09 123.57 34.07 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 107.045 -1.465 . . . . 74.549999999999997 107.045 165.781 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 16.4 p80 -92.02 146.01 24.08 Favored 'General case' 0 C--O 1.238 0.498 0 O-C-N 123.722 0.639 . . . . 64.109999999999999 110.963 -179.671 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 27.7 m -84.49 -50.03 8.11 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 115.346 -0.843 . . . . 74.239999999999995 110.955 -176.348 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -93.06 -175.75 3.96 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.308 0.643 . . . . 73.510000000000005 111.266 179.28 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -114.56 -35.19 4.97 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.07 0.948 . . . . 54.020000000000003 111.086 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -89.0 -55.53 3.65 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.134 0.573 . . . . 72.319999999999993 111.146 174.15 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.0 mp0 -64.49 -17.88 64.27 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 125.072 1.349 . . . . 72.430000000000007 112.436 -171.726 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.569 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 0.6 OUTLIER -69.41 -22.34 63.69 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.272 1.029 . . . . 75.120000000000005 113.744 -174.701 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -69.01 -30.84 69.31 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.582 0.753 . . . . 72.140000000000001 109.513 177.432 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -83.14 -40.32 19.9 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.27 1.028 . . . . 62.140000000000001 110.102 172.474 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.569 ' HB3' ' HA ' ' A' ' 70' ' ' GLU . 44.2 tt0 -65.77 -30.26 70.88 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.955 0.902 . . . . 74.129999999999995 111.853 -176.164 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.56 -45.3 75.99 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.041 0.536 . . . . 75.340000000000003 110.314 176.64 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.91 -30.27 67.64 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 123.907 0.754 . . . . 72.099999999999994 111.958 176.386 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.419 ' O ' HG12 ' A' ' 80' ' ' ILE . 34.9 ttmt -65.88 -47.14 75.88 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.693 0.797 . . . . 72.120000000000005 109.383 174.624 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -73.66 -21.91 60.13 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 114.633 -1.167 . . . . 73.439999999999998 109.914 -179.132 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -66.55 -42.93 86.39 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 123.928 0.891 . . . . 72.310000000000002 110.639 173.834 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.18 -38.43 91.02 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 123.798 0.686 . . . . 72.400000000000006 110.382 175.454 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.513 HG23 ' HG2' ' A' ' 34' ' ' LYS . 36.7 mm -65.5 -44.14 94.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 124.272 1.029 . . . . 71.400000000000006 111.055 177.923 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.564 HD23 HD13 ' A' ' 37' ' ' LEU . 35.9 mt -64.54 -45.0 89.04 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.181 0.592 . . . . 74.400000000000006 110.088 177.399 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -59.88 -42.29 93.42 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.681 0.792 . . . . 74.230000000000004 110.694 -176.797 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -61.02 -49.57 76.88 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 124.081 0.863 . . . . 71.040000000000006 111.073 176.419 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 55.9 t -61.69 -51.01 77.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 123.539 0.736 . . . . 75.409999999999997 110.916 -175.395 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.458 ' HZ ' HD12 ' A' ' 60' ' ' ILE . 35.4 m-85 -59.04 -44.04 91.73 Favored 'General case' 0 N--CA 1.477 0.882 0 O-C-N 124.021 0.825 . . . . 73.5 111.217 179.171 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.53 -32.56 74.26 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.049 0.54 . . . . 75.340000000000003 111.681 179.162 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -85.04 -6.46 59.32 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.748 0.819 . . . . 73.519999999999996 111.755 -179.313 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 86.1 mt -104.03 -15.54 15.56 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.388 0.675 . . . . 72.450000000000003 110.517 176.504 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 106.98 20.9 8.44 Favored Glycine 0 C--N 1.345 1.052 0 CA-C-N 116.111 -0.495 . . . . 30.43 113.676 175.789 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.452 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 95.8 m-85 -88.37 129.05 35.5 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 109.277 -0.638 . . . . 62.149999999999999 109.277 169.688 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -77.23 161.29 28.26 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.435 1.094 . . . . 74.140000000000001 109.653 -178.048 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -59.06 -38.95 80.62 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 124.18 0.992 . . . . 72.030000000000001 111.458 175.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 8.1 t -77.87 9.36 3.62 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 124.089 0.956 . . . . 72.140000000000001 112.503 176.531 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -101.94 -23.33 14.15 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.275 0.63 . . . . 64.209999999999994 110.701 168.659 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 59.6 t -108.78 121.37 61.74 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 C-N-CA 124.038 0.935 . . . . 70.209999999999994 110.433 -172.489 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.9 m -146.06 128.85 16.29 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.996 0.918 . . . . 74.25 109.552 171.446 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.418 ' HA ' ' HA ' ' A' ' 102' ' ' VAL . 33.7 m95 -73.09 152.73 41.1 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-O 121.468 0.651 . . . . 73.430000000000007 111.804 177.214 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -139.45 78.31 1.66 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.953 1.301 . . . . 71.450000000000003 107.555 176.241 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 63.92 -98.98 0.27 Allowed Glycine 0 C--N 1.345 1.074 0 CA-C-N 114.974 -1.012 . . . . 32.439999999999998 113.602 179.567 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -84.24 -25.72 29.22 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.648 0.779 . . . . 72.329999999999998 112.006 -177.127 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 28.7 m -125.33 138.04 54.06 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.504 0.722 . . . . 73.019999999999996 110.282 -168.035 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' VAL . . . . . 0.418 ' HA ' ' HA ' ' A' ' 97' ' ' TRP . 12.2 p -91.59 137.04 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.009 0 N-CA-C 109.489 -0.56 . . . . 52.350000000000001 109.489 176.676 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 27.1 m -102.18 106.45 17.29 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.616 1.166 . . . . 74.310000000000002 108.266 177.227 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 70.2 t -118.08 112.23 37.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 N-CA-C 108.323 -0.992 . . . . 62.039999999999999 108.323 -179.805 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' GLU . . . . . 0.533 ' HG2' ' NH1' ' A' ' 57' ' ' ARG . 0.1 OUTLIER -140.92 140.11 34.43 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 122.695 0.398 . . . . 75.239999999999995 110.087 178.82 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 160.88 -150.07 19.66 Favored Glycine 0 C--O 1.241 0.59 0 N-CA-C 111.098 -0.801 . . . . 71.140000000000001 111.098 -172.845 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 . . . . . 0 CA--C 1.552 1.042 0 C-N-CA 123.587 0.755 . . . . 63.130000000000003 112.262 -175.659 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 33.6 tptt . . . . . 0 N--CA 1.472 0.67 0 CA-C-O 120.549 0.214 . . . . 64.319999999999993 111.378 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.439 ' HB2' ' HD1' ' A' ' 26' ' ' TYR . 34.8 ttpt -127.27 107.32 9.89 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 109.072 -0.714 . . . . 51.420000000000002 109.072 174.795 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.1 p -100.69 143.97 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 N-CA-C 108.993 -0.743 . . . . 53.119999999999997 108.993 173.363 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.409 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 42.3 mt-10 -113.63 115.09 27.35 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 109.332 -0.618 . . . . 71.420000000000002 109.332 177.738 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 73.1 t -105.59 115.71 47.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 124.944 1.298 . . . . 73.319999999999993 110.062 -168.733 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.412 ' O ' ' HA ' ' A' ' 60' ' ' ILE . 38.7 mt-30 -97.08 99.59 11.09 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 108.576 -0.898 . . . . 62.329999999999998 108.576 -177.043 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.424 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 67.1 t -95.48 109.08 21.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 N-CA-C 109.092 -0.707 . . . . 61.409999999999997 109.092 -177.594 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.518 ' HE2' ' HB2' ' A' ' 59' ' ' SER . 35.6 ttpt -110.15 105.28 14.3 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 108.436 -0.95 . . . . 74.140000000000001 108.436 177.732 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.412 HD11 HG21 ' A' ' 48' ' ' ILE . 10.9 tt -118.15 123.71 72.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 122.983 0.513 . . . . 70.140000000000001 111.015 -174.61 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 41.8 m -95.99 110.82 22.98 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 123.259 0.624 . . . . 63.450000000000003 109.425 176.216 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.644 ' SG ' HG23 ' A' ' 48' ' ' ILE . 8.9 t -145.78 132.63 20.1 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.504 1.122 . . . . 75.409999999999997 110.185 179.655 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 62.78 35.22 13.96 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 124.479 1.111 . . . . 73.540000000000006 110.499 174.024 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.88 12.12 78.6 Favored Glycine 0 C--N 1.351 1.37 0 CA-C-N 115.255 -0.884 . . . . 60.140000000000001 114.234 177.089 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.51 ' HE2' ' HA ' ' A' ' 17' ' ' LYS . 8.0 mmpt? -125.23 142.23 51.62 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.567 0.747 . . . . 64.109999999999999 109.847 175.096 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 88.3 m -110.89 118.53 36.37 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 109.007 -0.738 . . . . 61.439999999999998 109.007 178.906 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.415 ' HB3' ' NH1' ' A' ' 44' ' ' ARG . 13.5 m-85 -108.06 109.76 21.28 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.525 1.13 . . . . 73.420000000000002 108.026 -172.681 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.478 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 1.7 pp20? -127.52 142.02 51.5 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 122.455 0.302 . . . . 64.150000000000006 111.46 -178.8 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 58.2 ttt180 -168.32 143.17 3.48 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.868 0.867 . . . . 70.239999999999995 109.553 178.849 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 23.9 m -89.79 118.16 29.18 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.347 1.059 . . . . 63.030000000000001 109.391 173.766 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -101.87 135.49 43.33 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.813 0.845 . . . . 65.209999999999994 109.729 -179.043 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -91.68 107.63 19.35 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 107.514 -1.291 . . . . 74.329999999999998 107.514 179.233 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.508 HD21 HG21 ' A' ' 40' ' ' VAL . 70.6 mt -111.14 99.4 8.25 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 109.076 -0.713 . . . . 73.340000000000003 109.076 -178.789 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.439 ' HD1' ' HB2' ' A' ' 5' ' ' LYS . 52.7 t80 -93.28 144.3 25.44 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.652 0.781 . . . . 54.219999999999999 109.571 177.343 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.571 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -158.26 160.62 37.28 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.186 0.995 . . . . 70.310000000000002 109.316 -179.012 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 56.4 t -75.85 -65.78 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 N-CA-C 108.308 -0.997 . . . . 72.140000000000001 108.308 170.829 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.527 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 97.8 mtt180 -96.03 162.18 13.66 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-O 121.064 0.459 . . . . 74.129999999999995 110.556 175.258 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 18.6 p-10 -69.96 -26.74 64.25 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.114 0.966 . . . . 60.039999999999999 111.222 174.229 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -69.1 -25.22 64.3 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 122.915 0.486 . . . . 71.409999999999997 111.438 175.858 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.571 ' HB2' ' HB1' ' A' ' 27' ' ' ALA . 11.5 mm-40 -70.77 -30.84 67.43 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.226 0.611 . . . . 75.540000000000006 109.997 177.319 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.465 HD22 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -66.19 -23.84 66.52 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 124.388 1.075 . . . . 75.040000000000006 110.97 -178.887 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -54.95 -58.66 6.7 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.661 0.784 . . . . 65.310000000000002 111.906 -178.796 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.8 pp20? -65.69 -25.94 67.55 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 122.52 0.328 . . . . 71.530000000000001 111.783 -178.122 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.465 ' HD2' HD22 ' A' ' 33' ' ' LEU . 59.5 mttm -69.42 -41.91 75.73 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.331 0.652 . . . . 71.430000000000007 110.637 177.175 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.521 HD13 HD23 ' A' ' 81' ' ' LEU . 84.8 mt -61.79 -44.07 97.6 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 123.909 0.755 . . . . 74.120000000000005 110.578 173.443 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -56.79 -42.14 78.95 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 122.931 0.493 . . . . 72.430000000000007 110.822 176.783 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -62.78 -61.78 2.17 Favored 'General case' 0 C--O 1.218 -0.593 0 O-C-N 123.98 0.8 . . . . 74.219999999999999 110.743 177.785 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.508 HG21 HD21 ' A' ' 25' ' ' LEU . 99.1 t -60.04 -37.84 74.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 123.363 0.665 . . . . 64.439999999999998 111.763 -173.416 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.457 HD21 HD11 ' A' ' 60' ' ' ILE . 48.9 mt -71.63 -47.71 52.7 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.326 0.65 . . . . 73.549999999999997 111.362 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -70.01 -32.24 70.31 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 122.906 0.482 . . . . 74.340000000000003 110.923 -177.18 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -82.38 -34.58 28.32 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.112 0.965 . . . . 74.319999999999993 110.686 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.415 ' NH1' ' HB3' ' A' ' 19' ' ' TYR . 5.4 tpm_? -60.09 -44.52 94.75 Favored 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 108.956 -0.757 . . . . 71.150000000000006 108.956 169.276 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.494 ' HA ' ' HB ' ' A' ' 48' ' ' ILE . 68.7 mtp -88.67 1.04 55.8 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-N 114.465 -1.243 . . . . 75.340000000000003 112.531 -178.469 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -65.54 -50.5 56.51 Favored Pre-proline 0 N--CA 1.483 1.199 0 CA-C-N 119.191 0.905 . . . . 71.209999999999994 111.15 178.961 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.53 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 57.5 Cg_endo -68.28 -23.15 39.02 Favored 'Trans proline' 0 C--N 1.388 2.613 0 C-N-CA 121.634 1.556 . . . . 54.520000000000003 111.707 172.198 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.644 HG23 ' SG ' ' A' ' 14' ' ' CYS . 47.5 mm -75.5 -34.92 30.87 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.034 0 C-N-CA 124.379 1.072 . . . . 70.129999999999995 110.509 -177.03 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' A' ' 45' ' ' MET . 35.7 mtmm -82.8 -12.17 57.69 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.494 0.717 . . . . 71.439999999999998 109.951 177.59 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -80.57 -33.06 36.41 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.24 1.016 . . . . 73.349999999999994 109.586 164.865 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 95.7 mt -73.26 -28.45 62.14 Favored 'General case' 0 N--CA 1.484 1.245 0 N-CA-C 109.759 -0.46 . . . . 52.43 109.759 178.566 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 67.65 32.58 78.67 Favored Glycine 0 C--N 1.354 1.529 0 CA-C-N 115.645 -0.707 . . . . 71.340000000000003 113.514 173.904 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.421 ' SG ' HG23 ' A' ' 48' ' ' ILE . 1.6 p -67.8 110.32 3.75 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 109.471 -0.566 . . . . 74.310000000000002 109.471 176.137 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 6.9 mtpm? -62.38 -20.42 64.4 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.527 1.131 . . . . 72.209999999999994 112.788 -171.758 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 43.4 ttp180 -136.4 131.08 33.7 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 108.585 -0.894 . . . . 74.219999999999999 108.585 173.033 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 35.6 m -124.49 136.88 59.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 109.11 -0.7 . . . . 71.409999999999997 109.11 173.222 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 54.9 ttt180 -106.69 105.38 15.38 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 108.184 -1.043 . . . . 73.310000000000002 108.184 177.057 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.41 HG22 HG13 ' A' ' 60' ' ' ILE . 32.8 mt -107.43 104.15 16.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 123.259 0.623 . . . . 40.109999999999999 109.435 -175.791 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.518 ' HB2' ' HE2' ' A' ' 11' ' ' LYS . 20.3 m -97.78 104.6 16.64 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 108.347 -0.983 . . . . 64.219999999999999 108.347 175.545 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.493 ' HB ' HG13 ' A' ' 102' ' ' VAL . 85.8 mt -97.71 110.24 25.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 123.831 0.852 . . . . 52.329999999999998 109.719 -179.782 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 27.7 mtm105 -98.38 107.72 20.25 Favored 'General case' 0 C--O 1.237 0.442 0 N-CA-C 107.05 -1.463 . . . . 74.129999999999995 107.05 175.639 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.1 p -94.61 137.18 23.76 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 N-CA-C 109.125 -0.695 . . . . 72.129999999999995 109.125 -171.983 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.409 ' HB3' ' H ' ' A' ' 7' ' ' GLU . 34.5 ttmt -82.37 118.74 23.4 Favored 'General case' 0 C--N 1.35 0.624 0 N-CA-C 109.527 -0.546 . . . . 71.219999999999999 109.527 -176.216 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 50.9 m80 -83.74 150.49 25.78 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 124.634 1.174 . . . . 73.450000000000003 108.922 177.497 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 29.7 t -65.68 -52.66 49.79 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 123.525 0.516 . . . . 74.319999999999993 112.05 -172.635 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.608 ' H ' ' HB2' ' A' ' 69' ' ' GLU . 15.2 m-20 -140.84 -175.9 4.47 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 124.242 1.017 . . . . 71.329999999999998 108.949 -174.11 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.8 -54.13 15.03 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.646 0.778 . . . . 73.319999999999993 111.687 -178.044 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.21 -23.36 62.0 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 122.926 0.49 . . . . 51.109999999999999 110.406 175.086 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.608 ' HB2' ' H ' ' A' ' 66' ' ' ASP . 24.9 mm-40 -76.56 -11.02 59.8 Favored 'General case' 0 C--O 1.211 -0.922 0 CA-C-O 118.755 -0.641 . . . . 71.5 112.51 174.49 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -57.17 -51.63 68.54 Favored 'General case' 0 N--CA 1.488 1.46 0 CA-C-N 119.241 0.928 . . . . 74.140000000000001 110.971 173.523 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -71.89 -30.74 65.71 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.087 0.555 . . . . 73.439999999999998 111.244 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 4.5 tppp? -67.32 -60.61 2.45 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.324 0.65 . . . . 64.230000000000004 109.581 178.682 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -67.0 -15.2 63.58 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.573 1.149 . . . . 73.310000000000002 112.164 178.557 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.36 -62.45 1.67 Allowed 'General case' 0 C--N 1.351 0.671 0 CA-C-N 118.882 0.764 . . . . 74.019999999999996 109.856 172.825 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -69.04 -40.11 78.78 Favored 'General case' 0 CA--C 1.55 0.963 0 O-C-N 124.171 0.919 . . . . 63.43 111.68 -179.318 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 48.3 tttm -67.29 -50.8 58.88 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.907 0.883 . . . . 73.129999999999995 111.95 -176.792 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -75.45 -20.27 58.94 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 110.127 -0.323 . . . . 74.349999999999994 110.127 177.649 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.92 -37.93 74.98 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 122.588 0.355 . . . . 62.340000000000003 111.168 171.44 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.489 ' O ' ' HG2' ' A' ' 83' ' ' LYS . . . -63.77 -45.87 87.84 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.227 0.611 . . . . 53.009999999999998 110.665 175.762 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.468 ' O ' HG23 ' A' ' 84' ' ' VAL . 49.4 mm -61.35 -45.61 98.26 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 C-N-CA 123.914 0.885 . . . . 61.109999999999999 110.325 -178.748 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.547 HD13 HG11 ' A' ' 102' ' ' VAL . 35.8 mt -69.58 -41.82 75.32 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.66 0.784 . . . . 75.25 111.39 178.881 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -56.31 -43.22 78.74 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 124.331 1.052 . . . . 61.409999999999997 110.624 -176.642 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.489 ' HG2' ' O ' ' A' ' 79' ' ' ALA . 33.6 mmtp -68.14 -42.23 80.47 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 114.67 -1.15 . . . . 73.310000000000002 110.758 179.734 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 80' ' ' ILE . 51.1 t -64.34 -47.95 87.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 C-N-CA 123.544 0.738 . . . . 73.120000000000005 110.468 -176.097 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.55 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 25.6 m-85 -61.13 -41.36 96.58 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.28 -0.873 . . . . 74.040000000000006 110.437 177.224 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.66 -25.39 66.54 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.494 0.718 . . . . 70.430000000000007 111.825 176.397 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -86.11 -9.69 56.22 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 124.018 0.927 . . . . 75.349999999999994 111.2 176.681 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 94.5 mt -106.1 -25.17 12.15 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.221 0.608 . . . . 63.43 111.023 -178.679 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 116.34 17.09 6.29 Favored Glycine 0 N--CA 1.475 1.29 0 C-N-CA 122.945 0.307 . . . . 53.130000000000003 113.696 177.985 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.55 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 10.3 m-85 -104.14 125.72 50.68 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 107.986 -1.116 . . . . 74.209999999999994 107.986 173.159 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -123.71 97.89 5.58 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 122.929 0.491 . . . . 62.210000000000001 110.833 -170.308 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 64.19 -72.09 0.06 Allowed 'General case' 0 N--CA 1.494 1.765 0 C-N-CA 125.254 1.422 . . . . 55.329999999999998 114.176 164.51 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 14.6 m -57.08 -30.45 64.32 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 125.068 1.347 . . . . 64.319999999999993 112.502 -178.051 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ASN . . . . . 0.412 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 10.7 m120 -66.1 -39.73 90.2 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.483 0.713 . . . . 75.219999999999999 111.008 176.476 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.416 ' HA ' HG22 ' A' ' 104' ' ' VAL . 47.6 t -93.02 106.99 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 124.999 1.32 . . . . 75.030000000000001 110.276 -167.619 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 44.5 m -123.93 126.66 46.73 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 122.996 0.518 . . . . 65.540000000000006 110.22 178.617 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 55.1 m95 -89.84 147.16 23.94 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 122.968 0.507 . . . . 74.150000000000006 110.491 174.663 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -156.86 98.15 1.75 Allowed 'General case' 0 CA--C 1.554 1.109 0 C-N-CA 124.658 1.183 . . . . 65.030000000000001 109.166 -177.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 77.54 -99.78 1.5 Allowed Glycine 0 C--N 1.35 1.324 0 CA-C-N 115.36 -0.836 . . . . 64.150000000000006 112.979 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -110.86 -7.3 14.6 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 124.409 1.084 . . . . 71.310000000000002 110.153 177.052 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 22.0 m -103.45 153.68 20.25 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.188 1.395 . . . . 74.420000000000002 110.659 -168.417 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' VAL . . . . . 0.547 HG11 HD13 ' A' ' 81' ' ' LEU . 2.7 p -128.9 104.62 11.63 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.877 0 C-N-CA 124.323 1.049 . . . . 75.519999999999996 108.627 167.238 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 24.3 m -91.97 104.92 17.28 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.646 0.778 . . . . 73.340000000000003 108.937 -178.897 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.416 HG22 ' HA ' ' A' ' 95' ' ' VAL . 53.1 t -102.01 121.99 53.68 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 C-N-CA 124.825 1.25 . . . . 74.150000000000006 109.485 179.573 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -89.03 126.27 35.36 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 108.77 -0.826 . . . . 63.520000000000003 108.77 172.886 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -106.27 154.83 16.81 Favored Glycine 0 N--CA 1.468 0.789 0 N-CA-C 111.131 -0.788 . . . . 65.450000000000003 111.131 173.612 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 . . . . . 0 N--CA 1.477 0.925 0 C-N-CA 123.431 0.692 . . . . 75.420000000000002 109.584 178.262 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.737 0 N-CA-C 108.698 -0.853 . . . . 71.150000000000006 108.698 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.41 ' HD2' ' HB3' ' A' ' 24' ' ' GLN . 38.4 ttpt -89.78 111.88 23.02 Favored 'General case' 0 C--O 1.241 0.655 0 N-CA-C 109.406 -0.59 . . . . 75.140000000000001 109.406 179.321 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.68 HG21 HG13 ' A' ' 62' ' ' VAL . 3.9 p -98.34 142.87 13.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 N-CA-C 107.927 -1.138 . . . . 74.209999999999994 107.927 174.149 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.42 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 44.6 mt-10 -105.52 109.95 22.1 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 107.427 -1.323 . . . . 73.140000000000001 107.427 176.265 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 73.2 t -99.16 113.26 33.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 114.355 -1.293 . . . . 70.430000000000007 108.705 -173.708 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.454 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 46.8 mt-30 -104.35 99.92 9.63 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 108.57 -0.9 . . . . 52.100000000000001 108.57 -176.159 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.441 HG22 HG12 ' A' ' 60' ' ' ILE . 74.9 t -95.18 108.48 20.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 N-CA-C 108.591 -0.892 . . . . 63.25 108.591 -178.227 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.44 ' HE2' ' HB2' ' A' ' 59' ' ' SER . 36.2 ttpt -109.9 107.27 17.15 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.278 -0.874 . . . . 74.400000000000006 108.984 -174.17 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.445 HD13 HG13 ' A' ' 48' ' ' ILE . 14.8 tt -123.55 116.52 48.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 123.086 0.554 . . . . 75.010000000000005 110.126 -177.136 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 93.1 m -94.15 124.28 38.07 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 109.568 -0.53 . . . . 72.0 109.568 178.865 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.436 ' SG ' HG23 ' A' ' 48' ' ' ILE . 47.6 t -150.6 151.56 32.75 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.626 1.17 . . . . 52.119999999999997 109.138 -178.171 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 36.1 t30 69.97 -78.23 0.05 OUTLIER 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 124.89 1.276 . . . . 74.549999999999997 109.798 -176.674 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -165.19 11.69 0.08 OUTLIER Glycine 0 N--CA 1.462 0.431 0 CA-C-N 115.487 -0.779 . . . . 51.109999999999999 111.293 174.176 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -123.19 156.79 34.39 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.231 1.012 . . . . 74.200000000000003 110.45 -173.244 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 93.6 m -103.22 111.9 24.5 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.318 1.047 . . . . 62.229999999999997 109.023 175.101 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 52.8 m-85 -100.46 101.14 12.01 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 108.078 -1.082 . . . . 71.25 108.078 -177.04 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -134.32 156.16 48.96 Favored 'General case' 0 C--O 1.239 0.519 0 C-N-CA 123.276 0.63 . . . . 74.310000000000002 110.695 -177.267 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.3 ttm180 -159.76 146.8 16.53 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.401 -0.818 . . . . 73.5 108.866 175.699 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 31.8 m -89.09 105.75 17.99 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 108.265 -1.013 . . . . 64.140000000000001 108.265 171.529 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 81.9 m-85 -95.9 119.77 34.97 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.8 0.84 . . . . 64.010000000000005 108.859 -177.003 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.42 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 26.6 mp0 -88.2 108.08 19.11 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 107.987 -1.116 . . . . 75.099999999999994 107.987 -179.676 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.455 HD22 ' HB3' ' A' ' 36' ' ' LYS . 78.6 mt -115.17 99.63 7.56 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.745 0.818 . . . . 74.340000000000003 109.189 -175.058 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.407 ' O ' ' HE3' ' A' ' 36' ' ' LYS . 87.8 t80 -94.11 133.61 37.42 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 108.932 -0.766 . . . . 75.140000000000001 108.932 172.614 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.522 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -130.47 171.81 12.58 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.479 0.711 . . . . 73.439999999999998 109.663 175.785 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 26.4 t -95.66 -32.27 4.37 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 N-CA-C 109.319 -0.623 . . . . 74.409999999999997 109.319 172.477 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.486 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 35.1 mtt180 -132.39 169.57 16.34 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.903 0.881 . . . . 64.430000000000007 109.465 179.369 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -66.59 -41.3 88.7 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.871 0.868 . . . . 74.340000000000003 110.976 175.244 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -65.49 -22.01 66.69 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.514 1.126 . . . . 75.510000000000005 111.885 -178.769 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.522 ' HB2' ' HB1' ' A' ' 27' ' ' ALA . 28.5 mm-40 -78.8 -26.5 44.33 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.377 0.671 . . . . 63.240000000000002 111.039 -179.543 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.507 HD22 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -71.4 -23.43 61.87 Favored 'General case' 0 CA--C 1.557 1.24 0 C-N-CA 123.821 0.848 . . . . 55.420000000000002 110.434 -176.344 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.535 ' HG2' HG23 ' A' ' 80' ' ' ILE . 7.8 mtmp? -57.42 -54.19 49.68 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.303 0.641 . . . . 73.349999999999994 111.713 -175.782 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.569 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 1.9 pp20? -60.6 -31.52 70.68 Favored 'General case' 0 C--N 1.354 0.8 0 CA-C-N 115.814 -0.63 . . . . 74.129999999999995 111.115 -176.766 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.507 ' HD2' HD22 ' A' ' 33' ' ' LEU . 58.4 mttm -67.31 -43.58 81.29 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.797 0.839 . . . . 55.140000000000001 110.417 178.87 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.428 HD13 HD23 ' A' ' 81' ' ' LEU . 75.5 mt -61.05 -39.43 89.8 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.902 0.881 . . . . 73.450000000000003 110.687 175.625 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.402 ' HD3' ' HA ' ' A' ' 35' ' ' GLU . 57.3 mtpt -63.87 -42.61 97.47 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.466 0.707 . . . . 74.219999999999999 111.042 175.794 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.569 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 31.7 mmtp -61.03 -48.12 83.26 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 109.698 -0.482 . . . . 65.150000000000006 109.698 177.492 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 52.9 t -57.13 -50.4 76.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 124.847 1.259 . . . . 54.329999999999998 112.032 178.529 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 70.3 mt -70.75 -49.24 48.93 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.256 0.622 . . . . 53.229999999999997 111.12 -173.383 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.402 ' O ' ' HB2' ' A' ' 46' ' ' ASP . 92.3 m-20 -60.92 -39.05 87.94 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 122.887 0.475 . . . . 74.129999999999995 111.162 177.221 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -63.54 -55.01 27.28 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.662 0.785 . . . . 73.430000000000007 110.951 179.24 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.4 tpm_? -71.0 -33.19 70.15 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 115.573 -0.74 . . . . 72.519999999999996 110.92 -173.242 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 59.6 mtp -89.02 -6.65 57.02 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 112.773 0.657 . . . . 71.319999999999993 112.773 -178.19 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.402 ' HB2' ' O ' ' A' ' 42' ' ' ASN . 29.5 t70 -61.61 -50.31 82.89 Favored Pre-proline 0 CA--C 1.569 1.683 0 CA-C-O 118.739 -0.648 . . . . 74.420000000000002 111.855 178.633 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -71.95 -21.32 24.55 Favored 'Trans proline' 0 C--N 1.391 2.767 0 C-N-CA 121.87 1.713 . . . . 62.450000000000003 112.631 174.245 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.445 HG13 HD13 ' A' ' 12' ' ' ILE . 49.3 mm -68.99 -31.46 50.54 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.262 0 C-N-CA 123.549 0.74 . . . . 65.010000000000005 109.91 -178.278 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 60.1 mttm -63.32 -39.93 95.91 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.243 -0.889 . . . . 75.239999999999995 110.412 174.131 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.48 -28.99 62.23 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 123.429 0.691 . . . . 75.430000000000007 109.798 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 94.6 mt -69.85 -33.13 71.86 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 109.703 -0.481 . . . . 63.200000000000003 109.703 176.605 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 69.94 47.98 43.55 Favored Glycine 0 C--N 1.344 0.999 0 CA-C-N 115.097 -0.956 . . . . 51.340000000000003 113.246 173.242 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 99.3 m -75.98 120.98 22.05 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 109.9 -0.408 . . . . 72.040000000000006 109.9 174.05 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 6.6 ptpp? -60.07 -23.19 63.57 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.435 1.094 . . . . 65.510000000000005 112.082 177.592 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 14.3 ttp180 -159.66 139.54 11.61 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.778 0.831 . . . . 53.020000000000003 109.182 175.048 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 17.3 m -129.32 150.57 34.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 124.229 1.012 . . . . 64.150000000000006 109.944 177.286 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 26.6 ttt180 -101.84 115.48 30.63 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 108.353 -0.98 . . . . 73.329999999999998 108.353 170.209 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 21.1 mt -108.58 102.31 13.8 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 N-CA-C 108.424 -0.954 . . . . 75.129999999999995 108.424 177.431 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.44 ' HB2' ' HE2' ' A' ' 11' ' ' LYS . 57.2 m -102.67 104.97 15.35 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 108.551 -0.907 . . . . 64.140000000000001 108.551 178.559 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.473 ' HB ' HG13 ' A' ' 102' ' ' VAL . 63.3 mt -99.13 111.66 29.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 124.227 1.011 . . . . 74.109999999999999 109.537 -176.085 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.454 ' HB2' ' HB2' ' A' ' 9' ' ' GLN . 2.6 mpt_? -90.88 133.8 34.95 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 108.481 -0.933 . . . . 75.409999999999997 108.481 177.044 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.68 HG13 HG21 ' A' ' 6' ' ' VAL . 39.0 t -107.32 110.78 33.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 N-CA-C 107.581 -1.266 . . . . 65.109999999999999 107.581 173.048 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.12 101.96 9.96 Favored 'General case' 0 C--N 1.353 0.751 0 N-CA-C 107.095 -1.446 . . . . 65.010000000000005 107.095 -176.018 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' HIS . . . . . 0.492 ' HD2' HG12 ' A' ' 62' ' ' VAL . 65.0 m170 -68.13 108.73 3.23 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 114.796 -1.093 . . . . 72.25 110.369 -175.204 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 47.8 t -60.22 -58.34 8.92 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 124.147 0.905 . . . . 74.329999999999998 111.379 -173.774 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -106.93 143.17 35.41 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.513 0.725 . . . . 75.409999999999997 110.718 -176.67 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.445 ' O ' ' HG2' ' A' ' 70' ' ' GLU . . . -72.59 -46.41 54.37 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.833 0.853 . . . . 71.0 111.563 -175.898 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -67.81 -31.75 71.83 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.02 0.528 . . . . 75.420000000000002 112.004 -179.735 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -80.51 -32.78 36.84 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 112.47 0.544 . . . . 74.129999999999995 112.47 -174.741 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.604 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 12.8 pt-20 -66.31 -17.63 64.87 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 114.556 1.317 . . . . 62.200000000000003 114.556 -165.889 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -70.59 -44.46 67.3 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 108.899 -0.778 . . . . 72.349999999999994 108.899 176.713 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 16.6 tppt? -71.5 -44.33 64.9 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 114.945 -1.025 . . . . 70.099999999999994 110.277 174.598 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.604 ' HB3' ' HA ' ' A' ' 70' ' ' GLU . 0.3 OUTLIER -63.84 -52.49 59.88 Favored 'General case' 0 C--O 1.209 -1.076 0 CA-C-N 114.603 -1.181 . . . . 73.109999999999999 110.982 -170.365 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.78 -49.58 74.87 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.526 0.73 . . . . 41.43 112.186 -175.909 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -56.36 -47.39 78.95 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 114.945 -1.025 . . . . 31.210000000000001 111.678 177.071 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -78.85 -22.53 45.96 Favored 'General case' 0 CA--C 1.556 1.207 0 C-N-CA 123.355 0.662 . . . . 61.520000000000003 111.317 -177.095 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -81.79 -21.76 37.53 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.939 0.896 . . . . 72.230000000000004 109.204 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -59.73 -36.17 76.05 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.087 0.555 . . . . 73.200000000000003 110.006 169.416 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -74.7 -37.02 62.73 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.895 0.878 . . . . 53.009999999999998 111.324 176.169 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.535 HG23 ' HG2' ' A' ' 34' ' ' LYS . 31.8 mm -62.42 -43.73 98.53 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 C-N-CA 123.853 0.861 . . . . 54.310000000000002 110.456 175.814 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.543 HD13 HG11 ' A' ' 102' ' ' VAL . 47.5 mt -67.34 -39.33 85.76 Favored 'General case' 0 C--O 1.22 -0.486 0 C-N-CA 124.243 1.017 . . . . 72.0 110.289 176.649 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -62.89 -34.9 78.38 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.725 0.81 . . . . 73.510000000000005 110.996 179.725 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 41.6 mmtm -61.56 -51.29 69.19 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 123.511 0.507 . . . . 73.019999999999996 110.306 172.007 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.472 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 73.9 t -61.31 -46.9 95.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 124.174 0.99 . . . . 61.109999999999999 110.73 -173.789 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.512 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 21.1 m-85 -61.5 -35.46 77.74 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 115.267 -0.879 . . . . 75.319999999999993 110.54 179.581 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -76.02 -29.53 58.14 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.999 0.519 . . . . 73.129999999999995 111.366 176.152 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -78.58 -13.7 59.69 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 122.997 0.519 . . . . 72.219999999999999 110.249 178.875 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 57.7 mt -108.86 -25.14 10.93 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.791 0.836 . . . . 61.109999999999999 110.725 178.22 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 119.77 -17.63 10.08 Favored Glycine 0 C--N 1.349 1.278 0 N-CA-C 115.207 0.843 . . . . 51.020000000000003 115.207 176.485 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.512 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 36.9 m-85 -59.83 135.76 57.79 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.619 0.768 . . . . 74.099999999999994 111.476 -177.241 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -99.05 167.75 10.52 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.965 0.906 . . . . 64.219999999999999 111.799 -172.181 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -56.66 -39.43 73.72 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 125.106 1.363 . . . . 73.510000000000005 112.516 -179.408 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 51.2 p -59.5 -29.03 67.57 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.299 1.039 . . . . 54.240000000000002 111.873 179.135 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -84.16 -26.55 28.74 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.706 0.802 . . . . 72.219999999999999 111.72 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 44.7 t -83.52 104.96 12.67 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 N-CA-C 109.364 -0.606 . . . . 74.25 109.364 -175.467 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 97.2 m -133.02 112.88 12.19 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.442 0.697 . . . . 63.340000000000003 110.248 178.813 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 59.8 m95 -76.32 112.3 12.67 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 123.198 0.599 . . . . 74.049999999999997 110.481 178.452 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -121.6 106.08 11.03 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.753 1.221 . . . . 64.209999999999994 109.303 179.608 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 72.86 54.75 6.95 Favored Glycine 0 C--N 1.35 1.342 0 O-C-N 123.518 0.511 . . . . 51.240000000000002 113.99 172.417 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 60.03 22.77 11.93 Favored 'General case' 0 N--CA 1.503 2.179 0 C-N-CA 124.755 1.222 . . . . 64.299999999999997 111.757 -179.383 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 40.4 m -138.96 141.71 38.41 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.073 1.349 . . . . 72.120000000000005 107.685 -171.788 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' VAL . . . . . 0.543 HG11 HD13 ' A' ' 81' ' ' LEU . 5.1 p -94.99 107.65 19.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 N-CA-C 108.878 -0.786 . . . . 71.430000000000007 108.878 179.271 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 89.0 m -98.55 107.72 20.24 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.766 0.826 . . . . 72.540000000000006 109.145 -178.752 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 45.2 t -94.73 131.87 40.35 Favored 'Isoleucine or valine' 0 C--O 1.243 0.733 0 C-N-CA 124.818 1.247 . . . . 70.450000000000003 109.631 -178.989 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -85.13 112.92 21.12 Favored 'General case' 0 C--O 1.24 0.556 0 N-CA-C 107.647 -1.242 . . . . 72.219999999999999 107.647 170.361 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -110.29 137.08 14.04 Favored Glycine 0 N--CA 1.465 0.617 0 CA-C-N 117.8 0.273 . . . . 60.049999999999997 112.889 -177.438 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 . . . . . 0 C--O 1.239 0.505 0 N-CA-C 106.126 -1.805 . . . . 63.030000000000001 106.126 164.379 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? . . . . . 0 N--CA 1.472 0.657 0 N-CA-C 109.707 -0.479 . . . . 73.25 109.707 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.483 ' HA ' ' HA ' ' A' ' 26' ' ' TYR . 23.7 ttpp -83.81 115.04 22.05 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.18 -1.044 . . . . 71.540000000000006 108.18 165.637 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -101.53 152.56 5.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 N-CA-C 106.341 -1.725 . . . . 64.319999999999993 106.341 170.944 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.476 ' H ' ' HB2' ' A' ' 63' ' ' LYS . 42.6 mt-10 -120.0 114.55 22.2 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.676 0.75 . . . . 73.120000000000005 109.607 175.59 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.407 HG21 HD12 ' A' ' 25' ' ' LEU . 62.3 t -96.36 113.39 30.61 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 125.105 1.362 . . . . 55.439999999999998 109.165 -174.434 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 91.9 mt-30 -96.94 103.03 14.92 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 108.231 -1.026 . . . . 55.520000000000003 108.231 -178.125 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 79.9 t -95.98 110.01 23.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 N-CA-C 109.028 -0.73 . . . . 64.319999999999993 109.028 -177.678 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.405 ' HG3' ' HB3' ' A' ' 20' ' ' GLU . 39.5 ttmt -113.21 102.79 10.7 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.905 0.882 . . . . 72.349999999999994 108.754 -178.339 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 10.3 tt -118.07 118.07 56.94 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 C-N-CA 123.098 0.559 . . . . 70.129999999999995 110.302 -176.858 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 60.1 m -90.62 110.49 21.64 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 109.079 -0.711 . . . . 72.420000000000002 109.079 175.663 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.609 ' SG ' HG23 ' A' ' 48' ' ' ILE . 42.4 t -112.67 124.47 52.63 Favored 'General case' 0 C--O 1.244 0.796 0 N-CA-C 107.631 -1.248 . . . . 70.329999999999998 107.631 179.353 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.517 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 43.8 t30 70.19 -80.45 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.021 1.328 . . . . 64.219999999999999 109.51 -176.314 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -158.98 18.47 0.27 Allowed Glycine 0 N--CA 1.464 0.536 0 N-CA-C 111.166 -0.774 . . . . 70.219999999999999 111.166 176.398 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.477 ' HE2' ' HA ' ' A' ' 17' ' ' LYS . 11.1 mmpt? -117.46 126.23 52.27 Favored 'General case' 0 C--N 1.348 0.529 0 C-N-CA 124.344 1.058 . . . . 75.319999999999993 108.77 -179.562 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 38.2 m -94.68 122.09 36.92 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.646 0.778 . . . . 51.140000000000001 109.532 -176.729 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.688 ' HB3' HH21 ' A' ' 44' ' ' ARG . 67.3 m-85 -113.71 101.21 9.1 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.807 0.843 . . . . 74.530000000000001 109.639 -175.172 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.405 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 12.8 pt-20 -118.82 149.24 41.85 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.408 0.683 . . . . 74.329999999999998 110.528 -178.476 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 39.8 ttp180 -166.22 137.08 3.52 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.622 0.769 . . . . 72.239999999999995 109.904 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 39.4 m -86.24 109.36 18.88 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 109.009 -0.737 . . . . 60.420000000000002 109.009 175.741 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 28.3 m-85 -96.7 134.33 40.1 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 107.985 -1.117 . . . . 72.540000000000006 107.985 177.338 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -92.58 108.52 20.04 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 107.661 -1.237 . . . . 63.229999999999997 107.661 177.959 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.407 HD12 HG21 ' A' ' 8' ' ' VAL . 69.7 mt -111.62 96.81 6.31 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 109.187 -0.672 . . . . 44.5 109.187 177.281 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.483 ' HA ' ' HA ' ' A' ' 5' ' ' LYS . 44.6 t80 -93.41 133.92 36.19 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.259 1.024 . . . . 61.009999999999998 109.19 173.536 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.556 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -151.67 144.79 24.61 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 122.453 0.301 . . . . 51.439999999999998 111.217 179.387 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 94.3 t -65.12 -45.98 92.52 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 O-C-N 124.578 1.174 . . . . 30.43 109.586 173.29 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.564 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 58.4 mtt85 -124.05 155.96 37.38 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.42 0.688 . . . . 74.519999999999996 110.118 -179.186 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -65.37 -27.35 68.51 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.58 0.752 . . . . 74.239999999999995 110.37 170.904 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -53.08 -44.88 67.9 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.419 1.088 . . . . 64.329999999999998 110.962 168.421 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.564 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 13.6 mm-40 -73.1 -23.73 60.56 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 115.527 -0.76 . . . . 75.430000000000007 111.143 -177.433 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.418 HD22 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -76.15 -26.83 56.67 Favored 'General case' 0 CA--C 1.559 1.292 0 C-N-CA 123.346 0.658 . . . . 71.200000000000003 110.133 -178.28 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.498 ' HG2' HG23 ' A' ' 80' ' ' ILE . 55.7 mtpt -60.64 -47.38 86.49 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 123.386 0.674 . . . . 74.329999999999998 112.765 -176.037 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -62.33 -35.39 78.94 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.527 0.731 . . . . 75.120000000000005 111.511 175.819 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.418 ' HD2' HD22 ' A' ' 33' ' ' LEU . 66.7 mttm -67.72 -42.82 81.34 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.655 0.782 . . . . 64.109999999999999 110.54 -179.069 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.466 HD13 HD23 ' A' ' 81' ' ' LEU . 88.8 mt -59.27 -45.95 89.85 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 124.15 0.906 . . . . 71.329999999999998 110.216 176.029 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -54.76 -48.47 72.58 Favored 'General case' 0 N--CA 1.482 1.144 0 O-C-N 123.741 0.651 . . . . 72.040000000000006 110.964 174.261 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.477 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 4.5 mmmp? -60.81 -59.51 5.27 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.233 0.613 . . . . 74.439999999999998 110.98 -178.23 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 60.7 t -48.65 -44.49 14.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 C-N-CA 125.196 1.398 . . . . 63.030000000000001 111.894 -178.822 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.468 HD21 HD11 ' A' ' 60' ' ' ILE . 58.5 mt -65.88 -51.41 59.0 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.312 -0.858 . . . . 73.030000000000001 110.802 177.305 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -68.56 -22.35 64.48 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 113.145 0.794 . . . . 72.549999999999997 113.145 -176.438 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 15.6 mm-40 -74.73 -53.56 8.99 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 108.61 -0.885 . . . . 73.439999999999998 108.61 174.453 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.688 HH21 ' HB3' ' A' ' 19' ' ' TYR . 17.7 tpt180 -74.64 -25.86 59.49 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-N 114.888 -1.051 . . . . 74.120000000000005 111.695 -171.133 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 55.6 mtp -92.39 -8.39 45.02 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 112.639 0.607 . . . . 54.399999999999999 112.639 -179.091 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.563 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 33.9 t70 -59.27 -49.84 90.66 Favored Pre-proline 0 CA--C 1.567 1.609 0 CA-C-O 118.791 -0.623 . . . . 72.409999999999997 112.206 177.527 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.442 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 39.5 Cg_endo -65.36 -28.53 54.72 Favored 'Trans proline' 0 C--N 1.39 2.761 0 C-N-CA 121.835 1.69 . . . . 74.439999999999998 112.644 173.698 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.609 HG23 ' SG ' ' A' ' 14' ' ' CYS . 50.0 mm -67.91 -36.97 77.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 C-N-CA 124.148 0.979 . . . . 54.350000000000001 111.511 -170.749 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.563 ' HE2' ' HA ' ' A' ' 46' ' ' ASP . 44.3 mtmt -66.81 -41.15 88.01 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 115.98 -0.554 . . . . 74.340000000000003 109.701 177.167 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -72.52 -24.73 61.19 Favored 'General case' 0 CA--C 1.557 1.233 0 CA-C-N 114.603 -1.18 . . . . 70.349999999999994 110.189 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 83.3 mt -75.7 -33.01 60.32 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.265 0.626 . . . . 75.200000000000003 110.416 173.654 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 72.59 55.05 6.94 Favored Glycine 0 C--N 1.345 1.073 0 CA-C-N 115.91 -0.586 . . . . 43.530000000000001 113.052 178.501 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.517 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 65.6 m -94.54 113.8 25.68 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 108.525 -0.917 . . . . 61.329999999999998 108.525 173.153 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.4 mtpm? -63.73 -78.33 0.05 OUTLIER 'General case' 0 N--CA 1.476 0.851 0 O-C-N 123.601 0.563 . . . . 74.239999999999995 110.216 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 15.1 ttm180 -84.3 121.21 27.2 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 109.321 -0.622 . . . . 71.409999999999997 109.321 178.971 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 29.3 m -126.26 138.5 54.43 Favored 'Isoleucine or valine' 0 C--O 1.243 0.738 0 C-N-CA 124.275 1.03 . . . . 64.140000000000001 108.589 173.618 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 58.9 ttt180 -103.09 109.43 20.99 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 107.775 -1.195 . . . . 53.32 107.775 169.359 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.409 HG22 HG13 ' A' ' 60' ' ' ILE . 34.0 mt -96.05 102.33 13.4 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 N-CA-C 106.791 -1.559 . . . . 62.210000000000001 106.791 173.927 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.3 m -100.68 102.77 13.96 Favored 'General case' 0 C--O 1.24 0.593 0 N-CA-C 107.597 -1.26 . . . . 75.409999999999997 107.597 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.468 HD11 HD21 ' A' ' 41' ' ' LEU . 72.2 mt -102.75 118.62 49.94 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 C-N-CA 123.343 0.657 . . . . 73.340000000000003 109.279 -178.136 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 51.9 mtm180 -108.5 118.84 37.83 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 108.55 -0.907 . . . . 71.209999999999994 108.55 175.812 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 7.2 p -92.82 138.25 20.49 Favored 'Isoleucine or valine' 0 C--O 1.242 0.679 0 N-CA-C 108.063 -1.088 . . . . 74.329999999999998 108.063 177.656 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.476 ' HB2' ' H ' ' A' ' 7' ' ' GLU . 10.3 mmpt? -80.12 110.1 15.21 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 107.355 -1.35 . . . . 75.219999999999999 107.355 174.134 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 55.6 m80 -75.98 142.65 41.88 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 115.342 -0.844 . . . . 74.109999999999999 109.125 -176.192 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.466 ' H ' ' HG2' ' A' ' 73' ' ' GLU . 32.0 m -52.15 -40.46 61.44 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.627 1.171 . . . . 71.409999999999997 113.641 -170.627 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -169.28 164.88 10.93 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.155 0.982 . . . . 73.150000000000006 108.732 -174.795 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -74.92 -26.19 59.45 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 112.697 0.629 . . . . 74.439999999999998 112.697 -178.299 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.69 -40.51 25.29 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 109.587 -0.523 . . . . 75.329999999999998 109.587 171.682 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -70.01 -17.58 63.28 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 115.436 -0.802 . . . . 73.140000000000001 111.658 175.684 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -49.72 -44.06 48.12 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 125.472 1.509 . . . . 75.049999999999997 112.284 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 24.5 mtpp -61.8 -37.24 83.65 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 114.623 -1.171 . . . . 73.200000000000003 111.357 -178.45 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.5 ' HA ' ' HE3' ' A' ' 72' ' ' LYS . 0.9 OUTLIER -83.65 -39.59 20.06 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 115.474 -0.784 . . . . 53.32 111.206 178.104 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.466 ' HG2' ' H ' ' A' ' 65' ' ' SER . 16.4 tp10 -76.65 -44.4 34.1 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.851 0.861 . . . . 74.209999999999994 111.18 -161.905 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.02 -48.87 74.63 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 123.928 0.767 . . . . 71.109999999999999 110.685 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 49.6 tptt -61.44 -43.81 98.21 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.291 1.037 . . . . 71.340000000000003 111.584 -179.318 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.9 tmmm? -64.18 -50.86 66.45 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 124.522 1.129 . . . . 72.209999999999994 110.137 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -75.21 -24.2 57.71 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 115.445 -0.798 . . . . 74.319999999999993 111.023 -171.314 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.72 -42.71 99.79 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.613 0.765 . . . . 72.120000000000005 110.769 174.729 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.28 -37.11 84.68 Favored 'General case' 0 CA--C 1.547 0.865 0 CA-C-N 115.227 -0.897 . . . . 72.209999999999994 111.214 177.354 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.498 HG23 ' HG2' ' A' ' 34' ' ' LYS . 48.2 mm -63.16 -47.12 93.92 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 C-N-CA 124.055 0.942 . . . . 74.540000000000006 110.728 177.197 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.659 HD13 HG11 ' A' ' 102' ' ' VAL . 56.1 mt -64.37 -46.2 84.41 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.862 0.865 . . . . 65.430000000000007 111.253 -177.178 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -59.59 -32.97 70.88 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.851 0.86 . . . . 75.299999999999997 109.907 -174.976 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -69.15 -48.01 63.46 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.324 0.65 . . . . 73.219999999999999 111.222 174.687 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 77.5 t -64.97 -44.86 96.02 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 C-N-CA 123.03 0.532 . . . . 53.329999999999998 111.371 -172.318 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 33.9 m-85 -61.29 -37.32 82.76 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.189 0.596 . . . . 53.329999999999998 110.942 175.918 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.53 -30.64 70.35 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.453 0.701 . . . . 75.530000000000001 111.437 175.843 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -81.18 -2.25 47.88 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.214 1.006 . . . . 75.230000000000004 111.138 178.967 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.7 mt -104.94 -24.56 12.82 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.924 0.89 . . . . 74.120000000000005 109.772 173.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 128.15 -17.15 5.98 Favored Glycine 0 C--N 1.346 1.118 0 CA-C-O 119.421 -0.655 . . . . 61.43 113.109 178.957 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -61.05 138.06 58.21 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-N 117.266 0.533 . . . . 72.540000000000006 110.422 178.222 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -81.01 169.25 17.74 Favored 'General case' 0 C--O 1.243 0.756 0 C-N-CA 123.26 0.624 . . . . 73.319999999999993 109.525 176.359 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -61.94 -37.16 83.65 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.009 0.524 . . . . 44.020000000000003 111.448 -178.982 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 40.4 p -63.54 -25.41 68.24 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.367 1.067 . . . . 73.310000000000002 113.083 179.203 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ASN . . . . . 0.428 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 12.7 m120 -63.56 -39.92 95.64 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 122.687 0.395 . . . . 70.430000000000007 110.251 172.548 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 36.3 t -83.74 102.58 9.9 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.93 0 C-N-CA 124.352 1.061 . . . . 74.439999999999998 109.8 -171.887 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.412 ' O ' ' HA ' ' A' ' 102' ' ' VAL . 5.9 m -111.21 152.86 26.61 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.683 0.793 . . . . 62.329999999999998 109.079 -179.258 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 20.6 m95 -128.6 115.7 18.48 Favored 'General case' 0 N--CA 1.484 1.243 0 CA-C-N 118.335 0.516 . . . . 74.329999999999998 109.777 176.02 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -157.77 126.78 5.75 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.426 1.09 . . . . 72.310000000000002 110.131 -174.383 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 62.48 46.75 93.15 Favored Glycine 0 C--N 1.352 1.47 0 C-N-CA 123.049 0.356 . . . . 72.420000000000002 112.981 179.024 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 59.08 9.3 1.24 Allowed 'General case' 0 N--CA 1.503 2.198 0 C-N-CA 126.632 1.973 . . . . 73.400000000000006 113.243 -176.575 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 33.0 m -109.27 145.12 36.46 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.637 1.175 . . . . 73.219999999999999 109.199 -174.526 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' VAL . . . . . 0.659 HG11 HD13 ' A' ' 81' ' ' LEU . 6.0 p -97.89 108.85 22.51 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.852 0 N-CA-C 107.961 -1.126 . . . . 64.219999999999999 107.961 166.006 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 80.0 m -92.64 100.93 13.35 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 108.564 -0.902 . . . . 74.409999999999997 108.564 179.205 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.428 ' HA ' ' O ' ' A' ' 94' ' ' ASN . 52.3 t -95.29 108.43 20.92 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 N-CA-C 107.483 -1.303 . . . . 73.230000000000004 107.483 175.345 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -119.06 129.47 55.11 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 107.644 -1.243 . . . . 74.030000000000001 107.644 179.594 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -160.71 -164.88 16.43 Favored Glycine 0 C--O 1.241 0.54 0 N-CA-C 111.344 -0.702 . . . . 73.439999999999998 111.344 -178.529 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 . . . . . 0 C--O 1.243 0.751 0 C-N-CA 123.064 0.546 . . . . 73.409999999999997 110.049 177.986 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.48 ' HA ' ' HE3' ' A' ' 4' ' ' LYS . 0.8 OUTLIER . . . . . 0 CA--C 1.544 0.729 0 N-CA-C 110.305 -0.258 . . . . 72.120000000000005 110.305 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -97.84 139.81 33.14 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 108.434 -0.95 . . . . 72.109999999999999 108.434 168.749 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 5.6 p -143.05 146.68 21.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 123.547 0.739 . . . . 75.450000000000003 109.919 177.906 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.525 ' HG3' ' HG3' ' A' ' 24' ' ' GLN . 3.4 mp0 -106.19 117.85 35.1 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 107.917 -1.142 . . . . 70.219999999999999 107.917 174.517 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.583 HG22 HG23 ' A' ' 62' ' ' VAL . 95.0 t -104.48 127.92 58.45 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 124.324 1.05 . . . . 74.129999999999995 108.757 -176.99 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.421 ' O ' ' HA ' ' A' ' 60' ' ' ILE . 45.7 mt-30 -111.1 101.88 10.38 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 109.198 -0.668 . . . . 52.450000000000003 109.198 176.126 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 88.0 t -93.84 112.07 26.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 N-CA-C 108.466 -0.939 . . . . 60.32 108.466 -179.533 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.437 ' O ' ' HA ' ' A' ' 58' ' ' ILE . 39.6 ttmt -106.48 104.4 14.08 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 108.455 -0.943 . . . . 65.140000000000001 108.455 179.548 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 14.9 tt -116.49 116.91 53.73 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 CA-C-O 121.381 0.61 . . . . 72.239999999999995 109.813 -178.709 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 50.7 m -104.81 135.79 45.53 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 123.372 0.669 . . . . 73.230000000000004 111.122 -175.383 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 39.8 t -163.32 141.21 7.78 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.179 0.992 . . . . 75.349999999999994 111.339 174.344 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 14.2 m120 60.49 32.24 20.46 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 125.279 1.432 . . . . 64.510000000000005 112.74 171.885 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 87.97 -1.98 85.33 Favored Glycine 0 C--N 1.345 1.056 0 CA-C-N 115.974 -0.557 . . . . 34.520000000000003 113.837 177.084 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 24.4 mmmt -115.21 147.63 40.09 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.243 0.617 . . . . 62.200000000000003 110.392 178.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 53.2 m -116.15 130.46 56.81 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 124.102 0.961 . . . . 54.130000000000003 108.731 175.69 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.1 m-85 -114.76 100.36 8.18 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 108.407 -0.96 . . . . 61.32 108.407 -179.518 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -127.84 142.05 51.39 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.108 0.563 . . . . 74.430000000000007 110.254 -177.953 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.3 tpt180 -159.4 145.27 16.14 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 115.87 -0.605 . . . . 73.409999999999997 109.939 -173.243 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 22.6 m -98.33 109.08 21.89 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 124.307 1.043 . . . . 63.240000000000002 109.706 178.028 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.402 ' HE1' HH21 ' A' ' 44' ' ' ARG . 5.8 m-85 -100.83 137.87 38.64 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.555 1.142 . . . . 74.120000000000005 108.67 -179.107 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.525 ' HG3' ' HG3' ' A' ' 7' ' ' GLU . 27.0 mp0 -103.59 108.23 19.42 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 108.349 -0.982 . . . . 65.400000000000006 108.349 178.457 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 80.4 mt -112.07 99.29 7.96 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.335 1.054 . . . . 55.32 109.637 -174.367 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 89.1 t80 -92.93 135.55 34.04 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 108.88 -0.785 . . . . 64.120000000000005 108.88 169.837 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.565 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -141.03 150.22 42.72 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.989 0.916 . . . . 70.230000000000004 109.467 179.718 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.0 t -80.87 -38.92 17.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-O 121.263 0.554 . . . . 74.219999999999999 110.338 175.285 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.542 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 52.2 mtt180 -119.92 163.34 17.71 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.279 0.631 . . . . 73.530000000000001 110.174 175.386 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -65.18 -34.57 78.69 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 115.253 -0.885 . . . . 52.439999999999998 109.919 170.869 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.524 ' HA ' ' HD3' ' A' ' 34' ' ' LYS . 25.4 mm-40 -56.99 -39.66 75.08 Favored 'General case' 0 C--N 1.359 1.015 0 C-N-CA 124.297 1.039 . . . . 71.140000000000001 111.573 173.255 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.565 ' HB2' ' HB1' ' A' ' 27' ' ' ALA . 29.9 mm-40 -68.04 -40.85 82.76 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 116.005 -0.543 . . . . 51.509999999999998 110.274 178.599 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.49 -33.92 76.64 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.637 0.775 . . . . 74.299999999999997 110.368 -179.305 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.524 ' HD3' ' HA ' ' A' ' 31' ' ' GLU . 59.6 mtpt -59.43 -51.79 68.4 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.629 0.772 . . . . 72.420000000000002 112.21 -178.649 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.524 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 1.2 pp20? -67.86 -28.04 67.19 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-O 119.467 -0.301 . . . . 63.020000000000003 111.33 179.659 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -64.89 -40.99 95.96 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.137 0.575 . . . . 75.040000000000006 111.054 174.743 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.475 HD13 HD23 ' A' ' 81' ' ' LEU . 70.3 mt -61.18 -44.17 97.72 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 123.747 0.655 . . . . 74.140000000000001 110.729 173.736 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -61.23 -39.35 89.95 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 122.834 0.453 . . . . 71.310000000000002 111.474 176.718 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.524 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 33.7 mmtp -61.39 -54.42 43.9 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.45 0.7 . . . . 74.040000000000006 110.691 176.828 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 47.1 t -58.43 -51.52 70.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 124.549 1.139 . . . . 71.5 112.169 -177.66 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 70.3 mt -65.72 -48.79 70.79 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 124.054 0.846 . . . . 65.340000000000003 111.384 -174.304 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 31.0 t-20 -60.79 -46.52 90.19 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.256 0.622 . . . . 64.519999999999996 110.419 -178.618 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -60.7 -43.87 97.25 Favored 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 123.622 0.769 . . . . 73.519999999999996 112.177 177.371 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ARG . . . . . 0.402 HH21 ' HE1' ' A' ' 23' ' ' TYR . 17.1 tpp180 -66.45 -24.89 66.51 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 123.504 0.722 . . . . 75.0 111.298 -178.829 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.483 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 65.3 mtp -85.43 -14.03 47.43 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-O 118.205 -0.902 . . . . 62.140000000000001 112.877 176.774 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.462 ' HA ' ' HD2' ' A' ' 49' ' ' LYS . 0.8 OUTLIER -60.34 -43.98 94.73 Favored Pre-proline 0 N--CA 1.503 2.21 0 CA-C-N 119.861 1.209 . . . . 73.329999999999998 113.42 -179.746 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.469 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 12.3 Cg_endo -56.71 -37.19 98.35 Favored 'Trans proline' 0 C--N 1.394 2.956 0 C-N-CA 121.715 1.61 . . . . 73.439999999999998 111.802 167.556 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.438 HG23 ' SG ' ' A' ' 53' ' ' CYS . 35.1 mm -72.78 -29.2 29.09 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.211 0 C-N-CA 124.77 1.228 . . . . 74.319999999999993 110.844 -174.06 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 45' ' ' MET . 80.9 mttt -75.1 -39.25 60.82 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.288 0.635 . . . . 73.340000000000003 109.681 179.401 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.6 ttpm? -69.44 -26.05 64.41 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 115.185 -0.916 . . . . 73.349999999999994 111.233 173.168 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 69.8 mt -72.3 -32.48 66.62 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 109.311 -0.626 . . . . 73.25 109.311 171.839 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 82.59 38.31 12.45 Favored Glycine 0 C--N 1.348 1.212 0 CA-C-N 115.897 -0.592 . . . . 42.5 112.297 178.497 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.438 ' SG ' HG23 ' A' ' 48' ' ' ILE . 33.1 m -73.51 118.98 17.11 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.563 0.745 . . . . 74.209999999999994 110.541 -179.076 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.95 -55.47 16.66 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 122.909 0.484 . . . . 71.439999999999998 110.349 177.417 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.1 ttm180 -121.51 144.57 48.64 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.984 0.913 . . . . 75.200000000000003 109.05 178.479 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 35.2 m -125.78 145.0 33.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 124.191 0.996 . . . . 75.519999999999996 109.326 179.165 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 38.6 ttm180 -109.37 109.61 20.53 Favored 'General case' 0 C--O 1.238 0.5 0 N-CA-C 107.948 -1.13 . . . . 74.530000000000001 107.948 173.418 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.437 ' HA ' ' O ' ' A' ' 11' ' ' LYS . 36.6 mt -105.95 134.85 46.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 C-N-CA 123.82 0.848 . . . . 70.129999999999995 108.933 179.329 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 50.9 m -129.35 106.97 9.15 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 107.45 -1.315 . . . . 44.200000000000003 107.45 173.372 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.474 ' HB ' HG13 ' A' ' 102' ' ' VAL . 76.3 mt -98.88 122.21 50.33 Favored 'Isoleucine or valine' 0 C--O 1.24 0.563 0 C-N-CA 123.513 0.725 . . . . 75.239999999999995 110.066 -177.784 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -104.28 103.4 13.15 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 107.078 -1.453 . . . . 75.319999999999993 107.078 172.918 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.583 HG23 HG22 ' A' ' 8' ' ' VAL . 6.7 p -95.98 146.09 7.63 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 N-CA-C 108.776 -0.824 . . . . 74.329999999999998 108.776 -177.774 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.441 ' HG3' ' HB2' ' A' ' 7' ' ' GLU . 12.7 mmmm -81.35 109.26 15.68 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.123 0.487 . . . . 71.150000000000006 110.236 177.967 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' HIS . . . . . 0.428 ' HB2' ' HG2' ' A' ' 70' ' ' GLU . 53.4 m-70 -80.88 111.66 17.55 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 107.501 -1.296 . . . . 74.409999999999997 107.501 178.592 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 38.8 t -20.29 -68.35 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 C-N-CA 127.249 2.22 . . . . 45.039999999999999 115.281 -166.579 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.558 ' H ' ' HB2' ' A' ' 69' ' ' GLU . 6.6 m-20 -137.1 173.17 11.98 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 108.057 -1.09 . . . . 74.439999999999998 108.057 174.81 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.8 -41.91 97.81 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.431 0.693 . . . . 75.219999999999999 111.479 -173.682 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -73.57 -26.87 61.02 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.097 0.559 . . . . 71.140000000000001 111.372 176.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.558 ' HB2' ' H ' ' A' ' 66' ' ' ASP . 18.4 mm-40 -74.97 -27.55 60.21 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-O 118.697 -0.668 . . . . 52.539999999999999 111.707 179.74 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.428 ' HG2' ' HB2' ' A' ' 64' ' ' HIS . 48.5 mt-10 -46.98 -40.03 13.63 Favored 'General case' 0 N--CA 1.498 1.959 0 N-CA-C 114.449 1.277 . . . . 75.140000000000001 114.449 -166.976 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 58.2 mttp -65.99 -58.21 6.05 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.23 0.612 . . . . 74.340000000000003 111.088 -176.65 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.9 tptt -66.19 -35.71 81.17 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.192 0.997 . . . . 72.230000000000004 111.048 -178.992 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -64.61 -48.02 76.43 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.433 1.093 . . . . 71.329999999999998 109.438 -179.371 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.48 -39.84 92.41 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 124.129 0.893 . . . . 24.329999999999998 111.631 -177.233 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -62.01 -43.64 98.4 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.495 0.718 . . . . 71.150000000000006 110.949 175.991 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.16 -44.55 83.76 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 124.109 0.964 . . . . 71.219999999999999 110.351 178.394 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -76.15 -20.27 57.73 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 115.55 -0.75 . . . . 74.109999999999999 110.523 -174.473 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.83 -43.07 94.29 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.344 0.657 . . . . 72.530000000000001 109.915 171.128 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.4 -41.03 85.6 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 123.439 0.696 . . . . 52.009999999999998 111.092 176.392 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.446 HG23 ' HG2' ' A' ' 34' ' ' LYS . 31.8 mm -57.71 -53.45 44.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 124.514 1.126 . . . . 63.25 110.914 177.125 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.475 HD23 HD13 ' A' ' 37' ' ' LEU . 43.8 mt -69.24 -33.25 72.99 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.779 0.832 . . . . 62.140000000000001 112.294 -178.934 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 62.3 t30 -59.32 -38.22 79.75 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.318 0.647 . . . . 65.239999999999995 110.394 -178.639 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -71.11 -46.08 62.4 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 114.575 -1.193 . . . . 75.450000000000003 111.756 175.757 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 54.6 t -62.34 -54.33 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 C-N-CA 123.949 0.9 . . . . 75.230000000000004 110.801 -173.921 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.581 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 22.2 m-85 -59.5 -37.08 77.34 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 115.017 -0.992 . . . . 61.100000000000001 111.93 -179.609 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.69 -26.64 67.12 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.306 0.643 . . . . 74.299999999999997 112.015 179.454 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -85.85 -12.76 49.94 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.023 0.929 . . . . 72.329999999999998 110.683 177.582 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.7 mt -107.21 0.51 23.32 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.608 0.763 . . . . 74.329999999999998 111.751 -174.868 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 103.18 -7.13 51.51 Favored Glycine 0 C--N 1.345 1.061 0 N-CA-C 114.252 0.461 . . . . 71.239999999999995 114.252 176.328 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.581 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 46.6 m-85 -84.44 131.82 34.63 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.469 0.708 . . . . 65.219999999999999 110.059 178.389 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -116.44 -166.06 1.12 Allowed 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 124.509 1.124 . . . . 61.219999999999999 109.874 -177.479 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -50.65 -51.13 51.94 Favored 'General case' 0 N--CA 1.492 1.668 0 C-N-CA 124.024 0.929 . . . . 72.510000000000005 112.278 -179.216 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 20.1 m -63.17 -17.69 62.66 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 124.205 1.002 . . . . 74.230000000000004 112.838 -176.564 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ASN . . . . . 0.426 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 18.4 m120 -94.12 -38.98 10.82 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.511 0.725 . . . . 72.340000000000003 110.827 -175.936 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 42.1 t -89.82 127.32 42.5 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 122.708 0.403 . . . . 74.219999999999999 109.98 -176.154 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 27.1 m -145.74 113.68 6.49 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.314 0.646 . . . . 75.200000000000003 109.862 178.842 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 68.2 m95 -82.07 142.34 32.39 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 122.778 0.431 . . . . 73.439999999999998 110.411 174.193 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -144.22 94.62 2.6 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.344 1.057 . . . . 73.310000000000002 108.93 -177.039 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 67.5 -92.98 0.23 Allowed Glycine 0 C--N 1.348 1.204 0 CA-C-N 115.531 -0.758 . . . . 74.319999999999993 113.686 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -114.72 -19.45 11.05 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.348 1.059 . . . . 72.510000000000005 110.395 -175.42 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 89.0 m -100.14 149.65 23.3 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.998 1.319 . . . . 72.450000000000003 110.541 -177.385 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' VAL . . . . . 0.474 HG13 ' HB ' ' A' ' 60' ' ' ILE . 3.3 p -110.99 113.39 44.14 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 N-CA-C 108.523 -0.917 . . . . 75.200000000000003 108.523 169.863 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 48.7 m -100.54 111.19 23.41 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 108.957 -0.757 . . . . 54.450000000000003 108.957 178.725 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.426 ' HA ' ' O ' ' A' ' 94' ' ' ASN . 86.1 t -110.37 109.93 30.29 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 N-CA-C 109.297 -0.631 . . . . 55.119999999999997 109.297 177.419 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -110.46 111.49 22.78 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 107.463 -1.31 . . . . 73.430000000000007 107.463 177.059 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -157.85 172.87 35.12 Favored Glycine 0 C--N 1.342 0.903 0 C-N-CA 121.802 -0.237 . . . . 70.530000000000001 112.718 -174.405 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 . . . . . 0 C--O 1.241 0.651 0 CA-C-O 121.906 0.86 . . . . 73.420000000000002 112.142 -172.591 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.24 0.603 0 CA-C-O 121.247 0.546 . . . . 74.219999999999999 110.218 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.7 ttpm? -98.05 113.32 25.15 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 107.884 -1.154 . . . . 73.120000000000005 107.884 170.052 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -100.42 127.74 53.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 N-CA-C 107.396 -1.335 . . . . 63.409999999999997 107.396 172.98 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -102.34 113.76 27.35 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 108.303 -0.999 . . . . 74.409999999999997 108.303 177.973 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 75.0 t -95.05 106.14 17.83 Favored 'Isoleucine or valine' 0 C--O 1.239 0.522 0 C-N-CA 125.147 1.379 . . . . 72.129999999999995 108.606 -174.274 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.506 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 65.5 mt-30 -99.84 98.84 9.59 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 108.373 -0.973 . . . . 52.030000000000001 108.373 -172.51 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.404 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 57.3 t -93.67 107.37 19.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 N-CA-C 108.919 -0.771 . . . . 70.109999999999999 108.919 -173.609 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.414 ' HG3' ' HB3' ' A' ' 20' ' ' GLU . 40.1 ttmt -106.19 101.65 11.11 Favored 'General case' 0 C--N 1.346 0.416 0 N-CA-C 107.817 -1.179 . . . . 64.510000000000005 107.817 178.902 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.489 ' HA ' ' O ' ' A' ' 57' ' ' ARG . 14.6 tt -119.09 122.08 68.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 122.965 0.506 . . . . 73.450000000000003 110.301 -174.062 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 30.0 m -90.33 123.16 33.86 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 109.178 -0.675 . . . . 75.310000000000002 109.178 178.062 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.639 ' SG ' HG23 ' A' ' 48' ' ' ILE . 16.2 t -156.66 126.27 6.23 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.142 0.977 . . . . 74.349999999999994 109.01 -173.856 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.492 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 6.3 t-20 66.33 25.22 10.45 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 125.218 1.407 . . . . 74.400000000000006 110.975 175.569 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.19 1.51 86.34 Favored Glycine 0 C--N 1.352 1.443 0 CA-C-N 115.585 -0.734 . . . . 72.219999999999999 113.843 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm -109.85 153.07 24.95 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.937 0.895 . . . . 75.129999999999995 110.023 -179.729 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 28.0 m -113.26 107.5 15.98 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.266 0.627 . . . . 71.120000000000005 109.415 -179.494 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -100.89 99.2 9.65 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 107.586 -1.265 . . . . 71.319999999999993 107.586 -175.135 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.414 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 8.4 pt-20 -115.4 122.61 46.34 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 109.578 -0.527 . . . . 73.099999999999994 109.578 -179.533 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.5 tpm_? -140.76 127.36 20.18 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.554 -0.748 . . . . 71.439999999999998 110.243 -169.699 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 27.3 m -86.67 111.35 20.59 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 123.661 0.784 . . . . 73.540000000000006 109.891 176.43 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -97.66 119.81 36.9 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.724 0.81 . . . . 74.219999999999999 109.374 177.29 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 26.8 mp0 -86.69 109.26 19.08 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 108.135 -1.061 . . . . 74.409999999999997 108.135 -179.674 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.466 HD11 HG21 ' A' ' 40' ' ' VAL . 86.1 mt -120.26 132.58 55.39 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.922 0.889 . . . . 51.210000000000001 109.286 -178.069 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 39.8 t80 -126.4 135.97 52.09 Favored 'General case' 0 C--O 1.24 0.577 0 N-CA-C 108.673 -0.862 . . . . 72.0 108.673 177.771 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.444 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -156.15 152.55 28.04 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.245 0.618 . . . . 64.120000000000005 109.439 173.157 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 95.8 t -67.99 -60.05 2.99 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 O-C-N 124.158 0.911 . . . . 65.299999999999997 109.294 174.031 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.577 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 97.4 mtt180 -96.57 162.87 13.27 Favored 'General case' 0 C--O 1.242 0.665 0 CA-C-O 121.837 0.827 . . . . 61.32 111.61 -178.267 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 18.2 p-10 -67.29 -37.16 82.95 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 113.598 -1.637 . . . . 65.140000000000001 111.055 174.057 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -67.68 -31.83 72.08 Favored 'General case' 0 C--N 1.353 0.747 0 C-N-CA 124.244 1.017 . . . . 71.25 111.58 -175.923 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.577 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 26.1 mm-40 -66.4 -35.63 80.8 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.861 -0.609 . . . . 64.349999999999994 109.926 177.961 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.407 HD23 ' HB3' ' A' ' 27' ' ' ALA . 0.1 OUTLIER -69.86 -25.85 63.92 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 123.893 0.877 . . . . 54.399999999999999 110.784 -176.243 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.508 ' HG2' HG23 ' A' ' 80' ' ' ILE . 53.2 mtmt -55.19 -62.13 1.87 Allowed 'General case' 0 C--N 1.365 1.28 0 C-N-CA 122.944 0.498 . . . . 75.540000000000006 111.556 -178.71 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.542 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 3.1 pp20? -61.29 -29.99 70.21 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 115.979 -0.555 . . . . 72.109999999999999 111.857 -176.972 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 56.4 mttm -67.08 -43.38 82.75 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.231 0.612 . . . . 71.25 110.423 177.687 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.493 HD13 HD23 ' A' ' 81' ' ' LEU . 88.8 mt -59.7 -40.55 88.27 Favored 'General case' 0 N--CA 1.474 0.746 0 O-C-N 123.989 0.806 . . . . 73.209999999999994 110.496 176.269 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -58.91 -46.51 87.73 Favored 'General case' 0 C--N 1.359 0.995 0 C-N-CA 123.025 0.53 . . . . 74.25 110.971 175.65 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.542 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 14.2 mmmm -60.58 -52.0 67.02 Favored 'General case' 0 N--CA 1.48 1.046 0 O-C-N 123.586 0.554 . . . . 75.439999999999998 110.04 179.183 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.466 HG21 HD11 ' A' ' 25' ' ' LEU . 46.5 t -55.16 -42.87 67.84 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 125.127 1.371 . . . . 70.239999999999995 111.996 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 67.0 mt -71.95 -36.64 69.93 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 122.869 0.468 . . . . 70.219999999999999 110.611 -179.402 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.3 m-80 -65.52 -30.95 71.77 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 122.78 0.432 . . . . 74.120000000000005 111.643 173.182 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 13.6 mm-40 -75.18 -54.54 6.94 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 122.501 0.32 . . . . 64.25 110.624 179.158 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.7 tpp180 -66.58 -36.38 82.5 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.29 0.636 . . . . 63.130000000000003 111.113 -175.823 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.505 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 69.9 mtp -86.41 -10.8 53.54 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 118.728 -0.653 . . . . 71.519999999999996 112.613 -178.159 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.54 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 22.4 t70 -58.79 -53.22 68.57 Favored Pre-proline 0 CA--C 1.564 1.49 0 CA-C-O 118.41 -0.805 . . . . 73.530000000000001 111.479 178.705 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -61.59 -29.67 84.65 Favored 'Trans proline' 0 C--N 1.395 2.988 0 C-N-CA 121.877 1.718 . . . . 75.209999999999994 111.912 174.253 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.639 HG23 ' SG ' ' A' ' 14' ' ' CYS . 49.4 mm -70.25 -34.0 56.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 123.893 0.877 . . . . 71.109999999999999 110.804 -173.158 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.54 ' HE2' ' HA ' ' A' ' 46' ' ' ASP . 45.6 mtmt -71.01 -38.97 72.64 Favored 'General case' 0 C--N 1.353 0.722 0 N-CA-C 109.667 -0.494 . . . . 75.019999999999996 109.667 178.195 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.1 tmmt? -73.85 -26.05 60.38 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 116.046 -0.524 . . . . 73.519999999999996 110.34 177.932 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.6 mt -70.9 -27.79 64.06 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 108.726 -0.842 . . . . 63.030000000000001 108.726 170.99 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 69.43 37.73 79.45 Favored Glycine 0 C--N 1.353 1.473 0 O-C-N 124.275 0.985 . . . . 70.319999999999993 112.933 172.767 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.492 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 71.4 m -70.74 111.25 6.06 Favored 'General case' 0 C--O 1.241 0.635 0 O-C-N 124.282 0.637 . . . . 51.210000000000001 109.917 177.881 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -58.01 -55.01 40.41 Favored 'General case' 0 C--O 1.215 -0.746 0 O-C-N 124.804 1.315 . . . . 75.540000000000006 110.465 -173.231 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 73.9 ttt180 -108.62 136.06 48.83 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 108.641 -0.874 . . . . 64.140000000000001 108.641 172.207 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 30.1 m -124.75 139.76 49.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 123.546 0.739 . . . . 73.109999999999999 109.623 175.877 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.489 ' O ' ' HA ' ' A' ' 12' ' ' ILE . 48.8 ttt180 -109.05 106.92 17.05 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 108.569 -0.9 . . . . 71.239999999999995 108.569 171.654 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 41.9 mt -102.31 106.16 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 N-CA-C 108.383 -0.969 . . . . 72.329999999999998 108.383 -179.67 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 17.5 m -109.22 102.5 11.44 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 107.963 -1.125 . . . . 63.229999999999997 107.963 -177.578 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 71.2 mt -99.67 113.83 36.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 123.496 0.718 . . . . 74.420000000000002 109.884 -174.261 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.506 ' HB2' ' HB2' ' A' ' 9' ' ' GLN . 58.5 mtm180 -98.96 122.72 42.59 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 107.705 -1.22 . . . . 73.430000000000007 107.705 -179.042 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.2 p -93.59 129.01 44.6 Favored 'Isoleucine or valine' 0 C--O 1.242 0.673 0 N-CA-C 108.932 -0.766 . . . . 61.450000000000003 108.932 -177.377 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.3 tmtt? -97.1 121.97 39.58 Favored 'General case' 0 C--O 1.239 0.532 0 N-CA-C 107.524 -1.287 . . . . 54.299999999999997 107.524 176.866 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 5.9 p80 -113.12 131.51 55.81 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.765 1.226 . . . . 74.409999999999997 109.369 -179.578 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 16.9 m -89.32 -59.22 2.27 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.611 0.765 . . . . 54.100000000000001 111.227 -173.365 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -87.53 131.81 34.25 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 116.276 -0.42 . . . . 74.409999999999997 110.244 -175.862 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -75.3 -24.27 57.45 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 123.653 0.781 . . . . 34.32 112.815 -173.223 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -81.33 -40.19 23.96 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 122.918 0.487 . . . . 61.0 110.417 178.356 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 -68.81 -49.19 60.55 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.017 0.527 . . . . 72.519999999999996 111.983 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -49.84 -30.02 9.09 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 124.911 1.382 . . . . 72.0 114.692 -166.07 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.9 ttpm? -64.96 -48.26 74.67 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.018 0.927 . . . . 44.420000000000002 110.725 -176.322 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 4.6 ttmp? -79.39 -40.98 28.78 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.123 0.569 . . . . 64.120000000000005 110.26 173.619 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -63.15 -37.97 89.32 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.321 1.049 . . . . 65.120000000000005 111.524 -166.848 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.71 -36.78 62.72 Favored 'General case' 0 C--N 1.356 0.871 0 C-N-CA 123.494 0.718 . . . . 55.25 111.623 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -66.41 -36.83 83.81 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 122.997 0.519 . . . . 63.340000000000003 111.179 174.974 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.454 ' O ' HG12 ' A' ' 80' ' ' ILE . 79.3 tttt -76.19 -31.71 58.61 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.719 -0.673 . . . . 63.25 109.456 177.897 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -75.96 -21.97 56.43 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.811 0.845 . . . . 71.049999999999997 109.605 176.988 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.37 -40.3 93.37 Favored 'General case' 0 C--N 1.35 0.615 0 C-N-CA 123.574 0.75 . . . . 71.349999999999994 109.757 172.137 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.94 -43.25 93.32 Favored 'General case' 0 C--N 1.351 0.632 0 O-C-N 123.969 0.793 . . . . 52.200000000000003 110.38 174.138 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.508 HG23 ' HG2' ' A' ' 34' ' ' LYS . 29.3 mm -62.4 -46.27 96.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 124.306 1.042 . . . . 73.120000000000005 111.267 -179.396 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.506 HD13 HG11 ' A' ' 102' ' ' VAL . 39.2 mt -63.05 -46.9 85.31 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.839 0.856 . . . . 55.229999999999997 110.013 178.606 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -62.47 -36.94 84.05 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 123.999 0.812 . . . . 73.319999999999993 109.819 -175.022 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.426 ' O ' ' HG2' ' A' ' 87' ' ' GLU . 30.2 mmmt -65.54 -41.63 92.83 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 122.902 0.481 . . . . 73.209999999999994 111.115 175.916 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.458 HG21 ' HB2' ' A' ' 37' ' ' LEU . 53.6 t -65.69 -43.16 93.78 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 123.428 0.691 . . . . 71.030000000000001 110.919 -178.453 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.461 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 26.4 m-85 -60.31 -41.62 93.83 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 115.308 -0.86 . . . . 72.310000000000002 109.808 175.617 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.75 -31.75 73.11 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.588 0.755 . . . . 40.530000000000001 111.711 177.275 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 83' ' ' LYS . 23.5 mm-40 -76.2 -19.6 58.26 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.65 0.78 . . . . 73.049999999999997 111.336 178.819 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 78.5 mt -109.32 14.32 23.78 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.551 0.74 . . . . 64.299999999999997 110.999 -177.838 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 81.17 28.5 44.71 Favored Glycine 0 C--N 1.35 1.356 0 N-CA-C 114.488 0.555 . . . . 63.030000000000001 114.488 171.831 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.639 ' HB3' HD21 ' A' ' 94' ' ' ASN . 13.7 m-85 -111.04 146.7 36.26 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 107.856 -1.164 . . . . 64.450000000000003 107.856 171.744 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ASN . . . . . 0.413 ' O ' HG23 ' A' ' 95' ' ' VAL . 89.6 m-20 -101.18 172.11 7.21 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.064 0.546 . . . . 62.119999999999997 111.402 -178.115 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -65.64 -36.93 85.1 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.372 1.069 . . . . 70.530000000000001 111.594 -173.879 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 18.3 m -62.51 -36.01 81.2 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 124.029 0.931 . . . . 61.520000000000003 112.776 -175.527 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ASN . . . . . 0.639 HD21 ' HB3' ' A' ' 90' ' ' TYR . 2.1 p-10 -86.08 -0.53 55.84 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 111.936 0.347 . . . . 64.109999999999999 111.936 178.124 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.553 ' HA ' HG22 ' A' ' 104' ' ' VAL . 57.9 t -101.07 106.59 19.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 N-CA-C 107.908 -1.145 . . . . 72.299999999999997 107.908 174.789 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 26.2 m -136.74 133.41 36.01 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.195 0.598 . . . . 74.230000000000004 109.622 -175.18 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 40.5 m95 -87.77 152.91 21.76 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-O 121.703 0.763 . . . . 74.219999999999999 111.826 -179.658 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -149.89 79.2 1.37 Allowed 'General case' 0 C--O 1.242 0.688 0 C-N-CA 126.254 1.821 . . . . 74.109999999999999 106.57 -175.992 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 72.99 -117.38 5.96 Favored Glycine 0 CA--C 1.531 1.091 0 CA-C-N 115.149 -0.932 . . . . 73.230000000000004 112.173 -173.728 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -97.43 11.16 37.68 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.764 0.825 . . . . 73.019999999999996 110.912 175.829 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 61.6 m -119.58 125.87 49.83 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.663 0.785 . . . . 50.240000000000002 109.976 -178.669 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' VAL . . . . . 0.506 HG11 HD13 ' A' ' 81' ' ' LEU . 8.9 p -96.02 116.78 38.72 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.763 0 N-CA-C 107.866 -1.161 . . . . 65.109999999999999 107.866 170.879 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 4.3 m -99.64 108.14 20.44 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 108.337 -0.986 . . . . 62.539999999999999 108.337 -177.978 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.583 HG13 HD22 ' A' ' 94' ' ' ASN . 83.6 t -115.12 112.28 39.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 C-N-CA 124.819 1.248 . . . . 50.25 108.549 -177.609 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 105' ' ' GLU . . . . . 0.426 ' HG2' ' HA ' ' A' ' 57' ' ' ARG . 28.1 mt-10 -111.22 152.23 27.35 Favored 'General case' 0 C--O 1.241 0.631 0 N-CA-C 109.484 -0.562 . . . . 70.040000000000006 109.484 177.561 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -170.39 145.87 9.41 Favored Glycine 0 N--CA 1.449 -0.436 0 CA-C-N 115.748 -0.66 . . . . 74.510000000000005 112.189 177.799 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 57.8 tt0 . . . . . 0 CA--C 1.536 0.423 0 N-CA-C 109.025 -0.731 . . . . 75.439999999999998 109.025 168.238 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.485 1.276 0 CA-C-O 120.775 0.321 . . . . 62.200000000000003 110.202 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.7 t -78.42 163.01 25.99 Favored 'General case' 0 C--O 1.245 0.827 0 CA-C-N 115.339 -0.846 . . . . 34.329999999999998 109.798 175.342 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.482 ' HA2' ' HA ' ' A' ' 28' ' ' VAL . . . -68.5 89.29 0.22 Allowed Glycine 0 C--N 1.343 0.97 0 N-CA-C 110.487 -1.045 . . . . 72.219999999999999 110.487 171.503 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.5 tppt? -81.59 100.71 9.55 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.013 0.525 . . . . 72.239999999999995 110.973 -171.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -84.83 93.5 8.51 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 106.792 -1.559 . . . . 74.129999999999995 106.792 169.383 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.445 HG21 HG22 ' A' ' 62' ' ' VAL . 5.9 p -106.36 152.82 7.87 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 C-N-CA 123.982 0.913 . . . . 74.0 110.395 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.429 ' OE2' ' HG3' ' A' ' 24' ' ' GLN . 11.1 mp0 -100.32 114.32 27.73 Favored 'General case' 0 C--N 1.351 0.631 0 N-CA-C 107.935 -1.135 . . . . 72.129999999999995 107.935 173.546 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.438 HG22 HG23 ' A' ' 62' ' ' VAL . 78.1 t -112.63 113.62 44.66 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 C-N-CA 124.617 1.167 . . . . 70.230000000000004 108.314 -177.424 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -101.0 108.45 20.17 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 108.906 -0.776 . . . . 73.409999999999997 108.906 -175.28 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 91.8 t -93.53 108.25 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 N-CA-C 108.062 -1.088 . . . . 70.299999999999997 108.062 179.374 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -112.72 103.47 11.5 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.269 1.028 . . . . 74.019999999999996 108.422 -174.389 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 11.7 tt -120.61 125.92 74.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 CA-C-O 121.337 0.589 . . . . 51.100000000000001 111.156 -171.272 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 19.9 m -98.34 121.38 40.2 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.974 0.909 . . . . 62.439999999999998 109.193 -177.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 5.4 t -148.06 131.78 16.94 Favored 'General case' 0 C--O 1.242 0.696 0 N-CA-C 109.579 -0.526 . . . . 72.340000000000003 109.579 179.102 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.648 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 2.8 t-20 78.49 -65.31 0.24 Allowed 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 125.93 1.692 . . . . 73.439999999999998 110.56 172.548 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -170.44 6.82 0.04 OUTLIER Glycine 0 N--CA 1.465 0.586 0 CA-C-N 116.474 -0.33 . . . . 35.149999999999999 112.624 172.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -119.72 154.55 33.96 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.126 0.971 . . . . 74.099999999999994 109.782 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 7.3 m -115.58 122.16 44.81 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 108.073 -1.084 . . . . 75.430000000000007 108.073 175.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -106.77 99.9 9.44 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 108.283 -1.006 . . . . 72.299999999999997 108.283 -174.073 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -114.77 146.1 41.36 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 121.063 0.459 . . . . 73.310000000000002 110.014 175.627 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -155.55 132.41 10.61 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 107.812 -1.181 . . . . 71.400000000000006 107.812 -176.859 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 51.7 m -87.47 111.25 20.96 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 109.536 -0.542 . . . . 74.349999999999994 109.536 177.795 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -98.71 140.66 32.58 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.48 0.712 . . . . 72.310000000000002 109.621 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.429 ' HG3' ' OE2' ' A' ' 7' ' ' GLU . 21.5 mp0 -97.21 105.91 18.14 Favored 'General case' 0 C--O 1.24 0.578 0 N-CA-C 107.151 -1.426 . . . . 73.120000000000005 107.151 174.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 45.7 mt -107.09 115.28 29.91 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 109.051 -0.722 . . . . 70.120000000000005 109.051 -179.033 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -107.12 123.63 48.52 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 109.21 -0.663 . . . . 75.209999999999994 109.21 177.246 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -145.9 122.05 10.81 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 122.738 0.415 . . . . 73.340000000000003 110.02 175.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.482 ' HA ' ' HA2' ' A' ' 3' ' ' GLY . 60.3 t -73.29 -30.86 31.96 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 C-N-CA 123.815 0.846 . . . . 54.450000000000003 109.774 171.491 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.422 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 58.4 mtt-85 -112.78 150.37 31.72 Favored 'General case' 0 CA--C 1.552 1.033 0 CA-C-N 114.96 -1.018 . . . . 72.200000000000003 110.043 -174.589 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -67.23 -44.85 78.44 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 123.939 0.896 . . . . 72.5 110.937 -178.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.403 ' HA ' ' HD3' ' A' ' 34' ' ' LYS . 56.2 mm-40 -61.77 -30.9 71.1 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.801 0.84 . . . . 74.519999999999996 111.633 179.247 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.422 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 35.0 mm-40 -61.7 -46.14 90.97 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 122.705 0.402 . . . . 61.140000000000001 111.293 177.142 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.7 -33.88 75.77 Favored 'General case' 0 CA--C 1.553 1.063 0 N-CA-C 109.871 -0.418 . . . . 62.039999999999999 109.871 -177.842 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.403 ' HD3' ' HA ' ' A' ' 31' ' ' GLU . 54.7 mtpt -54.31 -58.2 8.3 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.131 0.572 . . . . 74.219999999999999 111.395 176.159 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.8 pp20? -66.91 -26.89 67.08 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 115.92 -0.582 . . . . 71.430000000000007 112.354 -177.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 40.2 mttp -71.59 -35.17 70.43 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.129 0.571 . . . . 54.119999999999997 111.048 176.133 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.604 HD13 HD23 ' A' ' 81' ' ' LEU . 81.5 mt -64.23 -45.31 88.77 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 123.334 0.397 . . . . 73.239999999999995 110.058 171.915 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.434 ' HG2' HG13 ' A' ' 84' ' ' VAL . 50.1 mtpt -58.88 -38.11 78.1 Favored 'General case' 0 C--N 1.357 0.917 0 C-N-CA 122.782 0.433 . . . . 74.129999999999995 111.086 174.815 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 43.3 mmtm -60.32 -62.83 1.58 Allowed 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 122.865 0.466 . . . . 62.409999999999997 110.515 175.542 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 93.9 t -59.7 -45.94 93.92 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 123.583 0.753 . . . . 62.340000000000003 111.695 -172.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.619 HD21 HD11 ' A' ' 60' ' ' ILE . 68.9 mt -64.95 -58.33 6.4 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.382 0.673 . . . . 74.450000000000003 111.271 -179.252 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -60.32 -38.4 83.59 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 123.357 0.663 . . . . 71.329999999999998 112.054 -176.366 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -67.67 -48.24 67.2 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 122.577 0.351 . . . . 74.439999999999998 111.027 178.207 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -73.55 -32.96 64.47 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 116.342 -0.39 . . . . 72.319999999999993 111.287 -172.724 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.406 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 43.3 mtp -83.62 -11.53 57.18 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 122.972 0.509 . . . . 74.409999999999997 112.059 -177.846 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -61.02 -53.34 64.76 Favored Pre-proline 0 CA--C 1.564 1.484 0 CA-C-O 118.577 -0.725 . . . . 71.510000000000005 111.684 178.116 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.526 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 56.8 Cg_endo -68.47 -25.23 35.53 Favored 'Trans proline' 0 C--N 1.387 2.581 0 CA-C-N 121.169 1.453 . . . . 72.420000000000002 112.435 173.258 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 32.1 mm -63.52 -43.66 98.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 123.434 0.694 . . . . 54.020000000000003 111.398 -178.578 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.72 ' HA ' HD11 ' A' ' 108' ' ' LEU . 48.4 mtmt -67.12 -32.51 73.69 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 121.035 0.445 . . . . 61.310000000000002 110.098 178.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -71.57 -29.04 64.27 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.616 1.166 . . . . 71.409999999999997 111.101 176.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.526 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 86.9 mt -70.5 -33.86 71.69 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 109.312 -0.625 . . . . 71.430000000000007 109.312 175.774 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 89.58 119.99 1.91 Allowed Glycine 0 C--N 1.344 0.987 0 CA-C-N 115.448 -0.796 . . . . 64.430000000000007 113.315 168.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.648 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 72.3 m -153.24 156.11 37.88 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.322 1.049 . . . . 73.120000000000005 108.755 -179.33 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.49 ' H ' ' HD2' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -74.8 -37.2 62.42 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 109.152 -0.685 . . . . 73.140000000000001 109.152 171.377 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.558 ' HA ' ' H ' ' A' ' 108' ' ' LEU . 29.0 ttm180 -157.81 148.47 20.9 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 123.951 0.901 . . . . 73.329999999999998 109.102 -175.02 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 15.7 m -114.68 140.47 35.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 123.527 0.731 . . . . 64.120000000000005 109.97 177.277 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 45.5 ttm105 -104.96 103.36 12.91 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 108.25 -1.018 . . . . 61.530000000000001 108.25 173.534 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 40.5 mt -94.76 146.11 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 N-CA-C 107.886 -1.153 . . . . 74.340000000000003 107.886 178.306 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 28.8 m -144.15 103.37 3.99 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 106.836 -1.542 . . . . 63.399999999999999 106.836 177.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.619 HD11 HD21 ' A' ' 41' ' ' LEU . 72.7 mt -101.92 107.44 21.64 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 N-CA-C 108.827 -0.805 . . . . 70.439999999999998 108.827 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 38.1 ttp85 -97.53 121.16 39.11 Favored 'General case' 0 C--O 1.238 0.468 0 N-CA-C 108.036 -1.098 . . . . 74.019999999999996 108.036 176.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.445 HG22 HG21 ' A' ' 6' ' ' VAL . 4.1 p -94.85 140.29 17.04 Favored 'Isoleucine or valine' 0 C--O 1.243 0.744 0 N-CA-C 107.49 -1.3 . . . . 74.310000000000002 107.49 178.178 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 19.6 ttpp -81.52 136.39 35.61 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 109.262 -0.644 . . . . 73.340000000000003 109.262 178.603 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 86.2 m-70 -85.89 117.3 24.66 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 108.663 -0.865 . . . . 71.25 108.663 178.444 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 30.7 p -65.79 -62.13 1.68 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.742 0.817 . . . . 62.310000000000002 111.79 -173.813 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -148.29 140.39 24.07 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 107.969 -1.123 . . . . 73.319999999999993 107.969 -177.199 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -53.67 -34.53 58.99 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.939 0.895 . . . . 72.129999999999995 113.379 -172.046 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.6 -42.16 74.79 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 122.783 0.433 . . . . 62.520000000000003 111.272 178.292 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -74.97 -47.63 28.41 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.372 0.669 . . . . 45.299999999999997 111.494 -176.591 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.3 pp20? -68.16 -20.61 64.9 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 114.458 1.281 . . . . 63.009999999999998 114.458 -159.056 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 64.6 mttm -65.48 -42.46 92.2 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-O 121.407 0.623 . . . . 74.219999999999999 109.848 173.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -79.71 -40.79 28.15 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 114.858 -1.064 . . . . 63.420000000000002 110.566 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -74.03 -33.4 63.74 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 112.429 0.529 . . . . 75.049999999999997 112.429 -172.225 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.91 -35.93 64.67 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 117.795 0.271 . . . . 64.219999999999999 110.694 177.447 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 65.1 tttp -65.65 -39.85 91.86 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.101 0.56 . . . . 75.219999999999999 110.243 175.005 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 5.6 tmmm? -67.15 -40.06 86.61 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.974 0.909 . . . . 63.509999999999998 109.825 175.037 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -72.76 -23.72 60.86 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.788 0.835 . . . . 73.329999999999998 110.702 -175.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.56 -46.15 89.69 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 123.576 0.547 . . . . 71.530000000000001 109.913 173.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.439 ' O ' ' HG2' ' A' ' 83' ' ' LYS . . . -65.98 -40.73 91.48 Favored 'General case' 0 CA--C 1.545 0.75 0 CA-C-N 115.531 -0.759 . . . . 43.119999999999997 111.223 177.389 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 37.5 mm -56.09 -47.43 80.47 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 C-N-CA 124.287 1.035 . . . . 74.030000000000001 110.773 176.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.604 HD23 HD13 ' A' ' 37' ' ' LEU . 45.8 mt -67.09 -40.02 86.89 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.865 0.866 . . . . 72.239999999999995 111.762 -179.685 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 -60.13 -33.15 71.74 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.259 0.624 . . . . 64.400000000000006 111.433 -178.321 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.439 ' HG2' ' O ' ' A' ' 79' ' ' ALA . 32.9 mmtp -67.2 -49.54 64.18 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 123.697 0.623 . . . . 74.329999999999998 110.706 173.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.434 HG13 ' HG2' ' A' ' 38' ' ' LYS . 71.1 t -65.13 -49.26 80.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 123.988 0.915 . . . . 61.310000000000002 111.456 -171.273 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.496 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 26.4 m-85 -63.24 -33.71 76.08 Favored 'General case' 0 N--CA 1.477 0.902 0 O-C-N 123.582 0.552 . . . . 65.340000000000003 111.326 179.062 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -68.06 -30.06 69.18 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.104 0.562 . . . . 73.200000000000003 111.389 175.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -85.47 -13.51 48.94 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.905 0.882 . . . . 75.409999999999997 111.89 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 94.3 mt -107.49 -16.04 14.46 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 122.984 0.513 . . . . 64.299999999999997 111.385 -175.778 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 97.57 49.23 1.85 Allowed Glycine 0 C--N 1.345 1.079 0 CA-C-O 120.857 0.143 . . . . 63.299999999999997 113.373 176.796 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.496 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 40.6 m-85 -126.31 134.66 51.06 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 107.889 -1.152 . . . . 75.239999999999995 107.889 174.441 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -78.1 159.27 28.77 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.297 0.639 . . . . 73.540000000000006 111.528 -174.284 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -62.38 -46.06 90.32 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.859 0.864 . . . . 72.150000000000006 112.173 -175.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 63.9 p -58.53 -34.82 71.42 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 124.05 0.94 . . . . 74.230000000000004 112.16 177.051 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ASN . . . . . 0.409 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 2.5 m-20 -65.19 -25.66 67.81 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 115.412 -0.813 . . . . 53.439999999999998 110.932 -179.098 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 45.4 t -91.74 114.71 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.87 0 C-N-CA 124.333 1.053 . . . . 63.240000000000002 108.897 178.069 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 32.9 m -144.41 129.62 18.71 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 122.879 0.472 . . . . 74.510000000000005 110.389 178.453 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 66.3 m95 -86.05 137.97 32.3 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.403 0.681 . . . . 72.519999999999996 110.509 177.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -169.17 123.52 0.83 Allowed 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.481 1.112 . . . . 72.0 109.245 179.497 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 69.76 51.97 22.34 Favored Glycine 0 C--N 1.349 1.26 0 O-C-N 123.883 0.739 . . . . 55.539999999999999 113.193 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 46.67 26.09 0.5 Allowed 'General case' 0 N--CA 1.499 2.018 0 C-N-CA 126.444 1.898 . . . . 71.510000000000005 113.537 -176.359 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 50.0 m -135.54 148.01 48.99 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 125.313 1.445 . . . . 72.230000000000004 107.931 -177.235 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.601 HG11 HD13 ' A' ' 81' ' ' LEU . 13.4 p -103.35 121.58 54.83 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 N-CA-C 108.709 -0.849 . . . . 64.409999999999997 108.709 171.792 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 24.7 m -97.79 111.31 23.65 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 107.532 -1.284 . . . . 33.049999999999997 107.532 178.68 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.409 ' HA ' ' O ' ' A' ' 94' ' ' ASN . 55.1 t -119.35 125.0 74.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 N-CA-C 108.533 -0.914 . . . . 72.310000000000002 108.533 -178.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -107.95 153.83 22.49 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 109.578 -0.527 . . . . 73.140000000000001 109.578 174.485 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -148.51 136.98 6.15 Favored Glycine 0 C--O 1.238 0.368 0 N-CA-C 110.643 -0.983 . . . . 73.540000000000006 110.643 173.515 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 58.9 tp60 -68.35 102.34 1.38 Allowed 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 108.081 -1.081 . . . . 72.310000000000002 108.081 179.046 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.72 HD11 ' HA ' ' A' ' 49' ' ' LYS . 2.5 tm? -67.3 148.09 52.14 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.93 0.892 . . . . 62.530000000000001 109.759 -172.136 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.497 ' N ' HD13 ' A' ' 108' ' ' LEU . 31.8 tt0 74.6 -73.21 0.1 Allowed 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 124.762 1.225 . . . . 65.400000000000006 109.72 -176.139 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -82.67 67.4 3.73 Favored Glycine 0 C--N 1.346 1.136 0 N-CA-C 111.412 -0.675 . . . . 63.32 111.412 173.143 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 15.4 m -75.8 74.37 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.03 0 CA-C-O 121.911 0.863 . . . . 54.119999999999997 111.826 -173.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -171.82 144.6 1.8 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.783 1.233 . . . . 71.340000000000003 108.684 176.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 97.7 mt -126.33 -31.57 2.78 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.529 0.731 . . . . 74.310000000000002 109.944 173.633 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.404 ' HB3' ' CD2' ' A' ' 116' ' ' HIS . 47.7 mt-10 -86.1 85.66 7.36 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.655 0.782 . . . . 71.439999999999998 111.674 -174.625 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 21.2 p80 -99.43 69.33 1.66 Allowed 'General case' 0 CA--C 1.549 0.904 0 CA-C-O 121.723 0.773 . . . . 75.310000000000002 109.726 173.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.404 ' CD2' ' HB3' ' A' ' 114' ' ' GLU . 99.0 m-70 -75.04 129.75 38.13 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-N 115.531 -0.759 . . . . 70.219999999999999 112.087 -173.647 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 42.6 m-70 -119.65 92.04 3.69 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.141 0.977 . . . . 72.209999999999994 108.534 169.189 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 18.5 p80 -107.57 122.06 45.92 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.602 0.761 . . . . 70.540000000000006 109.873 -176.406 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 32.5 p-80 -78.22 119.68 21.94 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 109.512 -0.551 . . . . 75.319999999999993 109.512 177.304 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 49.9 t-80 . . . . . 0 CA--C 1.565 1.536 0 C-N-CA 124.357 1.063 . . . . 73.120000000000005 109.491 -174.191 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.8 mtm . . . . . 0 N--CA 1.485 1.323 0 N-CA-C 108.903 -0.777 . . . . 73.510000000000005 108.903 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.3 t -92.75 -170.17 2.38 Favored 'General case' 0 CA--C 1.554 1.12 0 N-CA-C 108.504 -0.925 . . . . 64.540000000000006 108.504 171.521 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -56.55 114.01 4.77 Favored Glycine 0 C--N 1.356 1.655 0 C-N-CA 122.716 0.198 . . . . 54.409999999999997 112.805 -179.331 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.33 134.53 38.01 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.503 0.721 . . . . 71.319999999999993 110.225 -171.143 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 33.6 ttpt -100.57 117.02 33.86 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.51 0.724 . . . . 72.409999999999997 110.593 -178.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.419 HG21 HG13 ' A' ' 62' ' ' VAL . 3.7 p -101.06 138.83 23.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 107.673 -1.232 . . . . 72.310000000000002 107.673 164.634 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -104.32 111.66 24.38 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 108.07 -1.085 . . . . 72.049999999999997 108.07 174.727 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.624 HG13 HG23 ' A' ' 60' ' ' ILE . 56.7 t -98.98 107.36 20.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 CA-C-N 113.593 -1.639 . . . . 73.409999999999997 108.841 -174.226 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.418 ' HB2' ' HB3' ' A' ' 61' ' ' ARG . 42.1 mt-30 -97.16 101.57 13.16 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 108.16 -1.052 . . . . 75.040000000000006 108.16 -176.537 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 67.0 t -93.23 111.95 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 108.848 -0.797 . . . . 72.209999999999994 108.848 -176.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -119.46 103.5 9.51 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.416 1.086 . . . . 61.509999999999998 108.259 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.48 HD13 HG13 ' A' ' 48' ' ' ILE . 12.3 tt -118.53 122.02 68.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 CA-C-O 121.036 0.446 . . . . 62.310000000000002 111.436 -173.648 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 31.9 m -97.39 112.08 24.06 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 108.361 -0.978 . . . . 75.120000000000005 108.361 178.827 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.666 ' SG ' HG23 ' A' ' 48' ' ' ILE . 14.6 t -122.24 115.92 23.22 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.464 1.106 . . . . 54.200000000000003 108.253 179.694 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 40.4 t-20 71.57 -73.1 0.1 Allowed 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 125.222 1.409 . . . . 60.140000000000001 110.29 178.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -161.48 10.18 0.12 Allowed Glycine 0 N--CA 1.469 0.894 0 N-CA-C 111.465 -0.654 . . . . 62.43 111.465 175.107 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.424 ' HA ' ' HE3' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -110.98 123.89 51.06 Favored 'General case' 0 C--N 1.349 0.559 0 C-N-CA 124.197 0.999 . . . . 75.010000000000005 109.264 177.207 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 91.5 m -106.81 123.89 48.81 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.688 0.795 . . . . 73.299999999999997 109.62 -179.398 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -109.64 101.84 10.72 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.487 1.115 . . . . 71.439999999999998 108.316 -176.309 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -114.58 142.42 46.46 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.05 0.54 . . . . 74.450000000000003 110.043 -177.898 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 52.6 ttm-85 -168.05 140.74 3.1 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 122.863 0.465 . . . . 65.140000000000001 111.393 175.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 24.7 m -86.68 109.24 19.06 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.661 1.185 . . . . 43.310000000000002 109.549 174.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -97.36 135.44 39.25 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.618 0.767 . . . . 75.439999999999998 109.41 177.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -94.48 109.46 21.34 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 107.85 -1.167 . . . . 51.420000000000002 107.85 177.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.417 HD22 ' HB3' ' A' ' 36' ' ' LYS . 58.0 mt -113.7 116.48 29.5 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.561 0.744 . . . . 70.310000000000002 109.344 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -114.79 120.53 40.33 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.438 1.095 . . . . 73.409999999999997 108.969 -176.374 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.498 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -150.98 150.88 31.31 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 122.946 0.499 . . . . 74.409999999999997 110.425 176.776 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.2 t -78.81 -42.94 25.08 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.773 0 CA-C-N 114.957 -1.019 . . . . 70.030000000000001 109.459 174.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.52 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 59.5 mtt-85 -116.83 164.33 14.83 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.846 0.858 . . . . 61.25 111.451 -169.837 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -62.39 -48.65 78.78 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 124.467 1.107 . . . . 61.539999999999999 111.662 178.686 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.425 ' HA ' ' HD3' ' A' ' 34' ' ' LYS . 49.4 mm-40 -64.29 -28.75 69.93 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 115.586 -0.733 . . . . 72.010000000000005 111.453 -176.543 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.52 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 29.1 mm-40 -74.52 -26.2 59.83 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.026 0.53 . . . . 52.409999999999997 111.123 177.719 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.434 HD23 ' HB3' ' A' ' 27' ' ' ALA . 0.2 OUTLIER -81.69 -37.87 26.72 Favored 'General case' 0 CA--C 1.555 1.147 0 N-CA-C 109.788 -0.449 . . . . 71.109999999999999 109.788 178.885 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.462 ' HG2' HG23 ' A' ' 80' ' ' ILE . 56.8 mtpt -56.12 -52.13 65.45 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 124.094 0.958 . . . . 73.239999999999995 112.452 -176.57 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -54.67 -37.87 66.27 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.667 0.787 . . . . 73.400000000000006 111.868 177.008 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.417 ' HB3' HD22 ' A' ' 25' ' ' LEU . 54.2 mttm -70.63 -38.0 73.85 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.232 0.613 . . . . 73.510000000000005 110.811 -178.667 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 57.6 mt -62.35 -40.86 97.79 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.571 0.748 . . . . 75.310000000000002 110.984 175.24 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.501 ' HG2' HG13 ' A' ' 84' ' ' VAL . 57.2 mtpt -63.71 -41.11 98.13 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.544 0.738 . . . . 55.439999999999998 111.326 175.236 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.6 mmmp? -61.61 -53.09 60.85 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.332 0.653 . . . . 73.510000000000005 110.638 176.499 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 46.4 t -60.05 -38.95 78.88 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 124.826 1.25 . . . . 73.430000000000007 111.988 -179.683 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.448 HD21 HD11 ' A' ' 60' ' ' ILE . 23.3 mt -71.28 -50.11 35.97 Favored 'General case' 0 C--O 1.212 -0.877 0 CA-C-O 118.948 -0.549 . . . . 72.019999999999996 110.943 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 56.5 m-80 -66.4 -21.8 66.23 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-N 118.513 0.597 . . . . 72.129999999999995 111.594 177.526 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -74.87 -55.65 5.58 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.048 0.539 . . . . 72.239999999999995 110.252 176.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.419 ' HA ' ' CZ ' ' A' ' 44' ' ' ARG . 0.3 OUTLIER -72.94 -26.28 61.33 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.437 0.695 . . . . 74.349999999999994 111.312 -176.666 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 57.0 mtp -96.43 2.58 52.72 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.191 0.596 . . . . 63.399999999999999 112.326 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -59.37 -55.8 42.44 Favored Pre-proline 0 CA--C 1.566 1.579 0 CA-C-O 118.697 -0.668 . . . . 73.430000000000007 110.973 170.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.408 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 56.3 Cg_endo -66.79 -20.93 51.75 Favored 'Trans proline' 0 C--N 1.39 2.718 0 C-N-CA 121.788 1.659 . . . . 75.430000000000007 112.429 176.731 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.666 HG23 ' SG ' ' A' ' 14' ' ' CYS . 48.2 mm -74.46 -40.19 48.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 124.434 1.094 . . . . 73.239999999999995 111.513 -174.446 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -68.44 -32.53 72.61 Favored 'General case' 0 N--CA 1.48 1.028 0 N-CA-C 109.424 -0.584 . . . . 74.400000000000006 109.424 176.27 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -69.45 -28.09 65.82 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 124.357 1.063 . . . . 73.140000000000001 110.959 175.343 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 83.9 mt -72.31 -39.37 68.3 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 109.004 -0.739 . . . . 74.329999999999998 109.004 172.736 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 62.42 62.27 5.76 Favored Glycine 0 C--N 1.352 1.433 0 CA-C-N 115.269 -0.878 . . . . 71.010000000000005 111.833 179.458 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 63.6 m -84.96 152.44 23.49 Favored 'General case' 0 C--O 1.242 0.686 0 C-N-CA 123.069 0.547 . . . . 64.140000000000001 112.145 -174.779 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -67.53 -39.5 85.04 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 115.073 -0.967 . . . . 63.439999999999998 110.018 178.526 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 11.4 ttm180 -142.53 140.77 31.91 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.387 1.075 . . . . 74.540000000000006 109.582 176.109 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 27.0 m -123.76 136.89 58.73 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 C-N-CA 124.471 1.109 . . . . 64.049999999999997 109.0 171.631 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.468 ' O ' ' HA ' ' A' ' 12' ' ' ILE . 47.1 mtt180 -112.09 106.63 15.31 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 108.749 -0.834 . . . . 60.32 108.749 172.944 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.473 HG12 HD12 ' A' ' 12' ' ' ILE . 17.8 mt -94.86 106.96 18.8 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 N-CA-C 108.014 -1.106 . . . . 65.299999999999997 108.014 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.9 m -99.64 102.45 13.94 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 107.045 -1.465 . . . . 75.319999999999993 107.045 179.219 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.624 HG23 HG13 ' A' ' 8' ' ' VAL . 72.2 mt -96.59 107.99 20.65 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 N-CA-C 108.314 -0.995 . . . . 73.340000000000003 108.314 179.22 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.418 ' HB3' ' HB2' ' A' ' 9' ' ' GLN . 0.2 OUTLIER -93.17 106.71 18.64 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 107.204 -1.406 . . . . 73.540000000000006 107.204 -178.713 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.419 HG13 HG21 ' A' ' 6' ' ' VAL . 22.6 t -92.57 114.27 29.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 N-CA-C 107.966 -1.124 . . . . 74.519999999999996 107.966 177.557 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -84.92 105.7 15.88 Favored 'General case' 0 C--O 1.239 0.507 0 N-CA-C 108.118 -1.068 . . . . 72.299999999999997 108.118 177.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 25.6 p80 -64.64 139.36 58.76 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 109.336 -0.616 . . . . 75.219999999999999 109.336 177.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 30.4 t -80.46 -36.79 33.01 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.208 0.603 . . . . 74.010000000000005 111.389 -174.078 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.525 ' HB2' ' HB2' ' A' ' 69' ' ' GLU . 7.2 m-20 -125.07 137.94 54.2 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.606 0.763 . . . . 74.239999999999995 110.232 -174.555 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -79.68 -15.52 57.41 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.715 0.806 . . . . 41.329999999999998 112.502 -174.208 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -86.22 -44.54 12.08 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.168 0.587 . . . . 63.439999999999998 109.538 171.57 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.525 ' HB2' ' HB2' ' A' ' 66' ' ' ASP . 11.2 mm-40 -76.81 -14.3 59.93 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 114.711 -1.131 . . . . 72.439999999999998 112.821 -175.743 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.601 ' HG3' ' HD2' ' A' ' 71' ' ' LYS . 9.4 pt-20 -50.55 -31.42 15.61 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 114.554 1.316 . . . . 62.049999999999997 114.554 -176.44 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.601 ' HD2' ' HG3' ' A' ' 70' ' ' GLU . 3.7 mptp? -67.15 -42.09 84.93 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 109.418 -0.586 . . . . 64.409999999999997 109.418 176.187 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -71.3 -36.35 71.61 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.421 1.088 . . . . 74.140000000000001 110.664 177.707 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -77.7 -42.81 33.18 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.88 0.872 . . . . 72.219999999999999 112.159 -172.121 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.82 -41.81 67.76 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-O 120.806 0.336 . . . . 70.25 110.272 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -63.59 -33.46 75.66 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.134 0.974 . . . . 75.310000000000002 111.465 172.151 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 20.8 ttmm -60.97 -53.25 59.53 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.675 0.79 . . . . 73.420000000000002 109.703 173.548 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.562 ' HA ' ' HB ' ' A' ' 80' ' ' ILE . 19.1 m-85 -69.67 -20.11 63.58 Favored 'General case' 0 C--O 1.221 -0.443 0 C-N-CA 123.57 0.748 . . . . 74.230000000000004 111.943 -178.076 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.478 ' O ' ' HB2' ' A' ' 82' ' ' ASN . . . -55.55 -55.17 35.08 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 109.765 -0.458 . . . . 72.420000000000002 109.765 171.123 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.434 ' O ' ' HG2' ' A' ' 83' ' ' LYS . . . -69.86 -45.7 67.17 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.503 0.721 . . . . 71.230000000000004 111.389 178.815 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.562 ' HB ' ' HA ' ' A' ' 77' ' ' PHE . 21.6 mm -60.81 -52.38 62.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 C-N-CA 124.624 1.17 . . . . 54.009999999999998 111.823 -175.454 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 37.5 mt -67.09 -36.25 81.58 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 118.97 -0.538 . . . . 74.329999999999998 111.202 177.237 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.478 ' HB2' ' O ' ' A' ' 78' ' ' ALA . 16.8 t-20 -60.55 -36.74 79.19 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 123.413 0.445 . . . . 73.530000000000001 109.892 178.655 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.434 ' HG2' ' O ' ' A' ' 79' ' ' ALA . 75.0 mmtt -61.74 -47.19 86.32 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.014 0.526 . . . . 74.540000000000006 110.261 174.796 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.501 HG13 ' HG2' ' A' ' 38' ' ' LYS . 74.2 t -62.26 -45.44 98.75 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 C-N-CA 124.03 0.932 . . . . 65.140000000000001 110.601 -175.896 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.5 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 20.0 m-85 -62.52 -41.07 98.61 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.617 0.767 . . . . 75.219999999999999 110.731 177.235 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -69.87 -24.76 63.47 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.607 0.763 . . . . 73.310000000000002 111.516 178.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -84.78 -11.42 55.79 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.614 0.766 . . . . 64.420000000000002 111.566 176.213 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.531 ' O ' ' HG3' ' A' ' 109' ' ' GLU . 82.1 mt -99.71 -32.7 10.92 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 109.519 -0.548 . . . . 75.329999999999998 109.519 177.143 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 131.32 -19.43 4.84 Favored Glycine 0 C--N 1.349 1.268 0 C-N-CA 123.265 0.46 . . . . 45.329999999999998 112.938 -179.016 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.5 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 23.8 m-85 -68.48 145.93 53.61 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.452 0.701 . . . . 70.099999999999994 110.995 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -92.87 159.56 15.3 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.368 0.667 . . . . 72.150000000000006 110.142 -177.575 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -64.85 -25.24 67.82 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.875 0.87 . . . . 72.239999999999995 110.969 172.645 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 80.4 p -67.03 -11.02 55.88 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.933 0.893 . . . . 54.43 112.643 176.48 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -90.91 -19.69 23.05 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.697 0.799 . . . . 64.209999999999994 110.723 175.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.52 HG13 HG21 ' A' ' 102' ' ' VAL . 59.3 t -90.71 115.18 29.47 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.975 0 C-N-CA 124.702 1.201 . . . . 74.510000000000005 110.757 -166.862 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 63.7 m -120.89 108.61 14.12 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.603 0.761 . . . . 62.439999999999998 110.299 178.234 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 68.2 m95 -87.91 121.86 30.84 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.367 0.667 . . . . 75.430000000000007 111.672 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -117.92 81.85 1.74 Allowed 'General case' 0 C--O 1.243 0.748 0 C-N-CA 124.621 1.169 . . . . 73.540000000000006 107.895 169.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.05 -115.1 4.38 Favored Glycine 0 C--N 1.345 1.07 0 CA-C-N 114.908 -1.042 . . . . 71.510000000000005 112.535 -178.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -96.72 1.88 51.43 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.888 0.875 . . . . 64.319999999999993 111.363 -178.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 43.1 m -118.58 140.29 50.13 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 108.911 -0.774 . . . . 61.140000000000001 108.911 179.181 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.52 HG21 HG13 ' A' ' 95' ' ' VAL . 5.9 p -121.19 128.07 75.94 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 C-N-CA 123.22 0.608 . . . . 71.420000000000002 110.087 174.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 85.7 m -101.75 104.56 15.36 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 107.375 -1.343 . . . . 73.340000000000003 107.375 172.137 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.401 HG21 ' CZ ' ' A' ' 85' ' ' PHE . 59.1 t -94.01 111.84 25.82 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 N-CA-C 107.639 -1.245 . . . . 65.140000000000001 107.639 178.728 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -113.17 118.79 35.69 Favored 'General case' 0 C--O 1.241 0.658 0 N-CA-C 108.297 -1.001 . . . . 74.219999999999999 108.297 -177.447 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -167.78 -173.62 36.0 Favored Glycine 0 CA--C 1.502 -0.772 0 N-CA-C 110.884 -0.887 . . . . 61.240000000000002 110.884 -178.105 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -102.96 161.57 13.65 Favored 'General case' 0 C--O 1.241 0.634 0 N-CA-C 108.579 -0.897 . . . . 74.530000000000001 108.579 175.216 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 82.8 mt -59.0 124.71 20.82 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 123.675 0.609 . . . . 63.5 110.023 175.614 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.571 ' HG2' HD21 ' A' ' 113' ' ' LEU . 0.4 OUTLIER -58.83 -29.29 66.8 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.376 1.07 . . . . 70.349999999999994 110.657 -179.897 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 168.84 142.58 3.55 Favored Glycine 0 C--N 1.34 0.796 0 N-CA-C 110.523 -1.031 . . . . 65.430000000000007 110.523 174.265 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 80.5 t -62.0 -44.27 98.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 N-CA-C 108.159 -1.052 . . . . 72.099999999999994 108.159 167.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -133.38 146.28 51.11 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 114.353 -1.294 . . . . 63.25 108.017 170.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.571 HD21 ' HG2' ' A' ' 109' ' ' GLU . 65.5 mt -107.8 176.63 5.08 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.103 0.561 . . . . 74.519999999999996 111.432 -170.807 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 47.7 mm-40 -61.24 -38.4 86.54 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.349 0.66 . . . . 73.299999999999997 109.823 170.277 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 36.5 m80 -84.47 90.37 7.6 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 106.932 -1.507 . . . . 72.230000000000004 106.932 163.408 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 43.4 m-70 -65.96 92.84 0.17 Allowed 'General case' 0 N--CA 1.476 0.873 0 O-C-N 123.854 0.721 . . . . 71.530000000000001 109.993 -173.775 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 42.3 m80 -139.48 31.59 2.09 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.358 1.063 . . . . 75.420000000000002 109.451 -178.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 3.3 p80 -56.88 119.56 6.44 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.146 0.578 . . . . 74.510000000000005 110.669 175.012 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 22.8 t-80 -74.58 -34.73 62.94 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 109.321 -0.622 . . . . 72.310000000000002 109.321 -176.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 16.3 m80 . . . . . 0 C--O 1.248 1.013 0 N-CA-C 107.995 -1.113 . . . . 74.310000000000002 107.995 161.932 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 ptm . . . . . 0 N--CA 1.488 1.445 0 CA-C-O 121.222 0.534 . . . . 74.120000000000005 111.074 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.9 t -152.69 169.0 23.8 Favored 'General case' 0 C--O 1.248 1.018 0 N-CA-C 108.122 -1.066 . . . . 53.549999999999997 108.122 172.532 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -70.08 97.28 0.58 Allowed Glycine 0 C--N 1.337 0.628 0 N-CA-C 109.306 -1.518 . . . . 74.340000000000003 109.306 168.561 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.3 tpmt? -115.3 150.41 36.29 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.374 0.67 . . . . 72.200000000000003 110.82 -169.866 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.8 ttmt -86.54 122.43 30.46 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.654 -0.703 . . . . 71.049999999999997 109.147 167.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -103.89 136.56 36.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 107.241 -1.392 . . . . 52.32 107.241 167.539 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.421 ' HB2' ' HD3' ' A' ' 63' ' ' LYS . 53.6 mt-10 -107.83 115.04 29.41 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 108.958 -0.756 . . . . 75.25 108.958 -179.75 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 92.2 t -96.34 114.41 33.08 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.688 0 C-N-CA 124.21 1.004 . . . . 75.549999999999997 109.572 -174.482 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -94.62 98.74 11.02 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 108.312 -0.996 . . . . 52.210000000000001 108.312 -177.237 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 90.7 t -93.76 108.23 20.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 N-CA-C 108.693 -0.854 . . . . 73.439999999999998 108.693 -176.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -108.04 103.93 13.26 Favored 'General case' 0 C--O 1.216 -0.709 0 N-CA-C 109.065 -0.717 . . . . 74.140000000000001 109.065 179.393 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.514 HD12 ' SD ' ' A' ' 45' ' ' MET . 12.8 tt -107.38 130.19 59.99 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 CA-C-O 121.085 0.469 . . . . 72.230000000000004 111.025 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 11.0 m -99.66 107.66 19.83 Favored 'General case' 0 C--O 1.241 0.61 0 C-N-CA 123.916 0.886 . . . . 75.140000000000001 108.652 177.447 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 37.5 t -130.66 120.31 23.72 Favored 'General case' 0 C--O 1.246 0.899 0 C-N-CA 123.911 0.884 . . . . 75.319999999999993 109.966 -179.024 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 57.9 t30 56.75 53.36 8.39 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.492 1.117 . . . . 60.340000000000003 110.986 178.662 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 68.95 6.87 54.65 Favored Glycine 0 C--N 1.343 0.922 0 CA-C-N 114.85 -1.068 . . . . 71.099999999999994 115.055 174.579 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -117.08 139.67 50.43 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.603 0.761 . . . . 52.240000000000002 110.376 -178.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 92.0 m -102.15 118.22 36.43 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.075 0.95 . . . . 62.140000000000001 110.17 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.559 ' HB3' ' NH2' ' A' ' 44' ' ' ARG . 50.4 m-85 -114.28 101.01 8.77 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.123 0.969 . . . . 71.230000000000004 109.0 -178.518 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -116.47 136.85 52.64 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 120.911 0.386 . . . . 71.319999999999993 110.719 178.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 51.8 ttt85 -147.43 139.88 24.63 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 123.518 0.727 . . . . 74.5 109.473 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 27.6 m -98.47 108.95 21.77 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 123.91 0.884 . . . . 64.340000000000003 109.671 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -97.37 127.09 43.03 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.094 0.957 . . . . 70.319999999999993 109.339 -176.163 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 26.2 mp0 -87.04 109.33 19.33 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 108.765 -0.828 . . . . 64.109999999999999 108.765 -178.343 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 70.4 mt -113.79 130.45 56.45 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.772 0.829 . . . . 65.099999999999994 109.144 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -121.79 119.06 30.58 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 108.473 -0.936 . . . . 74.239999999999995 108.473 -177.785 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.511 ' HB3' HD23 ' A' ' 33' ' ' LEU . . . -149.45 166.07 30.21 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-O 121.576 0.703 . . . . 71.109999999999999 110.753 177.478 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 41.6 t -106.33 -57.6 4.28 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 CA-C-N 114.38 -1.282 . . . . 65.230000000000004 108.825 176.314 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.663 ' HB2' ' HG3' ' A' ' 32' ' ' GLU . 66.5 mtp180 -87.97 158.29 18.69 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.805 1.242 . . . . 74.109999999999999 109.977 -179.783 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -77.07 -37.12 55.15 Favored 'General case' 0 N--CA 1.493 1.682 0 C-N-CA 124.485 1.114 . . . . 72.530000000000001 110.654 -172.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -64.08 -30.64 71.69 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 114.91 -1.041 . . . . 72.25 111.167 174.112 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.663 ' HG3' ' HB2' ' A' ' 29' ' ' ARG . 49.8 mt-10 -69.35 -23.18 63.72 Favored 'General case' 0 C--N 1.358 0.943 0 C-N-CA 122.161 0.184 . . . . 70.540000000000006 110.698 175.514 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.511 HD23 ' HB3' ' A' ' 27' ' ' ALA . 0.2 OUTLIER -84.24 -34.56 23.83 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-O 119.152 -0.451 . . . . 75.200000000000003 110.1 178.047 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.603 ' HG2' HG23 ' A' ' 80' ' ' ILE . 29.9 mtpt -53.75 -53.52 51.02 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 123.794 0.684 . . . . 62.229999999999997 112.033 -177.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.52 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 4.4 pt-20 -50.85 -47.21 60.35 Favored 'General case' 0 N--CA 1.474 0.772 0 O-C-N 124.515 1.135 . . . . 65.219999999999999 111.551 176.503 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 55.3 mttm -63.93 -38.05 89.65 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.415 0.686 . . . . 72.230000000000004 111.365 -173.444 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.456 HD13 HD23 ' A' ' 81' ' ' LEU . 79.8 mt -62.24 -50.48 71.56 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 124.098 0.874 . . . . 74.209999999999994 110.479 175.33 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.423 ' HG2' HG13 ' A' ' 84' ' ' VAL . 7.1 mtpm? -59.72 -34.69 73.25 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.76 0.824 . . . . 74.25 111.535 177.513 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.52 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 32.5 mmmt -65.49 -61.33 2.16 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 123.527 0.517 . . . . 73.030000000000001 110.739 176.152 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 46.4 t -57.6 -39.72 71.2 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.226 0 C-N-CA 124.672 1.189 . . . . 75.319999999999993 111.537 -175.247 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 63.5 mt -63.63 -57.19 10.85 Favored 'General case' 0 C--O 1.217 -0.642 0 CA-C-N 115.732 -0.667 . . . . 75.040000000000006 110.27 175.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.74 HD22 HD12 ' A' ' 113' ' ' LEU . 3.5 m-20 -60.5 -26.23 66.68 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 112.58 0.585 . . . . 75.310000000000002 112.58 -179.399 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.486 ' HA ' ' CE1' ' A' ' 117' ' ' HIS . 38.4 mm-40 -70.89 -51.86 23.64 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 120.879 0.371 . . . . 73.219999999999999 110.681 174.906 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.559 ' NH2' ' HB3' ' A' ' 19' ' ' TYR . 7.9 tpt180 -76.37 -32.29 58.51 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 115.481 -0.781 . . . . 73.140000000000001 112.139 -172.614 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.514 ' SD ' HD12 ' A' ' 12' ' ' ILE . 97.2 mmm -80.17 -12.8 59.61 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.161 0.584 . . . . 71.209999999999994 111.94 -172.863 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.77 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 9.5 t70 -70.85 -51.7 10.99 Favored Pre-proline 0 CA--C 1.569 1.707 0 CA-C-O 118.525 -0.75 . . . . 62.299999999999997 111.7 -177.901 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -62.04 -23.95 76.2 Favored 'Trans proline' 0 C--N 1.386 2.549 0 C-N-CA 122.031 1.821 . . . . 63.119999999999997 113.927 173.504 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.403 HG21 HD11 ' A' ' 12' ' ' ILE . 46.2 mm -65.27 -37.59 80.51 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 C-N-CA 123.889 0.876 . . . . 74.140000000000001 111.858 -178.32 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.77 ' HE2' ' HA ' ' A' ' 46' ' ' ASP . 45.1 mtmt -62.19 -34.41 76.39 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 122.777 0.431 . . . . 54.109999999999999 110.323 175.375 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -74.86 -29.09 60.92 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.767 0.827 . . . . 54.119999999999997 111.278 177.058 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 82.4 mt -68.28 -23.87 64.81 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 109.476 -0.564 . . . . 64.530000000000001 109.476 173.695 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.56 46.96 5.86 Favored Glycine 0 C--N 1.347 1.168 0 CA-C-N 115.163 -0.926 . . . . 24.109999999999999 112.481 166.314 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 20.8 p -117.03 107.35 14.42 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 123.803 0.841 . . . . 74.450000000000003 108.799 175.231 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -78.0 -12.8 60.02 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 110.293 -0.262 . . . . 71.540000000000006 110.293 177.418 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 37.1 ttt180 -116.7 127.71 54.66 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 108.781 -0.822 . . . . 73.329999999999998 108.781 170.713 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 28.7 m -130.8 142.11 44.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 123.825 0.85 . . . . 70.420000000000002 109.578 178.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 42.0 ttm180 -118.0 108.29 15.08 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.434 0.694 . . . . 64.299999999999997 109.819 173.695 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 36.6 mt -105.17 105.76 19.25 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 C-N-CA 124.593 1.157 . . . . 62.020000000000003 109.944 -177.153 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.416 ' HA ' ' O ' ' A' ' 102' ' ' VAL . 29.0 m -96.36 105.5 17.59 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 108.414 -0.958 . . . . 75.010000000000005 108.414 174.305 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 50.8 mt -97.5 125.11 50.7 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 123.017 0.527 . . . . 70.0 110.428 178.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 1.4 mpp_? -112.79 121.32 44.35 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 107.243 -1.391 . . . . 72.239999999999995 107.243 178.096 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.4 p -94.59 131.12 42.32 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 N-CA-C 109.563 -0.532 . . . . 55.439999999999998 109.563 -175.429 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.421 ' HD3' ' HB2' ' A' ' 7' ' ' GLU . 53.6 mtpt -95.85 133.3 40.16 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 108.29 -1.004 . . . . 64.129999999999995 108.29 -178.22 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 94.6 m-70 -101.17 155.89 17.75 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 114.009 1.115 . . . . 75.120000000000005 114.009 -161.443 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 34.0 t -69.47 -49.36 55.52 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 113.184 -1.825 . . . . 62.439999999999998 110.863 176.772 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -160.19 162.21 33.77 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 122.682 0.393 . . . . 74.019999999999996 110.688 -177.242 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.32 -37.5 83.49 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.171 0.989 . . . . 74.019999999999996 111.858 177.555 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.17 -39.05 78.96 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.921 -0.581 . . . . 72.209999999999994 111.421 177.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -83.01 -25.94 31.7 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 115.322 -0.854 . . . . 75.299999999999997 112.362 -173.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -62.58 -36.84 83.98 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 113.204 0.816 . . . . 72.319999999999993 113.204 -167.057 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.504 ' O ' ' HD3' ' A' ' 75' ' ' LYS . 21.3 pttp -67.11 -19.89 65.7 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.941 0.896 . . . . 74.409999999999997 112.139 178.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -86.24 -50.42 6.97 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.029 0.532 . . . . 60.32 110.69 169.312 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -52.44 -48.58 65.69 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 124.427 1.091 . . . . 62.009999999999998 112.132 -173.71 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.88 -49.56 75.74 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.877 0.871 . . . . 61.119999999999997 112.541 -176.387 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.504 ' HD3' ' O ' ' A' ' 71' ' ' LYS . 3.3 mptp? -69.8 -34.12 73.27 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 115.575 -0.738 . . . . 71.200000000000003 111.035 -175.58 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -64.67 -48.04 76.24 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.165 0.586 . . . . 72.0 110.106 171.16 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -70.18 -21.27 63.07 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.481 1.112 . . . . 75.329999999999998 110.111 -173.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.487 ' HA ' ' NE1' ' A' ' 97' ' ' TRP . . . -63.72 -48.77 75.71 Favored 'General case' 0 C--N 1.343 0.324 0 C-N-CA 123.955 0.902 . . . . 42.009999999999998 110.722 172.857 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.09 -42.21 85.01 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.573 -0.739 . . . . 44.130000000000003 111.021 176.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.603 HG23 ' HG2' ' A' ' 34' ' ' LYS . 44.0 mm -58.73 -50.33 79.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 123.966 0.907 . . . . 62.439999999999998 110.797 179.633 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.456 HD23 HD13 ' A' ' 37' ' ' LEU . 23.3 mt -68.12 -36.85 80.4 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 122.928 0.491 . . . . 74.129999999999995 111.883 179.027 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -59.74 -36.96 77.67 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.295 0.638 . . . . 75.319999999999993 110.21 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -71.98 -48.55 44.12 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 115.332 -0.849 . . . . 75.019999999999996 111.119 175.069 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.479 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 23.2 t -58.76 -55.33 23.82 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 C-N-CA 123.989 0.916 . . . . 74.510000000000005 111.323 -174.307 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.448 ' CE2' HG21 ' A' ' 104' ' ' VAL . 55.3 m-85 -59.89 -36.43 76.94 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 123.929 0.768 . . . . 64.209999999999994 112.231 179.257 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -71.19 -24.18 62.18 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 122.941 0.496 . . . . 75.109999999999999 111.858 178.669 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -84.8 -5.78 59.34 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.824 0.85 . . . . 70.310000000000002 111.004 175.291 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 68.4 mt -105.41 -31.06 9.2 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 122.701 0.4 . . . . 41.119999999999997 110.873 -179.578 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 143.6 -10.77 2.17 Favored Glycine 0 C--N 1.348 1.234 0 CA-C-O 119.404 -0.665 . . . . 64.109999999999999 114.287 177.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.443 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 97.1 m-85 -74.75 126.56 31.16 Favored 'General case' 0 N--CA 1.484 1.229 0 CA-C-N 118.271 1.036 . . . . 73.140000000000001 110.682 176.796 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -95.62 91.72 6.27 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.494 0.718 . . . . 75.109999999999999 111.333 -174.023 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 20.8 t70 54.8 -81.19 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 124.819 1.247 . . . . 73.040000000000006 113.989 165.642 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 20.1 m -66.73 -13.8 61.8 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 124.172 0.989 . . . . 50.210000000000001 113.144 -175.788 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ASN . . . . . 0.459 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 10.6 m120 -55.37 -37.44 67.53 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.175 0.59 . . . . 73.510000000000005 110.671 168.506 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 45.1 t -99.03 118.32 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 125.137 1.375 . . . . 71.450000000000003 110.092 -174.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 45.5 m -144.69 128.05 16.87 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-N 118.442 0.565 . . . . 73.510000000000005 110.568 173.661 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.487 ' NE1' ' HA ' ' A' ' 78' ' ' ALA . 27.7 m95 -87.17 152.49 22.28 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 124.129 0.971 . . . . 73.409999999999997 111.513 -179.317 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -159.72 92.76 1.05 Allowed 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.139 0.975 . . . . 73.030000000000001 109.036 177.528 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 59.25 58.54 13.92 Favored Glycine 0 C--N 1.346 1.105 0 CA-C-N 115.887 -0.597 . . . . 73.25 113.501 177.273 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 71.03 3.41 4.64 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 124.88 1.272 . . . . 61.409999999999997 113.055 179.387 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 37.7 m -119.59 110.75 17.23 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 108.916 -0.772 . . . . 74.239999999999995 108.916 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.416 ' O ' ' HA ' ' A' ' 59' ' ' SER . 6.9 p -99.76 119.8 48.3 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 N-CA-C 109.471 -0.566 . . . . 72.129999999999995 109.471 179.842 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 87.0 m -92.35 104.4 16.75 Favored 'General case' 0 C--O 1.241 0.634 0 N-CA-C 108.221 -1.029 . . . . 73.150000000000006 108.221 176.512 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.459 ' HA ' ' O ' ' A' ' 94' ' ' ASN . 48.8 t -108.48 109.49 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 C-N-CA 124.234 1.013 . . . . 72.349999999999994 108.37 179.056 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -135.76 147.24 48.32 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 122.465 0.306 . . . . 62.32 110.269 -176.297 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.413 ' HA3' ' ND2' ' A' ' 94' ' ' ASN . . . 168.27 -160.39 33.9 Favored Glycine 0 C--O 1.245 0.782 0 CA-C-N 115.825 -0.625 . . . . 72.120000000000005 112.338 -177.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 27.2 pt20 -88.4 117.67 27.49 Favored 'General case' 0 CA--C 1.55 0.964 0 CA-C-O 121.758 0.789 . . . . 70.340000000000003 111.623 -174.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 28.0 tp -78.79 172.77 13.27 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 124.502 1.121 . . . . 44.130000000000003 109.876 169.396 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 84.12 -44.33 0.09 Allowed 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 126.313 1.845 . . . . 74.540000000000006 109.707 -176.05 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -69.7 -35.66 74.21 Favored Glycine 0 C--N 1.343 0.948 0 N-CA-C 110.887 -0.885 . . . . 53.439999999999998 110.887 169.138 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 65.2 t -80.79 97.25 3.19 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.877 0 N-CA-C 108.545 -0.909 . . . . 70.439999999999998 108.545 169.445 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -168.63 131.09 1.35 Allowed 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.978 0.911 . . . . 74.310000000000002 108.974 -174.184 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.74 HD12 HD22 ' A' ' 42' ' ' ASN . 79.5 mt -119.48 147.03 44.9 Favored 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 108.893 -0.781 . . . . 71.109999999999999 108.893 175.017 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -69.96 80.39 0.48 Allowed 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.506 1.122 . . . . 73.209999999999994 111.909 -172.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 3.6 p-80 -169.85 80.33 0.11 Allowed 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.159 1.384 . . . . 74.450000000000003 108.121 173.439 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 83.0 t60 -79.06 73.48 5.61 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-O 122.303 1.049 . . . . 55.119999999999997 108.734 177.087 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' HIS . . . . . 0.486 ' CE1' ' HA ' ' A' ' 43' ' ' GLU . 23.8 p80 -64.33 -33.66 76.35 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 113.508 -1.678 . . . . 63.140000000000001 110.88 179.062 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 21.5 t-80 -86.35 111.51 20.55 Favored 'General case' 0 C--O 1.224 -0.255 0 C-N-CA 124.418 1.087 . . . . 74.549999999999997 110.05 -176.083 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 33.4 p-80 -124.15 39.03 4.06 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.37 1.068 . . . . 75.230000000000004 109.351 -178.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 59.3 t-80 . . . . . 0 C--O 1.249 1.067 0 C-N-CA 123.717 0.807 . . . . 74.239999999999995 109.562 -178.043 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.551 1.009 0 CA-C-O 121.771 0.796 . . . . 73.310000000000002 110.13 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.2 m -75.38 -42.9 52.84 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 121.748 0.785 . . . . 73.219999999999999 110.052 173.492 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -172.64 71.45 0.1 Allowed Glycine 0 C--N 1.338 0.65 0 N-CA-C 109.81 -1.316 . . . . 70.409999999999997 109.81 179.291 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.9 mmmm -72.93 141.69 47.83 Favored 'General case' 0 C--O 1.24 0.604 0 CA-C-O 121.221 0.534 . . . . 72.140000000000001 110.975 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.52 ' HA ' ' HA ' ' A' ' 26' ' ' TYR . 40.5 ttpt -83.05 110.9 18.39 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 106.89 -1.522 . . . . 74.439999999999998 106.89 166.591 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.539 HG21 HG22 ' A' ' 62' ' ' VAL . 7.2 p -98.21 149.91 5.05 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 N-CA-C 108.87 -0.789 . . . . 74.099999999999994 108.87 -176.101 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.446 ' HB3' HG22 ' A' ' 22' ' ' THR . 37.2 mt-10 -109.85 113.19 25.73 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 108.988 -0.745 . . . . 72.409999999999997 108.988 -176.002 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 79.5 t -100.71 118.24 47.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 C-N-CA 124.614 1.166 . . . . 73.430000000000007 109.333 -176.729 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 68.0 mt-30 -96.84 102.48 14.27 Favored 'General case' 0 C--O 1.24 0.588 0 N-CA-C 108.034 -1.099 . . . . 75.430000000000007 108.034 -178.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.433 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 48.2 t -93.67 104.65 15.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 N-CA-C 108.442 -0.947 . . . . 44.43 108.442 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -108.17 105.17 14.78 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.946 0.898 . . . . 71.349999999999994 109.009 -175.875 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.546 HD13 HG13 ' A' ' 48' ' ' ILE . 17.6 tt -123.41 118.4 54.36 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-O 121.256 0.551 . . . . 74.109999999999999 110.973 -178.337 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 21.8 m -95.01 121.03 36.21 Favored 'General case' 0 C--O 1.242 0.703 0 N-CA-C 108.676 -0.861 . . . . 64.109999999999999 108.676 177.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.422 ' SG ' HG23 ' A' ' 48' ' ' ILE . 26.3 t -145.26 141.92 29.04 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 124.213 1.005 . . . . 62.43 109.756 -178.945 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 46.6 t-20 72.03 -74.02 0.09 Allowed 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 125.182 1.393 . . . . 72.519999999999996 109.471 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -168.2 11.56 0.06 OUTLIER Glycine 0 C--N 1.338 0.662 0 N-CA-C 111.024 -0.83 . . . . 53.039999999999999 111.024 172.018 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 27.8 mmmt -122.3 138.29 54.56 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 124.743 1.217 . . . . 65.400000000000006 109.368 -175.809 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 53.7 m -98.09 122.78 41.65 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 108.819 -0.808 . . . . 63.539999999999999 108.819 174.525 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -106.13 101.47 10.95 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 107.106 -1.442 . . . . 73.329999999999998 107.106 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.433 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 12.8 pt-20 -130.7 141.75 50.41 Favored 'General case' 0 C--O 1.241 0.619 0 CA-C-O 121.217 0.532 . . . . 71.140000000000001 110.17 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 57.9 ttt85 -155.29 148.01 24.28 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 114.805 -1.089 . . . . 74.519999999999996 108.497 174.294 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.446 HG22 ' HB3' ' A' ' 7' ' ' GLU . 22.4 m -93.38 108.69 20.31 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.88 0.872 . . . . 74.030000000000001 108.926 177.694 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 80.3 m-85 -98.76 132.14 44.36 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.121 0.968 . . . . 64.140000000000001 110.169 -174.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.426 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 1.9 mp0 -88.96 107.59 19.11 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 108.365 -0.976 . . . . 61.130000000000003 108.365 178.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 33.5 mt -112.06 106.82 15.56 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.119 0.967 . . . . 73.319999999999993 109.288 179.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.52 ' HA ' ' HA ' ' A' ' 5' ' ' LYS . 55.0 t80 -81.07 128.16 33.42 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.165 0.586 . . . . 73.439999999999998 109.844 176.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.427 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -141.19 147.88 39.07 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.182 0.593 . . . . 73.030000000000001 110.461 174.096 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 58.7 t -84.85 -40.23 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 CA-C-N 115.645 -0.707 . . . . 53.25 109.163 172.07 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.53 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 40.0 mtt180 -120.16 162.49 19.26 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 115.043 -0.98 . . . . 74.420000000000002 109.841 -178.166 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -63.56 -38.01 89.52 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 115.133 -0.939 . . . . 64.209999999999994 110.797 171.564 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -65.91 -27.49 68.23 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.942 0.897 . . . . 65.209999999999994 111.781 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.53 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 12.4 mm-40 -68.0 -39.13 83.3 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 122.399 0.28 . . . . 72.409999999999997 110.362 177.682 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.572 HD22 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -66.11 -20.19 66.08 Favored 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 123.583 0.753 . . . . 71.5 110.986 -175.136 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.1 mtpp -54.03 -62.97 1.31 Allowed 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.661 0.785 . . . . 73.329999999999998 111.994 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.554 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 2.5 pp20? -65.0 -30.37 71.36 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 116.107 -0.497 . . . . 73.530000000000001 111.471 -176.785 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.572 ' HD2' HD22 ' A' ' 33' ' ' LEU . 53.8 mttm -64.42 -41.69 96.47 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.665 0.786 . . . . 65.400000000000006 110.495 178.691 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.437 HD13 HD23 ' A' ' 81' ' ' LEU . 74.4 mt -56.31 -52.75 63.37 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 124.014 0.821 . . . . 43.130000000000003 109.746 171.885 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.2 mtpm? -56.77 -37.79 71.57 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 124.121 0.888 . . . . 64.209999999999994 112.004 -178.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.554 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 29.9 mmtp -61.84 -55.29 31.45 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 122.948 0.499 . . . . 74.140000000000001 110.137 177.105 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 92.7 t -64.55 -34.11 67.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-N 115.008 -0.997 . . . . 73.319999999999993 111.422 -176.468 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.462 HD21 HD11 ' A' ' 60' ' ' ILE . 64.2 mt -72.4 -41.0 66.78 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.358 0.663 . . . . 74.299999999999997 111.023 -177.17 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.8 m-80 -64.94 -40.38 94.95 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 122.356 0.262 . . . . 70.310000000000002 111.109 174.579 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 47.7 mm-40 -65.95 -46.81 76.78 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.262 0.625 . . . . 64.519999999999996 111.4 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? -69.58 -39.26 77.45 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.35 0.66 . . . . 74.25 111.54 -177.631 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.476 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 54.3 mtp -88.45 -7.91 55.81 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 113.169 0.803 . . . . 74.099999999999994 113.169 -175.63 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -63.27 -51.47 68.59 Favored Pre-proline 0 CA--C 1.569 1.693 0 CA-C-O 118.548 -0.739 . . . . 73.299999999999997 111.573 178.048 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -66.49 -23.28 50.58 Favored 'Trans proline' 0 C--N 1.398 3.181 0 C-N-CA 122.383 2.056 . . . . 74.329999999999998 112.801 175.747 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.546 HG13 HD13 ' A' ' 12' ' ' ILE . 51.2 mm -67.07 -29.98 47.95 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 C-N-CA 124.148 0.979 . . . . 71.439999999999998 110.077 179.693 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.476 ' HG3' ' O ' ' A' ' 45' ' ' MET . 92.7 mttt -70.02 -34.5 73.37 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 115.272 -0.877 . . . . 74.439999999999998 110.6 175.625 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.4 ttmp? -74.24 -26.64 60.35 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.088 0.555 . . . . 71.450000000000003 111.319 178.201 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 88.8 mt -70.99 -45.01 64.76 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 108.995 -0.743 . . . . 62.329999999999998 108.995 172.72 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 88.21 17.87 56.64 Favored Glycine 0 C--N 1.342 0.903 0 CA-C-N 115.392 -0.822 . . . . 63.140000000000001 114.671 171.133 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.537 ' SG ' HG12 ' A' ' 56' ' ' VAL . 6.6 p -62.04 122.45 15.54 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 123.602 0.761 . . . . 70.109999999999999 110.131 175.209 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm -62.65 -57.15 12.06 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.212 0.605 . . . . 75.129999999999995 110.445 -177.189 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 33.5 ttp180 -103.48 128.23 50.71 Favored 'General case' 0 C--N 1.345 0.384 0 CA-C-N 115.504 -0.771 . . . . 71.540000000000006 109.11 176.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.537 HG12 ' SG ' ' A' ' 53' ' ' CYS . 34.5 m -116.08 142.96 27.32 Favored 'Isoleucine or valine' 0 C--O 1.244 0.785 0 C-N-CA 123.62 0.768 . . . . 75.319999999999993 109.437 176.467 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -100.42 103.1 14.46 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 108.52 -0.918 . . . . 73.049999999999997 108.52 177.497 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 36.9 mt -102.09 140.07 21.56 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 N-CA-C 107.994 -1.113 . . . . 64.030000000000001 107.994 179.065 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 32.4 t -141.9 104.24 4.47 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 107.327 -1.36 . . . . 60.32 107.327 175.74 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.462 HD11 HD21 ' A' ' 41' ' ' LEU . 78.2 mt -103.26 107.55 22.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 N-CA-C 108.511 -0.922 . . . . 74.310000000000002 108.511 -178.308 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 28.0 ttt180 -102.27 131.79 48.62 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 108.518 -0.919 . . . . 71.019999999999996 108.518 173.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.539 HG22 HG21 ' A' ' 6' ' ' VAL . 8.0 p -95.04 139.2 19.16 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 N-CA-C 106.979 -1.489 . . . . 75.129999999999995 106.979 174.709 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -82.77 136.99 34.52 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-O 121.134 0.492 . . . . 73.25 109.872 -175.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' HIS . . . . . 0.57 ' HB3' ' HG3' ' A' ' 70' ' ' GLU . 73.7 m80 -105.43 127.61 53.08 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 124.47 1.108 . . . . 61.329999999999998 109.397 -169.498 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 23.3 t -83.35 -47.81 11.07 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.643 0.777 . . . . 64.230000000000004 111.481 -171.631 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -109.29 -105.04 0.36 Allowed 'General case' 0 CA--C 1.56 1.329 0 C-N-CA 123.439 0.696 . . . . 74.230000000000004 109.998 -175.027 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.405 ' O ' ' HG2' ' A' ' 71' ' ' LYS . . . 176.71 -60.25 0.01 OUTLIER 'General case' 0 C--N 1.362 1.111 0 C-N-CA 125.351 1.46 . . . . 75.540000000000006 107.9 -177.883 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.27 -42.79 68.31 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 115.436 -0.802 . . . . 73.519999999999996 110.419 178.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -62.19 -36.04 80.69 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 115.572 -0.74 . . . . 43.420000000000002 110.461 173.261 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.57 ' HG3' ' HB3' ' A' ' 64' ' ' HIS . 41.5 mm-40 -73.2 -22.61 60.42 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.23 0.612 . . . . 71.140000000000001 112.137 -175.024 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.405 ' HG2' ' O ' ' A' ' 67' ' ' ALA . 3.1 mmmp? -63.39 -33.58 75.85 Favored 'General case' 0 N--CA 1.483 1.187 0 CA-C-O 121.285 0.564 . . . . 73.0 110.128 172.441 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 34.1 ttpt -84.29 -46.0 12.25 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.764 1.226 . . . . 71.340000000000003 110.96 177.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -80.5 -30.81 37.3 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 112.873 0.694 . . . . 70.430000000000007 112.873 -168.293 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -78.62 -30.6 46.58 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 122.594 0.358 . . . . 73.400000000000006 110.279 175.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 51.9 tttm -63.39 -40.5 97.39 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.618 0.767 . . . . 61.5 110.201 168.31 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -67.19 -40.69 86.57 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.693 0.797 . . . . 71.430000000000007 110.384 175.054 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -76.47 -19.04 58.43 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.984 0.914 . . . . 72.120000000000005 110.588 -175.215 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.2 -45.74 83.5 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.286 0.634 . . . . 40.530000000000001 110.448 173.221 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.69 -34.17 75.28 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.54 -0.755 . . . . 74.129999999999995 111.255 176.584 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 46.4 mm -67.68 -50.72 58.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 123.86 0.864 . . . . 74.099999999999994 110.918 -179.249 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.437 HD23 HD13 ' A' ' 37' ' ' LEU . 34.4 mt -66.11 -50.72 63.07 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 123.625 0.578 . . . . 72.340000000000003 110.174 -176.154 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -56.89 -41.29 77.78 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 124.029 0.932 . . . . 64.349999999999994 111.543 -177.155 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 19.7 mmmt -64.96 -44.71 88.5 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 123.76 0.663 . . . . 74.349999999999994 111.255 176.735 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.419 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 25.0 t -62.61 -44.7 99.62 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 C-N-CA 123.017 0.527 . . . . 64.200000000000003 110.124 -176.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.558 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 20.6 m-85 -60.77 -42.3 97.2 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 124.091 0.869 . . . . 74.420000000000002 110.273 177.741 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.39 -34.13 77.07 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.529 0.731 . . . . 73.510000000000005 111.331 177.558 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -81.27 -8.02 59.67 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.022 0.929 . . . . 74.25 110.85 -178.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 93.1 mt -107.22 -9.77 16.01 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.821 0.848 . . . . 70.010000000000005 110.397 176.802 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 109.4 -5.73 31.65 Favored Glycine 0 N--CA 1.478 1.485 0 N-CA-C 114.096 0.399 . . . . 50.140000000000001 114.096 175.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.619 ' HB3' HD21 ' A' ' 94' ' ' ASN . 9.9 m-85 -79.66 138.85 37.51 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.374 0.67 . . . . 63.130000000000003 109.438 179.048 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 28.3 m-80 -96.53 168.77 10.34 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.548 0.739 . . . . 71.230000000000004 111.735 -176.167 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -54.45 -45.46 73.11 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.926 1.29 . . . . 75.430000000000007 111.041 177.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 23.9 m -57.48 -46.45 83.69 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 124.71 1.204 . . . . 61.310000000000002 113.424 -173.389 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ASN . . . . . 0.619 HD21 ' HB3' ' A' ' 90' ' ' TYR . 3.7 p-10 -83.05 -11.24 58.23 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 122.743 0.417 . . . . 51.350000000000001 111.675 -177.111 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 97.0 t -88.6 102.1 12.48 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 N-CA-C 107.956 -1.127 . . . . 51.5 107.956 172.031 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 22.7 m -108.25 103.78 13.03 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.572 0.749 . . . . 64.140000000000001 110.458 -173.749 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 43.0 m95 -79.94 150.48 30.5 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.347 0.659 . . . . 74.109999999999999 111.65 178.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -144.28 69.88 1.28 Allowed 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 106.966 -1.494 . . . . 72.310000000000002 106.966 170.718 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 52.37 -82.4 0.01 OUTLIER Glycine 0 C--N 1.361 1.955 0 CA-C-N 114.156 -1.384 . . . . 41.119999999999997 114.777 179.483 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -72.55 -39.1 67.75 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 126.041 1.736 . . . . 34.039999999999999 112.776 -174.759 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 35.6 m -131.4 149.65 52.46 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.754 0.822 . . . . 50.43 110.475 -174.422 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 7.4 p -116.82 137.98 48.93 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 C-N-CA 123.329 0.652 . . . . 75.040000000000006 110.361 176.144 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 39.4 m -114.28 108.76 17.36 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.864 1.266 . . . . 71.010000000000005 109.073 176.322 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.4 t -101.04 119.69 49.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 C-N-CA 123.406 0.682 . . . . 73.430000000000007 109.475 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -86.32 113.07 22.01 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 107.333 -1.358 . . . . 75.219999999999999 107.333 171.724 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -105.02 167.31 14.99 Favored Glycine 0 C--N 1.34 0.804 0 N-CA-C 111.815 -0.514 . . . . 43.530000000000001 111.815 -176.693 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -138.36 128.58 25.84 Favored 'General case' 0 C--O 1.241 0.633 0 C-N-CA 123.79 0.836 . . . . 65.030000000000001 110.179 -175.29 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.401 HD11 ' HG2' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -74.34 123.74 25.17 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.894 0.878 . . . . 72.019999999999996 108.8 -178.766 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 42.56 22.45 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.86 0 C-N-CA 126.165 1.786 . . . . 74.140000000000001 114.482 -173.199 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -74.97 -32.33 56.85 Favored Glycine 0 C--N 1.352 1.434 0 N-CA-C 108.796 -1.722 . . . . 43.409999999999997 108.796 164.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 30.6 m -69.15 -164.17 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.559 1.311 0 C-N-CA 125.055 1.342 . . . . 73.409999999999997 110.293 164.533 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -51.13 121.11 5.64 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.293 0.637 . . . . 73.010000000000005 111.353 -178.596 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 85.6 mt -64.5 98.17 0.24 Allowed 'General case' 0 C--O 1.242 0.659 0 C-N-CA 123.795 0.838 . . . . 73.430000000000007 109.339 176.217 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -67.09 126.49 29.34 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 115.048 -0.978 . . . . 73.25 111.028 -172.494 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 59.0 m80 -67.97 -24.16 65.12 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.5 0.72 . . . . 73.099999999999994 110.569 177.335 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 50.3 t60 -61.76 104.91 0.49 Allowed 'General case' 0 C--O 1.244 0.8 0 N-CA-C 107.807 -1.183 . . . . 74.099999999999994 107.807 164.743 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 30.1 m80 -67.28 90.93 0.23 Allowed 'General case' 0 CA--C 1.534 0.334 0 O-C-N 124.074 0.859 . . . . 74.150000000000006 111.519 -172.186 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 55.4 p-80 -98.53 -162.75 0.98 Allowed 'General case' 0 C--O 1.248 0.988 0 N-CA-C 107.341 -1.355 . . . . 73.519999999999996 107.341 166.255 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -66.19 159.34 26.57 Favored 'General case' 0 CA--C 1.558 1.279 0 CA-C-N 118.424 0.556 . . . . 73.310000000000002 111.052 -178.446 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 4.3 p80 . . . . . 0 CA--C 1.553 1.091 0 C-N-CA 125.112 1.365 . . . . 62.43 108.4 162.509 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.1 ptt? . . . . . 0 N--CA 1.48 1.03 0 N-CA-C 109.934 -0.395 . . . . 72.340000000000003 109.934 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.8 m 67.62 167.96 0.25 Allowed 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.69 1.196 . . . . 63.25 111.023 -173.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -69.09 81.68 0.25 Allowed Glycine 0 C--N 1.343 0.941 0 N-CA-C 112.12 -0.392 . . . . 74.530000000000001 112.12 178.52 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.7 tppp? -124.06 128.49 49.4 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 123.494 0.718 . . . . 72.450000000000003 110.126 -175.265 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 26.8 ttpt -85.94 111.07 19.9 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-N 115.436 -0.802 . . . . 72.310000000000002 109.12 174.804 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.4 p -99.66 142.38 15.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 N-CA-C 108.122 -1.066 . . . . 61.219999999999999 108.122 171.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.548 ' HB3' HG22 ' A' ' 22' ' ' THR . 50.2 mt-10 -113.71 118.91 35.65 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 109.521 -0.548 . . . . 41.119999999999997 109.521 177.507 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 59.2 t -106.75 116.02 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 124.429 1.092 . . . . 62.109999999999999 109.688 -171.166 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.409 ' O ' ' HA ' ' A' ' 60' ' ' ILE . 43.4 tt0 -92.26 102.7 15.2 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 107.987 -1.116 . . . . 54.43 107.987 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 98.0 t -96.89 102.71 13.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 N-CA-C 108.317 -0.994 . . . . 73.349999999999994 108.317 178.401 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.497 ' HA ' ' HB3' ' A' ' 20' ' ' GLU . 22.1 ttmm -104.22 103.56 13.34 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 108.573 -0.899 . . . . 72.109999999999999 108.573 -178.119 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.494 HD13 HG13 ' A' ' 48' ' ' ILE . 11.8 tt -112.55 124.21 69.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 CA-C-O 121.069 0.462 . . . . 75.450000000000003 109.943 179.419 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 11.9 m -98.04 113.5 25.39 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.615 0.766 . . . . 75.340000000000003 109.247 178.386 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.596 ' SG ' HG23 ' A' ' 48' ' ' ILE . 18.4 t -153.81 150.6 28.63 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.914 1.286 . . . . 53.240000000000002 108.849 179.77 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.525 ' HB2' HD13 ' A' ' 51' ' ' LEU . 62.5 t30 69.82 12.77 8.02 Favored 'General case' 0 N--CA 1.504 2.261 0 C-N-CA 124.273 1.029 . . . . 70.439999999999998 111.295 178.715 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 77.94 4.86 86.39 Favored Glycine 0 C--N 1.349 1.291 0 CA-C-N 116.414 -0.357 . . . . 53.219999999999999 112.319 -171.625 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.4 mmpt? -113.53 165.78 12.15 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.583 1.153 . . . . 73.209999999999994 109.526 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 39.8 m -119.36 115.66 24.59 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 109.281 -0.637 . . . . 71.099999999999994 109.281 174.296 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -103.62 106.22 16.67 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 107.131 -1.433 . . . . 73.140000000000001 107.131 -179.4 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.497 ' HB3' ' HA ' ' A' ' 11' ' ' LYS . 16.9 pt-20 -143.29 161.6 37.88 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.523 0.678 . . . . 71.200000000000003 112.212 -176.032 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 35.6 ttm180 -167.21 148.24 5.66 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-N 113.764 -1.562 . . . . 74.519999999999996 108.063 176.635 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.548 HG22 ' HB3' ' A' ' 7' ' ' GLU . 27.8 m -92.37 112.99 25.13 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 107.337 -1.357 . . . . 52.240000000000002 107.337 169.651 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 -97.51 127.26 43.33 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.062 0.945 . . . . 74.040000000000006 109.902 -173.419 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -83.85 106.07 15.24 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 107.502 -1.296 . . . . 73.540000000000006 107.502 178.018 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 81.5 mt -112.98 119.95 39.69 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.292 1.037 . . . . 71.230000000000004 108.337 -179.468 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -109.1 118.81 37.73 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 109.024 -0.732 . . . . 75.540000000000006 109.024 -177.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -124.84 150.91 45.92 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.269 0.628 . . . . 50.140000000000001 110.098 178.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 44.9 t -95.01 -26.31 4.39 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 C-N-CA 123.881 0.872 . . . . 75.109999999999999 109.489 175.128 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.6 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 90.3 mtt180 -131.72 157.03 44.86 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 108.158 -1.052 . . . . 73.010000000000005 108.158 174.88 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -67.67 -32.96 74.0 Favored 'General case' 0 N--CA 1.488 1.427 0 CA-C-O 121.239 0.542 . . . . 64.140000000000001 111.012 -178.243 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -70.2 -21.35 63.04 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.138 0.975 . . . . 73.420000000000002 111.343 -179.421 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.6 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 27.6 mm-40 -68.93 -23.7 64.19 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 122.875 0.47 . . . . 73.010000000000005 110.813 174.8 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.61 HD22 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -73.18 -19.29 61.14 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 123.238 0.615 . . . . 65.209999999999994 111.217 -177.386 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -54.86 -59.19 5.06 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.682 0.793 . . . . 74.329999999999998 111.573 178.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -57.5 -36.37 71.45 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.847 0.859 . . . . 54.329999999999998 112.487 -177.769 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.61 ' HD2' HD22 ' A' ' 33' ' ' LEU . 62.0 mttm -67.25 -46.09 74.77 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.298 -0.865 . . . . 73.420000000000002 109.912 -177.327 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.479 HD13 HD23 ' A' ' 81' ' ' LEU . 95.9 mt -65.63 -40.04 92.12 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.411 0.684 . . . . 63.409999999999997 111.874 177.767 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 60.2 mtpt -59.47 -42.44 92.06 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 122.929 0.492 . . . . 62.119999999999997 110.697 177.336 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 34.1 mmtm -67.64 -57.21 6.82 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 123.506 0.504 . . . . 74.200000000000003 111.268 176.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 53.0 t -56.07 -44.51 78.9 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.94 0 C-N-CA 123.213 0.605 . . . . 74.109999999999999 111.508 -175.585 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.47 HD21 HD11 ' A' ' 60' ' ' ILE . 83.8 mt -68.99 -59.82 2.79 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.003 0.521 . . . . 70.239999999999995 111.311 179.407 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 60.8 t30 -60.69 -38.42 84.92 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 123.415 0.686 . . . . 70.150000000000006 112.173 -172.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 -80.17 -32.55 38.77 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.366 0.666 . . . . 63.350000000000001 111.921 -177.322 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 4.5 tpt180 -68.74 -33.83 74.57 Favored 'General case' 0 N--CA 1.486 1.358 0 CA-C-O 121.318 0.58 . . . . 74.430000000000007 109.506 172.227 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.528 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 58.2 mtp -86.64 -6.35 58.88 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.295 -0.866 . . . . 72.219999999999999 112.058 178.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -63.19 -51.08 72.05 Favored Pre-proline 0 CA--C 1.565 1.549 0 CA-C-O 118.814 -0.612 . . . . 73.510000000000005 111.723 178.197 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -66.72 -22.31 50.23 Favored 'Trans proline' 0 C--N 1.384 2.422 0 C-N-CA 121.423 1.415 . . . . 62.43 112.263 172.096 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.596 HG23 ' SG ' ' A' ' 14' ' ' CYS . 45.3 mm -71.82 -27.13 26.91 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 123.552 0.741 . . . . 71.420000000000002 110.354 179.13 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.556 ' HB3' ' HA2' ' A' ' 110' ' ' GLY . 90.1 mttt -71.08 -36.58 72.29 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.474 0.71 . . . . 70.319999999999993 110.348 174.513 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.33 -32.73 70.58 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 123.561 0.744 . . . . 63.409999999999997 109.335 175.545 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.525 HD13 ' HB2' ' A' ' 15' ' ' ASN . 92.9 mt -70.07 -34.42 73.17 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 109.655 -0.498 . . . . 54.43 109.655 175.176 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 73.83 45.62 26.72 Favored Glycine 0 C--N 1.342 0.871 0 CA-C-N 115.513 -0.767 . . . . 61.509999999999998 113.285 176.835 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 49.9 m -76.0 112.74 12.75 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 108.918 -0.771 . . . . 73.109999999999999 108.918 169.547 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -58.52 -33.06 69.43 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.254 1.021 . . . . 70.040000000000006 111.084 -179.566 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 43.9 ttp180 -145.7 143.79 29.98 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.452 1.101 . . . . 75.239999999999995 108.489 177.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.476 ' O ' ' HA ' ' A' ' 105' ' ' GLU . 28.7 m -131.42 147.88 32.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 123.953 0.901 . . . . 55.219999999999999 109.488 179.371 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 52.3 ttt85 -102.7 107.22 18.03 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 108.812 -0.81 . . . . 71.450000000000003 108.812 175.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 37.9 mt -107.6 107.91 23.93 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 C-N-CA 123.371 0.668 . . . . 63.340000000000003 109.641 -177.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 18.2 m -98.75 105.67 17.84 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 108.479 -0.934 . . . . 74.430000000000007 108.479 174.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.47 HD11 HD21 ' A' ' 41' ' ' LEU . 71.8 mt -100.3 134.27 40.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 123.129 0.572 . . . . 62.009999999999998 109.481 177.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 21.9 mtm180 -128.37 136.53 51.06 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.564 0.746 . . . . 55.329999999999998 109.544 174.397 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.7 p -95.78 137.22 24.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 123.542 0.737 . . . . 61.299999999999997 109.203 178.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.419 ' HB3' ' H ' ' A' ' 7' ' ' GLU . 63.8 tttm -83.16 114.8 21.58 Favored 'General case' 0 C--O 1.244 0.798 0 N-CA-C 107.602 -1.258 . . . . 54.240000000000002 107.602 174.527 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' HIS . . . . . 0.597 ' HA ' ' HG2' ' A' ' 73' ' ' GLU . 21.6 m170 -69.71 132.97 46.96 Favored 'General case' 0 C--O 1.234 0.258 0 O-C-N 123.885 0.741 . . . . 73.430000000000007 110.132 -172.214 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 19.7 t -57.04 -52.34 65.65 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 123.836 0.854 . . . . 51.240000000000002 111.529 -179.533 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.603 ' H ' ' HB2' ' A' ' 69' ' ' GLU . 21.8 m-20 -144.99 179.69 7.18 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 124.306 1.043 . . . . 61.509999999999998 109.576 -178.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.26 -51.28 64.36 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.974 0.91 . . . . 71.219999999999999 111.085 176.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.17 -26.27 68.09 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.473 0.709 . . . . 63.520000000000003 111.421 177.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.603 ' HB2' ' H ' ' A' ' 66' ' ' ASP . 30.9 mm-40 -73.97 -30.2 62.38 Favored 'General case' 0 C--O 1.204 -1.327 0 CA-C-O 118.136 -0.935 . . . . 71.409999999999997 112.516 179.147 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -49.48 -47.89 48.2 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 114.166 1.173 . . . . 74.400000000000006 114.166 -168.463 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 40.9 mtmt -69.2 -39.71 78.47 Favored 'General case' 0 N--CA 1.479 0.975 0 CA-C-N 115.477 -0.783 . . . . 53.219999999999999 110.585 -177.335 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -69.54 -33.66 73.1 Favored 'General case' 0 C--O 1.212 -0.914 0 CA-C-N 114.581 -1.191 . . . . 74.230000000000004 110.225 175.625 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.597 ' HG2' ' HA ' ' A' ' 64' ' ' HIS . 10.1 tp10 -73.16 -39.32 65.74 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.953 1.301 . . . . 73.420000000000002 110.376 -166.78 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.23 -53.46 56.9 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 115.304 -0.862 . . . . 63.130000000000003 110.841 173.288 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 59.0 mttp -66.44 -39.47 88.93 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 124.396 1.078 . . . . 70.200000000000003 112.447 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -58.32 -54.58 45.45 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 125.387 1.475 . . . . 63.32 109.815 -179.12 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -73.37 -26.5 61.03 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 113.45 -1.705 . . . . 74.540000000000006 110.371 -177.692 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.4 -44.66 90.61 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.433 0.693 . . . . 73.340000000000003 111.076 175.633 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.51 -43.13 99.42 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.351 0.66 . . . . 50.030000000000001 111.219 178.268 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 49.0 mm -66.45 -44.29 90.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 CA-C-N 115.866 -0.606 . . . . 72.510000000000005 110.756 178.166 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.479 HD23 HD13 ' A' ' 37' ' ' LEU . 32.1 mt -64.7 -36.98 86.02 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.368 0.667 . . . . 63.409999999999997 110.975 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -55.53 -44.26 76.51 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.215 1.006 . . . . 54.219999999999999 110.233 179.238 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.421 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 33.7 mmtp -68.05 -45.09 74.89 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 114.841 -1.072 . . . . 75.519999999999996 110.961 177.562 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 77.5 t -66.87 -45.75 86.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 123.312 0.645 . . . . 73.219999999999999 111.151 -172.109 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.467 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 24.1 m-85 -60.75 -38.48 85.34 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.214 0.606 . . . . 72.450000000000003 110.718 176.145 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.32 -28.22 67.81 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.105 0.562 . . . . 65.239999999999995 111.485 176.103 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.421 ' HG3' ' O ' ' A' ' 83' ' ' LYS . 45.0 mt-10 -82.07 -14.96 55.06 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.538 0.735 . . . . 75.219999999999999 110.645 176.912 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 97.2 mt -107.34 -2.77 20.31 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.77 0.828 . . . . 73.420000000000002 110.846 -178.285 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 82.01 19.21 65.64 Favored Glycine 0 C--N 1.348 1.245 0 N-CA-C 114.503 0.561 . . . . 71.430000000000007 114.503 175.58 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.467 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 14.6 m-85 -89.39 137.68 32.11 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 109.419 -0.586 . . . . 71.129999999999995 109.419 173.084 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -80.51 150.69 29.55 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.57 0.748 . . . . 74.530000000000001 110.189 -176.3 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -67.37 -31.63 72.0 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.903 0.881 . . . . 71.329999999999998 112.11 -176.39 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 16.8 m -58.42 -27.02 63.92 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.123 0.569 . . . . 72.25 112.224 174.318 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 42.1 m-20 -75.6 -22.34 57.0 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.071 0.549 . . . . 70.420000000000002 111.116 178.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.515 ' HA ' HG22 ' A' ' 104' ' ' VAL . 47.9 t -91.16 105.84 16.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 124.335 1.054 . . . . 71.239999999999995 109.616 -171.395 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 19.3 m -129.75 112.84 14.02 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.059 0.544 . . . . 71.409999999999997 111.318 -174.512 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 65.5 m95 -87.34 119.34 27.51 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.683 0.793 . . . . 72.120000000000005 111.351 177.429 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -137.85 115.06 10.97 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.437 1.095 . . . . 71.430000000000007 108.64 172.127 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 64.26 43.7 96.62 Favored Glycine 0 C--N 1.351 1.404 0 O-C-N 124.05 0.844 . . . . 71.340000000000003 113.63 175.814 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 63.07 17.55 10.23 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 124.97 1.308 . . . . 74.519999999999996 111.672 179.233 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 25.4 m -118.56 119.78 35.53 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 107.087 -1.449 . . . . 71.030000000000001 107.087 175.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.409 HG11 HD13 ' A' ' 81' ' ' LEU . 7.7 p -99.04 115.65 40.13 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 N-CA-C 109.013 -0.736 . . . . 75.319999999999993 109.013 178.188 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 41.7 m -94.52 118.52 31.79 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 107.913 -1.143 . . . . 70.430000000000007 107.913 177.771 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.515 HG22 ' HA ' ' A' ' 95' ' ' VAL . 55.9 t -128.54 114.97 35.73 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 C-N-CA 123.994 0.917 . . . . 74.310000000000002 108.609 -178.236 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.476 ' HA ' ' O ' ' A' ' 56' ' ' VAL . 3.4 mp0 -85.1 110.95 19.33 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 108.007 -1.109 . . . . 73.549999999999997 108.007 171.219 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -104.11 148.14 16.77 Favored Glycine 0 C--N 1.337 0.629 0 N-CA-C 109.747 -1.341 . . . . 64.25 109.747 179.313 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -131.94 143.37 50.07 Favored 'General case' 0 C--O 1.241 0.658 0 CA-C-O 121.216 0.531 . . . . 71.230000000000004 110.518 -173.61 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -147.74 157.76 43.69 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-N 114.702 -1.135 . . . . 71.140000000000001 109.486 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -94.98 -25.87 16.33 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.581 0.752 . . . . 70.409999999999997 109.408 170.593 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' GLY . . . . . 0.556 ' HA2' ' HB3' ' A' ' 49' ' ' LYS . . . 89.27 -60.96 3.68 Favored Glycine 0 C--N 1.341 0.858 0 CA-C-N 115.585 -0.734 . . . . 63.020000000000003 111.773 -177.157 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 33.7 m -78.93 156.15 4.85 Favored 'Isoleucine or valine' 0 C--O 1.244 0.8 0 C-N-CA 123.593 0.757 . . . . 61.509999999999998 109.986 173.726 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -66.1 145.06 56.28 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 122.777 0.431 . . . . 73.319999999999993 110.538 -177.457 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 86.2 mt -82.19 -7.1 59.61 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.997 0.919 . . . . 44.340000000000003 113.358 -170.564 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -83.78 -162.61 0.66 Allowed 'General case' 0 N--CA 1.488 1.449 0 CA-C-N 118.142 0.428 . . . . 53.340000000000003 110.463 174.186 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 67.1 m-70 -67.33 79.26 0.15 Allowed 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 109.536 -0.542 . . . . 74.349999999999994 109.536 177.153 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 56.9 t-80 -76.04 121.73 23.19 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 121.128 0.489 . . . . 43.439999999999998 111.816 -169.11 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 11.8 m170 -97.35 119.56 36.1 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 108.317 -0.994 . . . . 71.329999999999998 108.317 169.629 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 14.2 t-80 -81.8 94.65 7.08 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 108.452 -0.944 . . . . 60.240000000000002 108.452 169.374 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 23.1 p80 -72.17 159.98 33.2 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 116.021 -0.536 . . . . 73.319999999999993 111.25 -175.077 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 53.4 t-80 . . . . . 0 C--O 1.249 1.028 0 N-CA-C 107.464 -1.31 . . . . 51.030000000000001 107.464 174.487 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.48 1.046 0 N-CA-C 109.01 -0.737 . . . . 72.310000000000002 109.01 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.3 p -87.02 138.78 31.2 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.209 0.603 . . . . 70.040000000000006 110.03 -179.336 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -165.1 56.91 0.26 Allowed Glycine 0 C--N 1.337 0.61 0 N-CA-C 110.215 -1.154 . . . . 71.430000000000007 110.215 179.116 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.53 ' HA ' ' HE3' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -115.33 131.53 56.9 Favored 'General case' 0 C--O 1.239 0.513 0 CA-C-N 114.565 -0.817 . . . . 75.400000000000006 110.801 -176.051 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.515 ' HA ' ' HA ' ' A' ' 26' ' ' TYR . 5.7 ttpm? -88.8 105.35 17.67 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 107.241 -1.392 . . . . 71.150000000000006 107.241 162.316 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.8 p -97.1 143.18 12.9 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 N-CA-C 108.901 -0.777 . . . . 74.450000000000003 108.901 -178.43 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.52 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 49.6 mt-10 -106.97 111.71 24.33 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 108.107 -1.072 . . . . 63.409999999999997 108.107 176.109 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 95.7 t -101.17 116.27 44.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 C-N-CA 124.773 1.229 . . . . 74.519999999999996 108.952 -175.351 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -96.64 101.34 12.93 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 107.982 -1.118 . . . . 72.299999999999997 107.982 -178.78 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 84.6 t -93.69 108.11 20.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 N-CA-C 108.434 -0.95 . . . . 54.25 108.434 179.127 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.401 ' HG3' ' HB3' ' A' ' 20' ' ' GLU . 39.4 ttmt -108.07 137.81 45.42 Favored 'General case' 0 C--O 1.224 -0.255 0 C-N-CA 124.748 1.219 . . . . 72.120000000000005 107.718 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.484 HD13 HG13 ' A' ' 48' ' ' ILE . 11.9 tt -143.98 136.57 23.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 CA-C-N 118.405 0.548 . . . . 73.349999999999994 110.966 176.642 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 28.0 m -101.9 120.48 40.47 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 108.66 -0.867 . . . . 71.120000000000005 108.66 173.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.614 ' SG ' HG23 ' A' ' 48' ' ' ILE . 0.9 OUTLIER -157.58 137.96 12.8 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.467 1.107 . . . . 75.319999999999993 109.201 -178.99 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.418 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 3.1 t-20 75.89 -46.33 0.55 Allowed 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 126.107 1.763 . . . . 74.519999999999996 112.482 179.378 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 155.44 2.02 0.12 Allowed Glycine 0 CA--C 1.522 0.52 0 N-CA-C 110.949 -0.86 . . . . 73.030000000000001 110.949 -175.167 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 49.3 mtpt -119.13 162.63 18.32 Favored 'General case' 0 C--N 1.355 0.822 0 C-N-CA 123.976 0.91 . . . . 63.520000000000003 109.621 -178.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.0 m -117.74 114.91 24.01 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 108.605 -0.887 . . . . 74.219999999999999 108.605 176.075 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -101.34 100.16 10.62 Favored 'General case' 0 C--O 1.24 0.563 0 N-CA-C 106.536 -1.653 . . . . 73.430000000000007 106.536 -175.039 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.401 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 11.9 pt-20 -134.48 145.2 48.59 Favored 'General case' 0 C--O 1.243 0.724 0 C-N-CA 123.361 0.665 . . . . 64.430000000000007 110.589 -173.337 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.8 ttm180 -167.71 144.71 4.3 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.619 0.768 . . . . 61.43 109.755 -179.144 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 28.1 m -87.6 108.74 19.21 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.645 0.778 . . . . 62.219999999999999 109.484 175.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -97.81 128.45 44.46 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.778 0.831 . . . . 75.219999999999999 109.48 -178.424 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.52 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 26.8 mp0 -93.87 109.15 20.86 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 108.414 -0.958 . . . . 74.439999999999998 108.414 -176.34 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 78.5 mt -120.04 106.73 12.27 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.533 1.133 . . . . 55.210000000000001 109.469 -175.243 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.515 ' HA ' ' HA ' ' A' ' 5' ' ' LYS . 61.9 t80 -95.23 142.0 28.17 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 122.745 0.418 . . . . 74.019999999999996 110.312 175.087 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.484 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -148.46 149.16 31.19 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 123.43 0.692 . . . . 72.109999999999999 110.243 174.688 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.0 t -86.13 -21.89 7.41 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.043 0 C-N-CA 124.613 1.165 . . . . 23.32 109.463 175.362 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.63 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 48.2 mtp180 -131.47 141.77 49.85 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 108.025 -1.102 . . . . 72.239999999999995 108.025 171.493 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -64.45 -19.39 65.51 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 122.565 0.346 . . . . 63.149999999999999 111.027 174.727 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 -66.78 -33.36 75.46 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.284 0.634 . . . . 70.010000000000005 111.621 170.782 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.63 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 8.4 mm-40 -68.83 -25.81 64.85 Favored 'General case' 0 N--CA 1.49 1.544 0 CA-C-N 117.871 0.305 . . . . 65.420000000000002 110.47 177.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.575 HD22 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -71.37 -25.39 62.35 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 123.426 0.691 . . . . 73.439999999999998 111.146 -177.901 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.451 ' HG2' HG23 ' A' ' 80' ' ' ILE . 57.3 mtpt -56.97 -52.18 66.27 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.786 0.834 . . . . 75.140000000000001 112.28 -176.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -61.46 -35.43 77.58 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.095 0.558 . . . . 72.340000000000003 111.645 179.495 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.575 ' HD2' HD22 ' A' ' 33' ' ' LEU . 65.4 mttm -65.88 -45.33 82.45 Favored 'General case' 0 C--N 1.352 0.7 0 C-N-CA 123.573 0.749 . . . . 74.450000000000003 109.988 -178.078 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 71.9 mt -58.39 -47.7 83.01 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 124.518 1.136 . . . . 75.5 110.843 176.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -58.41 -43.02 88.47 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 123.903 0.752 . . . . 63.210000000000001 111.346 178.688 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -70.85 -41.38 71.54 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.585 0.754 . . . . 60.420000000000002 112.52 -178.481 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.455 HG23 ' O ' ' A' ' 36' ' ' LYS . 94.5 t -64.66 -42.15 94.23 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 C-N-CA 123.234 0.614 . . . . 72.230000000000004 110.46 175.591 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.637 HD21 HD11 ' A' ' 60' ' ' ILE . 35.7 mt -64.74 -48.95 72.69 Favored 'General case' 0 C--O 1.212 -0.874 0 CA-C-N 115.481 -0.781 . . . . 64.230000000000004 110.135 179.129 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -63.04 -34.65 78.04 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.18 0.592 . . . . 50.439999999999998 111.678 177.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.689 ' HG3' ' H ' ' A' ' 120' ' ' HIS . 4.3 tm-20 -68.86 -40.19 79.47 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.134 0.574 . . . . 63.43 110.079 178.321 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.41 ' HA ' ' CZ ' ' A' ' 44' ' ' ARG . 0.0 OUTLIER -76.14 -30.14 58.05 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 123.729 0.812 . . . . 74.209999999999994 111.337 179.166 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.459 ' SD ' HD12 ' A' ' 12' ' ' ILE . 87.7 mmm -91.1 -15.8 28.86 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 124.272 1.029 . . . . 74.129999999999995 112.35 -175.85 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.588 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 14.4 t70 -68.24 -50.77 28.1 Favored Pre-proline 0 CA--C 1.555 1.172 0 CA-C-O 118.247 -0.882 . . . . 73.219999999999999 112.038 -175.732 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.49 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 38.8 Cg_endo -63.08 -23.47 73.54 Favored 'Trans proline' 0 C--N 1.391 2.786 0 C-N-CA 121.812 1.675 . . . . 53.240000000000002 111.837 176.339 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.614 HG23 ' SG ' ' A' ' 14' ' ' CYS . 49.1 mm -71.12 -30.34 40.38 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 C-N-CA 124.788 1.235 . . . . 55.140000000000001 111.149 -177.244 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.588 ' HE2' ' HA ' ' A' ' 46' ' ' ASP . 45.7 mtmt -73.31 -36.99 66.33 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 122.87 0.468 . . . . 75.129999999999995 109.994 176.126 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.5 tmmm? -67.03 -31.48 72.05 Favored 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 123.398 0.679 . . . . 73.329999999999998 110.476 173.517 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 81.8 mt -72.6 -36.45 68.11 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 122.671 0.388 . . . . 64.510000000000005 110.021 173.754 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.57 40.51 18.37 Favored Glycine 0 C--N 1.345 1.083 0 CA-C-N 115.672 -0.695 . . . . 74.040000000000006 113.421 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.418 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 94.8 m -77.21 109.77 11.36 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 109.493 -0.558 . . . . 60.439999999999998 109.493 174.4 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -63.53 -51.46 65.37 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.978 0.911 . . . . 61.009999999999998 110.697 -174.516 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 68.5 ttt180 -111.36 133.5 53.63 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 109.313 -0.625 . . . . 74.420000000000002 109.313 174.007 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 31.5 m -126.34 146.11 32.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 124.002 0.921 . . . . 73.239999999999995 109.455 178.313 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 24.7 ttm180 -110.0 104.8 13.75 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 108.663 -0.866 . . . . 73.099999999999994 108.663 173.064 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.418 HD11 ' SD ' ' A' ' 45' ' ' MET . 38.0 mt -101.34 105.91 18.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 N-CA-C 108.697 -0.853 . . . . 73.230000000000004 108.697 -179.248 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 11.7 t -103.85 104.7 14.74 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 108.928 -0.767 . . . . 61.240000000000002 108.928 178.676 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.637 HD11 HD21 ' A' ' 41' ' ' LEU . 73.9 mt -96.51 112.43 28.63 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 124.266 1.026 . . . . 75.319999999999993 108.921 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 70.4 ttt180 -101.08 120.08 39.68 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 108.019 -1.104 . . . . 73.430000000000007 108.019 174.202 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 4.1 p -95.21 144.67 9.46 Favored 'Isoleucine or valine' 0 C--O 1.243 0.729 0 N-CA-C 108.433 -0.951 . . . . 74.140000000000001 108.433 -178.086 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.408 ' HB3' ' H ' ' A' ' 7' ' ' GLU . 60.0 tttm -92.05 144.17 25.72 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 109.137 -0.69 . . . . 70.310000000000002 109.137 177.338 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -117.32 154.87 30.51 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 124.162 0.985 . . . . 75.109999999999999 109.112 -167.725 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 36.7 t -64.54 -56.0 16.88 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 124.311 1.007 . . . . 74.120000000000005 111.598 -175.581 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -149.26 159.63 44.09 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 115.474 -0.784 . . . . 74.510000000000005 109.867 -167.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.73 -20.26 65.93 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 114.091 1.145 . . . . 61.43 114.091 -174.758 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -88.05 -31.05 19.48 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.175 0.59 . . . . 72.129999999999995 110.247 170.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 46.0 mm-40 -79.72 -11.25 59.85 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 114.913 -1.04 . . . . 74.549999999999997 113.298 -177.576 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -38.5 -51.45 1.59 Allowed 'General case' 0 N--CA 1.5 2.064 0 C-N-CA 124.381 1.072 . . . . 62.5 112.561 -179.358 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -80.93 -29.63 35.46 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 114.215 -1.357 . . . . 74.099999999999994 111.814 -172.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 56.7 tptt -74.46 -35.82 63.33 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.679 0.792 . . . . 72.409999999999997 110.458 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -84.94 -29.11 25.39 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.311 0.644 . . . . 72.040000000000006 110.157 -179.03 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.26 -47.67 75.9 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 123.897 0.748 . . . . 53.299999999999997 110.602 173.21 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp -73.79 -30.28 62.66 Favored 'General case' 0 CA--C 1.551 1.005 0 CA-C-N 116.093 -0.503 . . . . 64.329999999999998 111.395 179.819 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 4.6 ttmp? -57.43 -52.24 66.16 Favored 'General case' 0 N--CA 1.487 1.412 0 CA-C-O 121.438 0.637 . . . . 74.010000000000005 109.783 168.847 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -70.8 -19.2 62.71 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-N 114.742 -1.117 . . . . 74.319999999999993 111.812 179.165 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.439 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -61.61 -43.72 98.33 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 117.942 0.337 . . . . 60.229999999999997 110.665 174.723 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.83 -44.16 77.86 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.222 0.609 . . . . 60.119999999999997 111.569 174.754 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.451 HG23 ' HG2' ' A' ' 34' ' ' LYS . 35.2 mm -61.68 -46.71 95.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 C-N-CA 124.172 0.989 . . . . 74.430000000000007 111.476 -178.048 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.567 HD13 HG11 ' A' ' 102' ' ' VAL . 51.0 mt -76.53 -30.86 57.32 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.835 0.854 . . . . 74.420000000000002 111.118 -178.317 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 61.4 t30 -60.06 -39.27 85.43 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.207 0.603 . . . . 72.209999999999994 109.965 176.444 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -67.35 -43.28 81.92 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 115.104 -0.953 . . . . 60.119999999999997 111.336 175.316 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.419 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 42.8 t -64.36 -50.39 76.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 123.676 0.79 . . . . 71.310000000000002 110.676 -174.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.528 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 20.0 m-85 -66.22 -27.03 67.67 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.611 0.764 . . . . 71.25 111.239 -179.439 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.9 -35.58 78.73 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.324 0.649 . . . . 61.520000000000003 111.199 172.719 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -84.79 -1.99 57.09 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.73 0.812 . . . . 72.200000000000003 110.606 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 96.3 mt -107.21 -29.48 9.31 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.124 0.97 . . . . 71.439999999999998 110.415 176.768 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 103.44 9.28 38.9 Favored Glycine 0 C--N 1.351 1.389 0 C-N-CA 123.179 0.419 . . . . 61.340000000000003 114.121 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.528 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 27.0 m-85 -83.49 135.58 34.61 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.38 0.672 . . . . 74.219999999999999 110.052 174.777 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.416 ' O ' HG23 ' A' ' 95' ' ' VAL . 15.5 m120 -91.71 168.31 11.57 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 123.814 0.846 . . . . 74.25 110.705 -177.172 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -59.43 -30.65 68.64 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 123.982 0.913 . . . . 63.32 111.254 175.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 54.8 p -65.84 -39.56 90.91 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.175 0.99 . . . . 61.520000000000003 111.103 177.209 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -72.17 -22.9 61.22 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.558 0.743 . . . . 74.239999999999995 111.241 178.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.416 HG23 ' O ' ' A' ' 91' ' ' ASN . 88.7 t -96.36 128.38 47.61 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 C-N-CA 124.193 0.997 . . . . 62.240000000000002 110.203 -175.442 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 9.0 t -128.36 141.09 51.53 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.08 0.552 . . . . 62.409999999999997 109.885 170.233 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.439 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 59.9 m95 -111.86 136.76 50.74 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.904 0.882 . . . . 64.439999999999998 109.847 178.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -143.11 87.4 1.97 Allowed 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.494 1.118 . . . . 72.140000000000001 108.076 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 72.45 -83.65 0.55 Allowed Glycine 0 C--N 1.348 1.24 0 CA-C-N 115.28 -0.873 . . . . 73.239999999999995 113.613 176.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 29.4 p-10 -126.66 -6.4 6.3 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.145 0.978 . . . . 72.329999999999998 111.745 -175.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 25.8 m -116.18 133.08 56.42 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.641 0.776 . . . . 74.319999999999993 109.202 -176.282 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.567 HG11 HD13 ' A' ' 81' ' ' LEU . 4.8 p -115.39 123.05 70.52 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 C-N-CA 124.057 0.943 . . . . 74.510000000000005 108.947 176.491 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 61.0 m -107.08 114.83 29.14 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 108.633 -0.877 . . . . 44.299999999999997 108.633 176.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 49.1 t -109.11 110.73 33.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 C-N-CA 123.797 0.839 . . . . 43.130000000000003 108.786 175.011 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -95.56 111.95 23.77 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 107.971 -1.122 . . . . 52.32 107.971 173.313 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -118.72 177.73 16.5 Favored Glycine 0 C--O 1.24 0.526 0 O-C-N 123.801 0.688 . . . . 43.119999999999997 112.24 -176.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -122.86 143.49 49.84 Favored 'General case' 0 C--O 1.243 0.721 0 C-N-CA 123.804 0.842 . . . . 75.420000000000002 108.946 177.418 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.511 HD23 ' HA ' ' A' ' 49' ' ' LYS . 10.3 mp -78.46 169.73 17.79 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 115.5 -0.773 . . . . 74.409999999999997 110.668 176.922 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 61.8 26.74 16.26 Favored 'General case' 0 CA--C 1.558 1.281 0 O-C-N 124.294 0.996 . . . . 52.549999999999997 110.572 178.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -59.65 -73.94 0.42 Allowed Glycine 0 C--N 1.351 1.411 0 CA-C-N 115.562 -0.745 . . . . 74.400000000000006 112.532 -178.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 92.1 t -142.15 -61.95 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 N-CA-C 106.101 -1.815 . . . . 72.120000000000005 106.101 168.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 177.23 136.61 0.07 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 126.381 1.872 . . . . 70.209999999999994 107.181 176.122 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 52.3 mt -72.79 -66.47 0.66 Allowed 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 106.733 -1.581 . . . . 72.409999999999997 106.733 170.255 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -158.8 -176.7 6.03 Favored 'General case' 0 CA--C 1.55 0.965 0 CA-C-N 113.58 -1.645 . . . . 62.130000000000003 106.923 162.598 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 64.5 m80 -68.97 158.24 35.1 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 122.709 0.404 . . . . 73.450000000000003 110.54 176.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 47.5 t60 -62.61 119.29 8.93 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.367 0.667 . . . . 74.140000000000001 110.837 179.395 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 17.2 t-80 -109.55 139.41 44.59 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 106.076 -1.824 . . . . 44.109999999999999 106.076 161.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 58.1 t60 -55.12 -51.65 65.76 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.913 0.885 . . . . 74.219999999999999 112.588 -169.299 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 45.4 t-80 -159.84 161.61 34.52 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 115.352 -0.84 . . . . 74.010000000000005 109.383 -176.002 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' HIS . . . . . 0.689 ' H ' ' HG3' ' A' ' 43' ' ' GLU . 41.4 t-80 . . . . . 0 C--O 1.248 0.98 0 C-N-CA 123.761 0.824 . . . . 74.129999999999995 108.872 173.108 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mpt? . . . . . 0 N--CA 1.482 1.15 0 CA-C-O 120.904 0.383 . . . . 70.329999999999998 110.714 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.8 m -75.3 166.41 23.66 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 123.834 0.854 . . . . 70.140000000000001 109.861 170.282 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 69.89 54.38 12.15 Favored Glycine 0 C--N 1.346 1.123 0 N-CA-C 110.784 -0.926 . . . . 53.450000000000003 110.784 -173.647 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.2 tptp -105.73 137.38 43.69 Favored 'General case' 0 C--O 1.24 0.602 0 C-N-CA 123.567 0.747 . . . . 74.319999999999993 110.588 -171.616 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -86.18 121.9 29.42 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 108.455 -0.943 . . . . 43.409999999999997 108.455 169.412 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.461 HG23 HG23 ' A' ' 62' ' ' VAL . 0.9 OUTLIER -113.17 137.62 45.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 C-N-CA 124.662 1.185 . . . . 74.109999999999999 108.108 177.795 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -104.25 112.11 25.0 Favored 'General case' 0 C--O 1.242 0.678 0 N-CA-C 108.181 -1.044 . . . . 75.310000000000002 108.181 171.295 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 62.3 t -96.16 106.08 17.88 Favored 'Isoleucine or valine' 0 C--N 1.345 0.373 0 C-N-CA 125.141 1.376 . . . . 72.430000000000007 107.98 -176.661 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -96.81 99.81 11.37 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 108.063 -1.088 . . . . 72.329999999999998 108.063 -172.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.8 t -99.15 112.0 30.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 124.115 0.966 . . . . 70.209999999999994 109.726 -174.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.486 ' HB3' ' HB3' ' A' ' 59' ' ' SER . 26.6 ttpp -118.56 103.85 10.11 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 107.874 -1.158 . . . . 72.140000000000001 107.874 177.604 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.441 HD13 HG13 ' A' ' 48' ' ' ILE . 14.6 tt -113.94 129.84 69.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 123.441 0.696 . . . . 74.239999999999995 110.319 -173.38 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 84.8 m -97.82 117.8 32.94 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 109.394 -0.595 . . . . 71.530000000000001 109.394 174.298 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.744 ' SG ' HG23 ' A' ' 48' ' ' ILE . 49.1 t -129.48 118.18 21.69 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.332 1.053 . . . . 52.119999999999997 109.171 -178.581 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.569 ' HB2' ' SG ' ' A' ' 53' ' ' CYS . 6.4 t-20 74.3 -1.28 3.12 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 125.341 1.456 . . . . 74.450000000000003 112.263 170.338 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 123.41 -6.02 9.27 Favored Glycine 0 C--N 1.351 1.368 0 CA-C-O 119.874 -0.404 . . . . 71.049999999999997 113.415 -178.263 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -108.5 147.38 31.79 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.398 0.679 . . . . 64.409999999999997 110.242 179.297 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 40.2 m -112.31 115.45 28.77 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.717 0.807 . . . . 72.099999999999994 110.057 -176.774 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -110.79 112.74 24.82 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.446 1.098 . . . . 74.239999999999995 109.066 -175.406 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -112.93 140.51 47.68 Favored 'General case' 0 N--CA 1.485 1.286 0 CA-C-N 118.329 0.513 . . . . 63.409999999999997 110.537 -179.517 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 17.3 tpt180 -161.23 120.46 2.54 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.357 0.663 . . . . 74.420000000000002 110.059 -175.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 61.8 m -89.27 116.32 27.4 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.551 0.74 . . . . 74.329999999999998 110.013 174.201 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -98.27 136.82 37.91 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.124 0.97 . . . . 71.140000000000001 108.764 176.138 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 25.6 mp0 -101.78 111.71 24.06 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 108.823 -0.806 . . . . 73.319999999999993 108.823 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.428 ' HB2' HG13 ' A' ' 6' ' ' VAL . 89.9 mt -112.52 161.09 17.15 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.061 0.944 . . . . 75.519999999999996 109.893 -179.494 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 86.1 t80 -151.95 129.38 11.36 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 108.752 -0.833 . . . . 72.409999999999997 108.752 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.546 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -150.89 146.21 26.15 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 122.611 0.364 . . . . 64.030000000000001 111.171 -179.311 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 48.6 t -65.66 -52.41 50.89 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 O-C-N 124.506 1.129 . . . . 74.150000000000006 109.802 175.767 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 -113.56 160.99 17.94 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 115.371 -0.832 . . . . 70.340000000000003 110.167 -177.367 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.475 ' HB2' HG13 ' A' ' 80' ' ' ILE . 21.6 p-10 -69.59 -28.42 65.94 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.489 0.715 . . . . 71.040000000000006 109.969 173.518 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -55.09 -39.44 69.3 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.398 1.079 . . . . 62.329999999999998 111.387 170.001 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.546 ' HB2' ' HB1' ' A' ' 27' ' ' ALA . 19.5 mm-40 -77.48 -20.86 53.71 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.271 -0.877 . . . . 73.010000000000005 111.677 -177.876 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.01 -27.86 64.0 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 122.682 0.393 . . . . 70.140000000000001 110.556 178.214 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 20.7 mtpp -54.14 -60.25 3.58 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.225 1.01 . . . . 64.439999999999998 112.823 -177.076 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -53.22 -33.96 55.1 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 124.392 1.077 . . . . 50.32 112.132 178.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 52.4 mttm -77.93 -37.43 47.77 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.643 0.777 . . . . 62.219999999999999 110.819 -175.182 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.558 HD13 HD23 ' A' ' 81' ' ' LEU . 93.7 mt -65.19 -40.6 94.44 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.445 0.698 . . . . 72.310000000000002 111.202 172.868 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 58.1 mtpt -59.69 -40.83 89.16 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.203 0.601 . . . . 74.450000000000003 110.637 174.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt -65.91 -53.05 44.55 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 123.562 0.539 . . . . 55.210000000000001 111.42 175.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 20.8 t -53.49 -45.15 58.0 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 C-N-CA 124.14 0.976 . . . . 63.439999999999998 112.134 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.573 HD21 HD11 ' A' ' 60' ' ' ILE . 97.2 mt -72.94 -51.28 19.06 Favored 'General case' 0 CA--C 1.54 0.577 0 O-C-N 123.58 0.55 . . . . 70.219999999999999 111.3 -178.479 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -67.1 -40.39 86.91 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 122.924 0.49 . . . . 73.219999999999999 112.006 -174.569 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -62.05 -43.27 99.19 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.576 0.35 . . . . 61.32 110.079 174.226 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.1 tpp180 -62.12 -41.99 98.78 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.531 0.732 . . . . 73.230000000000004 111.078 176.539 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.509 ' SD ' HD11 ' A' ' 58' ' ' ILE . 83.2 mtp -94.41 6.91 47.31 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 112.822 0.675 . . . . 74.200000000000003 112.822 -169.74 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -75.84 -48.82 3.62 Favored Pre-proline 0 CA--C 1.56 1.363 0 CA-C-O 118.741 -0.647 . . . . 43.329999999999998 110.444 168.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.464 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 31.4 Cg_exo -51.97 -37.76 67.99 Favored 'Trans proline' 0 C--N 1.396 3.057 0 C-N-CA 122.146 1.897 . . . . 72.209999999999994 112.72 166.905 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.744 HG23 ' SG ' ' A' ' 14' ' ' CYS . 50.6 mm -66.64 -30.47 49.82 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.35 0 C-N-CA 124.286 1.035 . . . . 74.140000000000001 111.528 -173.015 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -66.91 -45.28 78.43 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 123.399 0.679 . . . . 62.439999999999998 110.191 173.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.4 tmmm? -61.75 -34.74 76.39 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 114.695 -1.138 . . . . 65.140000000000001 111.193 176.167 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.539 HD12 HD13 ' A' ' 48' ' ' ILE . 85.3 mt -72.39 -29.03 63.37 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.192 0.597 . . . . 75.049999999999997 110.811 176.669 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 68.93 83.23 0.17 Allowed Glycine 0 C--N 1.353 1.498 0 O-C-N 123.976 0.798 . . . . 43.140000000000001 112.188 174.211 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.569 ' SG ' ' HB2' ' A' ' 15' ' ' ASN . 89.5 m -123.98 134.51 53.46 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.272 0.629 . . . . 44.310000000000002 110.701 -174.209 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -63.66 -65.5 0.67 Allowed 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.554 0.741 . . . . 72.109999999999999 110.156 177.075 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 31.9 ttt180 -127.99 126.94 42.33 Favored 'General case' 0 C--O 1.241 0.616 0 C-N-CA 124.019 0.928 . . . . 70.519999999999996 108.577 -176.021 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 34.0 m -115.91 140.54 37.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 C-N-CA 123.155 0.582 . . . . 42.229999999999997 109.664 179.192 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 24.4 ttm180 -105.96 106.89 17.61 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 108.417 -0.957 . . . . 72.019999999999996 108.417 177.449 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.509 HD11 ' SD ' ' A' ' 45' ' ' MET . 50.9 mt -93.9 114.0 29.7 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 N-CA-C 107.993 -1.114 . . . . 60.549999999999997 107.993 179.498 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.486 ' HB3' ' HB3' ' A' ' 11' ' ' LYS . 37.2 t -102.86 102.27 12.37 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.21 -1.033 . . . . 62.109999999999999 108.21 -177.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.573 HD11 HD21 ' A' ' 41' ' ' LEU . 78.9 mt -104.85 115.83 47.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 123.409 0.684 . . . . 73.150000000000006 109.555 -177.751 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -109.77 129.4 55.63 Favored 'General case' 0 C--O 1.238 0.471 0 N-CA-C 108.518 -0.919 . . . . 74.310000000000002 108.518 171.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.461 HG23 HG23 ' A' ' 6' ' ' VAL . 12.4 p -94.97 148.32 5.13 Favored 'Isoleucine or valine' 0 C--O 1.246 0.899 0 N-CA-C 108.293 -1.002 . . . . 63.109999999999999 108.293 177.106 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 24.2 ttmm -80.49 137.5 36.46 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 108.813 -0.81 . . . . 73.140000000000001 108.813 172.21 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 31.8 m170 -85.38 128.97 34.9 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.069 0.948 . . . . 74.420000000000002 110.446 -173.532 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 28.0 m -66.23 -65.79 0.63 Allowed 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.713 0.805 . . . . 71.549999999999997 111.061 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.458 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 29.6 t70 -162.53 151.98 15.66 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.758 0.823 . . . . 74.010000000000005 108.887 -178.634 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.78 -32.33 63.39 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 124.316 1.047 . . . . 42.299999999999997 113.282 -174.298 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.2 -41.9 89.53 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.054 0.541 . . . . 61.329999999999998 110.658 174.749 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -70.71 -50.03 40.73 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-N 115.157 -0.929 . . . . 74.219999999999999 111.592 -177.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.458 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 58.0 mt-10 -43.53 -34.56 1.41 Allowed 'General case' 0 N--CA 1.501 2.081 0 C-N-CA 126.026 1.73 . . . . 75.209999999999994 115.431 -163.503 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -65.44 -51.27 61.38 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.773 0.829 . . . . 73.25 110.77 -178.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -81.93 -29.93 32.04 Favored 'General case' 0 CA--C 1.552 1.054 0 CA-C-N 115.103 -0.953 . . . . 72.400000000000006 111.053 177.478 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -68.84 -39.08 80.13 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 124.509 1.124 . . . . 73.430000000000007 110.3 -173.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.08 -49.69 69.06 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 115.517 -0.765 . . . . 72.310000000000002 111.098 177.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -59.97 -40.57 89.51 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.424 1.09 . . . . 72.430000000000007 111.503 177.248 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 68.6 tttt -64.6 -50.59 66.6 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.26 1.424 . . . . 74.040000000000006 110.543 -179.449 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -75.28 -23.69 57.44 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 115.812 -0.631 . . . . 72.049999999999997 110.266 -177.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.61 -33.41 72.62 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.584 0.753 . . . . 51.340000000000003 110.784 174.604 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.8 -40.93 83.86 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.422 0.689 . . . . 63.109999999999999 110.829 173.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.475 HG13 ' HB2' ' A' ' 30' ' ' ASP . 46.2 mm -67.86 -41.82 85.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.023 0.929 . . . . 71.329999999999998 110.794 178.614 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.558 HD23 HD13 ' A' ' 37' ' ' LEU . 42.3 mt -63.96 -47.74 79.25 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.54 0.736 . . . . 64.230000000000004 109.533 176.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -55.84 -42.95 76.55 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 124.669 1.187 . . . . 53.299999999999997 111.337 -177.194 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.449 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 43.4 mmtm -67.2 -41.59 85.56 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 115.562 -0.745 . . . . 73.319999999999993 111.33 179.291 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.444 HG21 ' HB2' ' A' ' 37' ' ' LEU . 54.4 t -64.68 -40.72 90.02 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.119 0 C-N-CA 123.378 0.671 . . . . 73.400000000000006 110.301 -178.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.534 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 19.6 m-85 -64.95 -39.99 94.34 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.265 -0.88 . . . . 75.329999999999998 110.53 177.51 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -68.11 -24.33 65.02 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.199 0.6 . . . . 65.519999999999996 111.95 176.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.449 ' HG3' ' O ' ' A' ' 83' ' ' LYS . 45.9 mt-10 -80.95 -20.94 40.88 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.651 0.78 . . . . 73.420000000000002 111.018 178.08 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.1 mt -106.68 -22.71 12.66 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 122.968 0.507 . . . . 63.420000000000002 110.923 -173.571 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 103.54 39.97 2.47 Favored Glycine 0 C--N 1.351 1.403 0 C-N-CA 123.153 0.406 . . . . 62.100000000000001 114.054 177.261 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.534 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 10.1 m-85 -112.76 134.6 54.2 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 107.432 -1.322 . . . . 74.209999999999994 107.432 169.625 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 -83.61 158.37 21.93 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.447 0.699 . . . . 62.32 110.092 -175.123 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.79 -39.66 78.04 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 124.491 1.117 . . . . 73.400000000000006 111.539 177.509 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 22.6 t -60.57 -35.64 76.56 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 124.452 1.101 . . . . 73.540000000000006 111.761 178.237 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -65.3 -26.41 68.06 Favored 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 124.222 1.009 . . . . 74.25 111.977 178.68 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.508 HG22 HG13 ' A' ' 104' ' ' VAL . 47.1 t -90.91 117.88 35.04 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 124.219 1.007 . . . . 62.119999999999997 109.174 -177.51 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 20.7 m -134.65 106.78 7.13 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.598 0.759 . . . . 52.039999999999999 109.958 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 69.3 m95 -68.97 109.95 4.2 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 122.731 0.413 . . . . 70.239999999999995 110.167 176.062 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -107.73 96.92 6.73 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 107.993 -1.114 . . . . 74.0 107.993 177.532 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 68.37 -120.32 11.51 Favored Glycine 0 C--N 1.343 0.927 0 O-C-N 123.675 0.609 . . . . 52.119999999999997 112.415 -178.394 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -79.67 -32.55 41.5 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 124.663 1.185 . . . . 73.420000000000002 110.335 -178.016 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 20.2 m -105.84 148.8 27.14 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.946 0.899 . . . . 71.450000000000003 110.129 -169.407 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.9 p -104.06 136.49 37.03 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 CA-C-O 121.274 0.559 . . . . 62.450000000000003 110.012 177.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 27.6 m -103.67 100.02 9.83 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.467 1.507 . . . . 70.530000000000001 108.198 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.508 HG13 HG22 ' A' ' 95' ' ' VAL . 42.0 t -108.71 109.6 28.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 N-CA-C 108.23 -1.026 . . . . 62.43 108.23 -179.612 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -106.49 109.58 21.54 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 109.855 -0.424 . . . . 73.409999999999997 109.855 -176.579 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -115.12 137.41 13.91 Favored Glycine 0 C--N 1.333 0.373 0 N-CA-C 110.552 -1.019 . . . . 70.540000000000006 110.552 179.163 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -87.83 139.76 30.2 Favored 'General case' 0 C--O 1.242 0.674 0 N-CA-C 108.823 -0.806 . . . . 74.209999999999994 108.823 173.028 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.72 HD11 HG22 ' A' ' 48' ' ' ILE . 36.0 mt -73.54 158.16 35.38 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-O 121.448 0.642 . . . . 72.129999999999995 111.977 -177.487 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -63.14 -35.22 79.57 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 114.246 -1.343 . . . . 71.310000000000002 110.01 164.156 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 67.87 -171.5 34.68 Favored Glycine 0 C--N 1.357 1.746 0 CA-C-N 114.96 -1.018 . . . . 74.340000000000003 112.672 -179.236 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 47.5 t 73.16 -58.14 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 C-N-CA 126.025 1.73 . . . . 74.230000000000004 112.466 175.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -54.3 103.62 0.09 Allowed 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 126.345 1.858 . . . . 74.129999999999995 112.427 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 78.4 mt -112.63 149.32 32.99 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.762 1.225 . . . . 74.120000000000005 108.498 173.16 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -70.89 148.26 47.95 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 112.183 0.438 . . . . 72.540000000000006 112.183 -173.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 9.9 t-160 -103.89 18.65 21.53 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 108.95 -0.759 . . . . 74.340000000000003 108.95 167.487 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -85.19 151.71 23.89 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.428 0.691 . . . . 63.340000000000003 110.032 175.858 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 78.2 t60 -148.84 34.65 0.76 Allowed 'General case' 0 N--CA 1.48 1.068 0 CA-C-O 122.22 1.01 . . . . 63.420000000000002 108.313 175.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 18.4 t60 -69.03 -20.64 64.13 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 114.958 -1.019 . . . . 72.439999999999998 110.331 178.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 63.2 t-80 -62.22 115.71 4.38 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.984 0.914 . . . . 75.0 110.456 173.524 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 7.7 m170 . . . . . 0 C--O 1.246 0.916 0 C-N-CA 124.596 1.158 . . . . 62.539999999999999 108.899 174.686 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 47.2 tpp . . . . . 0 N--CA 1.478 0.943 0 N-CA-C 110.414 -0.217 . . . . 71.349999999999994 110.414 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.5 m -73.98 83.94 1.75 Allowed 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 108.931 -0.766 . . . . 62.119999999999997 108.931 168.421 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 158.07 59.69 0.01 OUTLIER Glycine 0 CA--C 1.507 -0.425 0 N-CA-C 109.011 -1.636 . . . . 51.399999999999999 109.011 -173.406 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -87.79 124.27 33.44 Favored 'General case' 0 C--O 1.239 0.523 0 CA-C-N 114.923 -0.638 . . . . 75.310000000000002 110.788 -174.356 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 25.3 ttpt -88.49 98.61 11.73 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 107.062 -1.459 . . . . 51.340000000000003 107.062 163.816 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.546 HG23 HG23 ' A' ' 62' ' ' VAL . 0.2 OUTLIER -99.23 126.62 52.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 107.54 -1.282 . . . . 73.439999999999998 107.54 -179.745 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -102.25 113.8 27.4 Favored 'General case' 0 C--O 1.24 0.554 0 N-CA-C 108.29 -1.004 . . . . 72.340000000000003 108.29 179.437 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 64.0 t -100.67 109.18 24.68 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 C-N-CA 124.933 1.293 . . . . 74.010000000000005 108.658 -172.694 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.433 ' O ' ' HA ' ' A' ' 60' ' ' ILE . 41.7 mt-30 -96.45 98.17 10.03 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 107.7 -1.222 . . . . 44.200000000000003 107.7 -176.113 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 48.6 t -94.07 104.63 15.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 N-CA-C 108.525 -0.917 . . . . 70.5 108.525 -175.629 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.419 ' HE3' HG21 ' A' ' 18' ' ' THR . 1.7 tmtp? -111.98 102.82 11.03 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 107.573 -1.269 . . . . 62.240000000000002 107.573 -176.721 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.409 ' HA ' ' O ' ' A' ' 57' ' ' ARG . 8.7 tt -119.47 124.34 72.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 122.902 0.481 . . . . 75.230000000000004 110.451 -172.047 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 39.0 m -91.5 121.71 33.44 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.269 0.628 . . . . 51.509999999999998 109.493 178.057 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.662 ' SG ' HG23 ' A' ' 48' ' ' ILE . 1.3 t -158.43 143.13 16.13 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.709 1.204 . . . . 53.520000000000003 109.878 -177.543 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.401 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 63.3 t30 62.44 25.32 15.1 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 124.182 0.993 . . . . 71.019999999999996 111.526 172.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 85.86 -8.19 73.95 Favored Glycine 0 C--N 1.345 1.054 0 CA-C-N 115.766 -0.652 . . . . 73.239999999999995 113.498 179.572 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -108.66 169.51 8.61 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.677 0.791 . . . . 75.140000000000001 110.738 -179.287 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.419 HG21 ' HE3' ' A' ' 11' ' ' LYS . 87.0 m -115.03 123.96 50.4 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 114.905 -1.043 . . . . 62.140000000000001 108.771 171.298 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -110.28 100.77 9.59 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 107.718 -1.216 . . . . 50.329999999999998 107.718 178.151 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.7 pp20? -106.27 146.39 30.42 Favored 'General case' 0 C--O 1.242 0.704 0 N-CA-C 108.982 -0.747 . . . . 72.099999999999994 108.982 177.68 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.1 tpt180 -157.21 124.64 5.27 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 123.305 0.378 . . . . 53.140000000000001 110.204 174.546 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 44.0 m -89.17 109.57 20.42 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 108.962 -0.755 . . . . 75.450000000000003 108.962 173.546 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -98.01 135.79 39.21 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 108.814 -0.81 . . . . 54.420000000000002 108.814 178.561 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -97.12 108.69 21.47 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 107.732 -1.21 . . . . 74.040000000000006 107.732 175.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 94.7 mt -115.24 137.83 51.6 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 108.233 -1.025 . . . . 52.340000000000003 108.233 -178.291 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -132.18 132.55 43.28 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 109.334 -0.617 . . . . 73.209999999999994 109.334 -175.703 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -156.27 149.86 24.76 Favored 'General case' 0 C--O 1.239 0.509 0 C-N-CA 123.323 0.649 . . . . 61.43 109.626 173.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 51.7 t -63.41 -37.69 80.2 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 C-N-CA 124.215 1.006 . . . . 71.230000000000004 109.869 174.691 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 53.4 mtt180 -130.12 145.31 51.69 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.442 0.697 . . . . 74.319999999999993 110.848 175.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 35.2 p-10 -69.53 -23.26 63.56 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.063 0.945 . . . . 73.0 111.333 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -59.26 -37.75 78.4 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.224 0.61 . . . . 73.329999999999998 110.731 170.568 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -81.94 -22.24 36.81 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.486 0.715 . . . . 75.439999999999998 111.348 179.26 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.576 HD22 ' HD2' ' A' ' 36' ' ' LYS . 0.7 OUTLIER -70.4 -22.55 62.73 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.411 1.084 . . . . 75.439999999999998 110.265 178.189 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.568 ' HG2' HG23 ' A' ' 80' ' ' ILE . 50.1 mtpt -52.79 -53.59 46.13 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 124.004 0.922 . . . . 64.409999999999997 113.168 -178.495 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -61.1 -30.14 70.18 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 123.41 0.444 . . . . 63.240000000000002 111.717 -177.017 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.576 ' HD2' HD22 ' A' ' 33' ' ' LEU . 58.0 mttm -67.58 -45.35 75.78 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 123.503 0.502 . . . . 51.32 110.355 174.797 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.438 HD13 HD23 ' A' ' 81' ' ' LEU . 95.8 mt -58.63 -44.77 90.12 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.735 0.814 . . . . 74.120000000000005 111.439 177.124 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.525 ' HG2' HG13 ' A' ' 84' ' ' VAL . 51.2 mtpt -61.25 -47.45 86.0 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 123.764 0.665 . . . . 75.409999999999997 111.044 -178.813 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -62.42 -52.46 63.48 Favored 'General case' 0 N--CA 1.476 0.83 0 O-C-N 123.607 0.567 . . . . 64.439999999999998 110.982 178.094 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 22.4 t -58.0 -42.18 82.08 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 C-N-CA 124.894 1.278 . . . . 72.0 112.52 -178.774 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.454 HD21 HD11 ' A' ' 60' ' ' ILE . 39.4 mt -70.35 -37.75 74.7 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.341 0.657 . . . . 61.32 110.965 179.688 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -68.06 -35.76 78.73 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 119.426 -0.321 . . . . 55.340000000000003 111.473 175.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -72.93 -45.29 58.93 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.373 0.669 . . . . 73.340000000000003 110.818 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.7 tpm_? -60.25 -41.39 93.11 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.86 0.864 . . . . 73.239999999999995 110.235 176.022 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.436 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 64.4 mtp -92.67 2.81 56.52 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 115.64 -0.709 . . . . 61.409999999999997 112.821 -178.222 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -65.47 -49.57 62.11 Favored Pre-proline 0 CA--C 1.553 1.07 0 CA-C-O 118.603 -0.713 . . . . 71.530000000000001 111.404 178.565 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.49 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 37.9 Cg_endo -63.69 -27.42 68.66 Favored 'Trans proline' 0 C--N 1.389 2.699 0 C-N-CA 121.391 1.394 . . . . 55.219999999999999 111.756 172.366 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.662 HG23 ' SG ' ' A' ' 14' ' ' CYS . 45.0 mm -74.19 -34.06 36.7 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.02 0 C-N-CA 124.149 0.979 . . . . 72.430000000000007 110.729 -173.534 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.638 ' HA ' HD21 ' A' ' 108' ' ' LEU . 93.0 mttt -73.9 -31.36 63.07 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.276 0.63 . . . . 73.5 110.086 176.856 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.8 tmmm? -76.14 -29.06 57.66 Favored 'General case' 0 CA--C 1.548 0.903 0 CA-C-N 115.108 -0.951 . . . . 73.310000000000002 109.654 175.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 92.1 mt -71.89 -32.28 67.26 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 109.08 -0.711 . . . . 54.219999999999999 109.08 173.805 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.38 40.32 33.57 Favored Glycine 0 C--N 1.349 1.253 0 CA-C-N 115.834 -0.621 . . . . 72.420000000000002 112.369 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.401 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 68.5 m -71.44 97.11 1.58 Allowed 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 109.415 -0.587 . . . . 73.340000000000003 109.415 174.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -50.9 -39.7 55.03 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 125.792 1.637 . . . . 73.409999999999997 112.539 -169.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 9.5 ttp180 -134.21 130.76 37.68 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 107.796 -1.187 . . . . 53.210000000000001 107.796 179.154 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 23.0 m -124.86 145.19 32.55 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 C-N-CA 122.897 0.479 . . . . 71.439999999999998 110.669 -178.784 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.512 ' HG3' HG23 ' A' ' 103' ' ' THR . 21.1 ttt180 -104.39 108.55 20.02 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 108.237 -1.024 . . . . 74.430000000000007 108.237 170.857 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 37.7 mt -101.62 104.25 16.08 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 N-CA-C 108.253 -1.017 . . . . 74.219999999999999 108.253 176.033 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 70.3 m -101.91 103.48 14.15 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 107.839 -1.171 . . . . 75.120000000000005 107.839 177.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.454 HD11 HD21 ' A' ' 41' ' ' LEU . 61.5 mt -98.93 130.25 48.09 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 123.258 0.623 . . . . 70.230000000000004 109.83 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 27.8 ttm-85 -115.92 120.04 37.89 Favored 'General case' 0 C--O 1.239 0.506 0 N-CA-C 107.726 -1.212 . . . . 70.010000000000005 107.726 174.132 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.546 HG23 HG23 ' A' ' 6' ' ' VAL . 7.6 p -94.73 139.09 19.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 N-CA-C 108.636 -0.875 . . . . 61.520000000000003 108.636 -178.856 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -81.08 121.56 26.24 Favored 'General case' 0 C--O 1.24 0.596 0 N-CA-C 108.904 -0.776 . . . . 72.129999999999995 108.904 -177.005 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -95.19 149.99 20.7 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.626 0.77 . . . . 71.019999999999996 110.35 -176.363 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 23.5 m -77.32 -44.41 29.66 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.2 1.0 . . . . 71.230000000000004 111.455 -178.575 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -156.39 158.0 36.59 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.189 0.596 . . . . 72.430000000000007 110.473 -174.08 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.52 -44.15 89.44 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 124.599 1.16 . . . . 74.329999999999998 112.984 -176.353 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -75.6 -22.26 57.07 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 122.9 0.48 . . . . 72.129999999999995 110.892 178.085 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -84.6 -17.38 38.92 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 118.894 -0.574 . . . . 74.239999999999995 112.034 178.099 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -57.35 -44.01 83.94 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.096 0.558 . . . . 63.43 111.785 -179.318 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.75 -33.98 76.28 Favored 'General case' 0 N--CA 1.479 1.018 0 O-C-N 124.001 0.813 . . . . 73.230000000000004 111.17 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -70.55 -59.42 2.85 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 109.524 -0.547 . . . . 51.310000000000002 109.524 176.833 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -63.4 -30.21 71.37 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.055 1.342 . . . . 64.120000000000005 112.784 -173.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.34 -55.63 15.02 Favored 'General case' 0 C--O 1.213 -0.841 0 N-CA-C 109.313 -0.625 . . . . 73.319999999999993 109.313 179.041 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 5.5 tmtm? -62.24 -43.8 98.0 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 125.241 1.416 . . . . 64.239999999999995 110.711 179.265 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 60.3 tttm -64.1 -55.44 21.97 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.427 1.491 . . . . 73.450000000000003 111.637 -175.589 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -75.04 -19.12 60.18 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 115.207 -0.906 . . . . 42.32 110.603 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.15 -43.18 99.03 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 122.887 0.475 . . . . 73.439999999999998 110.89 172.324 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.463 ' O ' ' HG2' ' A' ' 83' ' ' LYS . . . -60.1 -41.92 93.58 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 124.0 0.812 . . . . 60.200000000000003 110.482 176.22 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.568 HG23 ' HG2' ' A' ' 34' ' ' LYS . 42.8 mm -63.09 -50.64 78.58 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 124.385 1.074 . . . . 64.319999999999993 111.604 178.549 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.438 HD23 HD13 ' A' ' 37' ' ' LEU . 34.1 mt -64.35 -43.36 94.8 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.279 0.632 . . . . 72.319999999999993 110.315 -179.198 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 60.8 t30 -59.5 -40.08 85.91 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 124.505 1.122 . . . . 73.5 110.854 -177.359 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.463 ' HG2' ' O ' ' A' ' 79' ' ' ALA . 74.7 mmtt -69.26 -41.86 76.36 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 115.588 -0.733 . . . . 73.140000000000001 111.213 176.237 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.55 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 37.4 t -62.11 -50.64 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 123.343 0.657 . . . . 72.239999999999995 109.884 -178.839 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.471 ' CE2' HG21 ' A' ' 104' ' ' VAL . 28.3 m-85 -61.28 -36.19 79.37 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.099 0.96 . . . . 72.409999999999997 111.544 178.736 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.83 -31.91 73.01 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.426 0.691 . . . . 73.420000000000002 111.449 175.242 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -85.39 -12.86 51.1 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.139 0.976 . . . . 65.209999999999994 111.117 178.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 54.6 mt -98.69 0.24 44.23 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 122.783 0.433 . . . . 75.549999999999997 110.11 -178.535 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 96.13 -1.62 62.97 Favored Glycine 0 C--N 1.35 1.355 0 O-C-N 123.443 0.464 . . . . 35.420000000000002 113.374 177.677 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -82.25 140.34 33.71 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 109.603 -0.517 . . . . 72.150000000000006 109.603 178.814 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -70.36 147.33 49.71 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.062 0.545 . . . . 72.310000000000002 110.093 178.348 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -50.67 -55.99 13.97 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 125.288 1.435 . . . . 73.409999999999997 111.515 178.524 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 11.6 t -59.37 -19.92 50.67 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 124.287 1.035 . . . . 72.140000000000001 113.543 -174.035 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -74.09 -19.07 60.71 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.104 0.561 . . . . 72.140000000000001 112.139 -179.077 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.502 ' HA ' HG22 ' A' ' 104' ' ' VAL . 49.0 t -74.29 101.2 1.69 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 N-CA-C 107.058 -1.46 . . . . 75.010000000000005 107.058 175.62 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 8.1 m -111.43 94.16 4.83 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 109.496 -0.557 . . . . 65.239999999999995 109.496 -172.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 65.7 m95 -72.04 107.43 4.74 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 109.003 -0.74 . . . . 73.230000000000004 109.003 174.346 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -101.63 75.57 1.59 Allowed 'General case' 0 C--O 1.238 0.478 0 C-N-CA 124.556 1.143 . . . . 74.420000000000002 108.402 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 64.9 -88.14 0.08 OUTLIER Glycine 0 C--N 1.346 1.092 0 CA-C-N 114.988 -1.005 . . . . 72.010000000000005 112.789 -178.602 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -82.97 -61.3 1.9 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.461 1.105 . . . . 34.109999999999999 109.779 -178.737 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 11.5 m -102.5 144.26 31.17 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 114.947 -1.024 . . . . 55.100000000000001 110.302 -167.001 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 6.3 p -103.44 120.05 52.87 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 C-N-CA 123.032 0.533 . . . . 74.409999999999997 110.255 -178.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.512 HG23 ' HG3' ' A' ' 57' ' ' ARG . 52.5 m -99.72 110.61 23.0 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.453 1.101 . . . . 73.329999999999998 108.812 177.862 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.502 HG22 ' HA ' ' A' ' 95' ' ' VAL . 46.2 t -112.41 112.66 41.43 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 124.266 1.026 . . . . 64.409999999999997 108.381 -176.843 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -92.38 114.34 26.87 Favored 'General case' 0 C--O 1.24 0.599 0 N-CA-C 109.206 -0.664 . . . . 73.239999999999995 109.206 -179.283 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -107.79 137.96 14.32 Favored Glycine 0 C--N 1.342 0.872 0 CA-C-N 115.972 -0.558 . . . . 64.420000000000002 112.981 -176.009 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 23.6 tm0? -85.59 117.48 24.51 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 107.98 -1.118 . . . . 73.230000000000004 107.98 171.364 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.638 HD21 ' HA ' ' A' ' 49' ' ' LYS . 8.6 tt -118.58 140.56 49.7 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.841 1.256 . . . . 51.299999999999997 107.806 -179.252 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -142.55 120.87 12.32 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 121.047 0.451 . . . . 74.420000000000002 111.652 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -111.91 78.74 0.25 Allowed Glycine 0 C--N 1.343 0.927 0 N-CA-C 110.531 -1.028 . . . . 73.140000000000001 110.531 174.308 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 82.9 t -53.78 -35.63 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 C-N-CA 124.458 1.103 . . . . 73.420000000000002 111.621 -176.062 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -126.8 99.83 5.92 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 108.016 -1.105 . . . . 64.430000000000007 108.016 174.721 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 79.6 mt -82.3 106.95 14.6 Favored 'General case' 0 C--O 1.242 0.71 0 C-N-CA 123.093 0.557 . . . . 74.209999999999994 110.001 178.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.81 166.82 22.46 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 115.081 -0.963 . . . . 72.120000000000005 110.789 178.671 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 43.1 p-80 -158.78 71.69 0.55 Allowed 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 121.773 0.797 . . . . 63.409999999999997 109.951 177.386 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 56.0 p-80 -68.85 122.14 18.01 Favored 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 107.571 -1.27 . . . . 73.109999999999999 107.571 170.49 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -47.98 83.73 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 125.52 1.528 . . . . 75.340000000000003 114.828 -159.312 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 67.2 m-70 -147.36 -162.14 1.48 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 126.157 1.783 . . . . 72.530000000000001 107.917 176.126 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 16.3 p-80 -152.61 54.45 0.79 Allowed 'General case' 0 N--CA 1.479 0.989 0 CA-C-O 121.874 0.845 . . . . 62.0 110.089 173.767 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 . . . . . 0 N--CA 1.484 1.231 0 C-N-CA 123.84 0.856 . . . . 72.129999999999995 109.302 178.257 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 mmt . . . . . 0 N--CA 1.483 1.187 0 CA-C-O 120.738 0.304 . . . . 42.030000000000001 110.553 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.6 m -71.7 -25.63 62.17 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 123.672 0.789 . . . . 73.120000000000005 110.301 174.714 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -99.16 132.04 10.78 Favored Glycine 0 C--N 1.34 0.781 0 CA-C-N 115.582 -0.736 . . . . 55.409999999999997 111.422 172.054 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.4 tmtm? -124.49 131.63 53.49 Favored 'General case' 0 C--O 1.243 0.716 0 N-CA-C 107.18 -1.415 . . . . 74.200000000000003 107.18 -178.585 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -71.96 101.39 2.68 Favored 'General case' 0 C--N 1.351 0.657 0 CA-C-O 121.192 0.52 . . . . 52.100000000000001 109.612 178.38 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.3 p -100.35 150.23 5.64 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 124.129 0.972 . . . . 75.239999999999995 109.805 -178.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -100.5 113.61 26.53 Favored 'General case' 0 C--O 1.239 0.536 0 N-CA-C 108.463 -0.94 . . . . 71.340000000000003 108.463 172.101 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.413 HG21 HD12 ' A' ' 25' ' ' LEU . 88.8 t -101.39 107.49 21.54 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 124.833 1.253 . . . . 43.100000000000001 108.688 -177.21 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -94.93 101.08 12.83 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 107.862 -1.162 . . . . 75.209999999999994 107.862 -177.396 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 92.2 t -96.14 111.07 25.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 N-CA-C 108.907 -0.775 . . . . 51.520000000000003 108.907 -177.563 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.3 ttmm -107.49 102.92 12.15 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.265 1.026 . . . . 44.130000000000003 108.329 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.418 HD11 HG21 ' A' ' 48' ' ' ILE . 15.2 tt -111.11 121.52 63.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 CA-C-O 121.3 0.571 . . . . 70.310000000000002 110.515 -177.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 30.2 m -95.16 119.78 34.25 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.031 0.933 . . . . 73.209999999999994 109.364 178.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.675 ' SG ' HG23 ' A' ' 48' ' ' ILE . 21.7 t -150.72 134.98 16.97 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.926 1.29 . . . . 64.439999999999998 108.835 -175.405 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.572 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 4.0 t30 65.56 29.87 10.85 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 125.014 1.326 . . . . 73.230000000000004 110.473 177.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.19 0.03 75.63 Favored Glycine 0 C--N 1.353 1.52 0 CA-C-N 115.487 -0.779 . . . . 74.239999999999995 113.879 -178.343 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -112.71 164.54 13.24 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.918 0.887 . . . . 74.400000000000006 110.645 -177.151 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 82.3 m -115.84 119.86 37.37 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.569 0.748 . . . . 62.450000000000003 110.487 176.581 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -109.93 120.75 43.45 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 107.115 -1.439 . . . . 73.329999999999998 107.115 176.678 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -143.36 156.46 44.69 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 118.433 0.56 . . . . 74.310000000000002 111.994 -177.451 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 39.3 ttp180 -166.49 134.9 2.85 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-N 114.9 -1.045 . . . . 73.219999999999999 108.721 -174.245 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 57.4 m -91.62 118.6 30.77 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.729 0.812 . . . . 73.109999999999999 109.813 178.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 67.7 m-85 -100.41 137.57 38.65 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.203 1.001 . . . . 73.010000000000005 109.041 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -100.18 107.89 19.87 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 106.776 -1.565 . . . . 73.120000000000005 106.776 173.688 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.413 HD12 HG21 ' A' ' 8' ' ' VAL . 67.3 mt -111.23 98.28 7.39 Favored 'General case' 0 C--O 1.239 0.513 0 C-N-CA 123.514 0.726 . . . . 65.510000000000005 109.304 -175.225 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 68.5 t80 -92.36 140.59 29.44 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 115.568 -0.742 . . . . 73.109999999999999 109.464 172.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.553 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -141.5 171.62 13.81 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.883 0.873 . . . . 71.319999999999993 109.498 178.078 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 48.1 t -101.81 -28.65 3.14 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 C-N-CA 123.255 0.622 . . . . 73.040000000000006 109.455 173.349 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.587 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 95.2 mtt180 -130.86 174.24 10.17 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.941 0.897 . . . . 74.109999999999999 109.745 176.567 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.454 ' HB3' ' HE3' ' A' ' 76' ' ' LYS . 14.0 p-10 -72.46 -39.18 67.95 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.549 0.74 . . . . 74.340000000000003 109.91 173.817 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -64.11 -26.72 68.66 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.089 0.956 . . . . 72.439999999999998 111.455 -178.588 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.587 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 38.2 mm-40 -67.84 -32.74 73.48 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.642 0.777 . . . . 71.430000000000007 111.293 178.632 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.404 ' HA ' ' HD2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -67.67 -20.08 65.26 Favored 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 123.759 0.824 . . . . 64.010000000000005 110.689 -177.391 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.434 ' HE2' ' HB3' ' A' ' 34' ' ' LYS . 36.2 mtpt -56.83 -61.22 2.59 Favored 'General case' 0 C--N 1.362 1.15 0 C-N-CA 123.2 0.6 . . . . 64.129999999999995 112.344 179.577 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -57.46 -31.84 66.34 Favored 'General case' 0 N--CA 1.481 1.122 0 O-C-N 124.0 0.812 . . . . 55.409999999999997 111.657 -176.826 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.404 ' HD2' ' HA ' ' A' ' 33' ' ' LEU . 65.9 mttm -67.13 -47.31 71.47 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.907 0.883 . . . . 75.540000000000006 110.29 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.533 HD13 HD23 ' A' ' 81' ' ' LEU . 97.2 mt -63.9 -48.17 77.68 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.72 0.808 . . . . 70.430000000000007 111.916 177.242 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -60.25 -41.14 92.56 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.605 0.762 . . . . 73.209999999999994 111.514 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.426 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 30.2 mmmt -66.93 -51.89 49.7 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 122.611 0.365 . . . . 64.239999999999995 111.195 175.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 20.6 t -56.02 -44.11 77.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 C-N-CA 123.381 0.672 . . . . 70.120000000000005 111.578 -179.078 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 82.4 mt -69.69 -52.62 24.06 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.051 0.541 . . . . 75.019999999999996 110.993 -179.009 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -63.97 -42.74 97.15 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 113.196 0.813 . . . . 71.299999999999997 113.196 -177.313 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 23.2 mm-40 -67.44 -46.14 73.97 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 122.223 0.209 . . . . 72.430000000000007 110.59 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 36.1 tpt85 -70.08 -35.15 73.98 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 122.647 0.379 . . . . 65.25 111.518 -176.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.42 ' SD ' HD11 ' A' ' 58' ' ' ILE . 60.4 mtp -86.93 -7.79 57.85 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 113.11 0.782 . . . . 71.200000000000003 113.11 -176.342 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.4 ' HA ' ' HD3' ' A' ' 49' ' ' LYS . 24.2 t70 -61.49 -48.13 91.43 Favored Pre-proline 0 CA--C 1.569 1.683 0 CA-C-O 118.843 -0.599 . . . . 60.130000000000003 111.608 177.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -68.92 -19.17 40.55 Favored 'Trans proline' 0 C--N 1.391 2.811 0 C-N-CA 122.182 1.922 . . . . 71.349999999999994 113.554 170.755 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.675 HG23 ' SG ' ' A' ' 14' ' ' CYS . 46.8 mm -74.68 -34.29 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 C-N-CA 123.624 0.77 . . . . 71.129999999999995 110.466 177.135 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.44 ' HG2' HD11 ' A' ' 108' ' ' LEU . 5.2 mtpm? -72.85 -32.71 65.65 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.924 0.889 . . . . 71.439999999999998 109.626 173.359 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.34 -27.72 68.79 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.549 1.14 . . . . 73.129999999999995 110.718 172.641 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.521 HD12 ' SG ' ' A' ' 14' ' ' CYS . 68.3 mt -76.18 -35.09 59.29 Favored 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 109.712 -0.477 . . . . 75.010000000000005 109.712 171.755 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 79.11 35.95 29.07 Favored Glycine 0 C--N 1.345 1.069 0 O-C-N 123.822 0.701 . . . . 22.539999999999999 112.374 177.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.572 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 80.8 m -69.99 99.3 1.41 Allowed 'General case' 0 C--N 1.345 0.411 0 N-CA-C 109.285 -0.635 . . . . 61.200000000000003 109.285 176.614 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 44.0 mtmt -55.16 -32.84 62.44 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.954 1.301 . . . . 64.120000000000005 112.203 -169.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -125.28 136.63 53.71 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 108.01 -1.107 . . . . 74.239999999999995 108.01 168.011 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.426 ' O ' ' HA ' ' A' ' 105' ' ' GLU . 17.1 m -121.16 134.89 63.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 123.603 0.761 . . . . 44.240000000000002 109.058 174.664 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -100.55 107.53 19.23 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 108.716 -0.846 . . . . 74.310000000000002 108.716 172.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.42 HD11 ' SD ' ' A' ' 45' ' ' MET . 35.7 mt -104.18 103.42 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 N-CA-C 108.904 -0.776 . . . . 71.5 108.904 177.881 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 51.4 m -99.91 102.73 14.21 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 108.3 -1.0 . . . . 72.420000000000002 108.3 176.73 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 73.8 mt -97.24 109.54 23.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 C-N-CA 124.021 0.928 . . . . 75.510000000000005 108.73 179.242 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -92.07 134.7 34.59 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 107.952 -1.129 . . . . 73.150000000000006 107.952 171.405 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.8 p -94.02 146.96 5.94 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 N-CA-C 106.813 -1.551 . . . . 55.539999999999999 106.813 174.822 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.5 tmtm? -80.43 125.29 29.74 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 107.934 -1.135 . . . . 63.509999999999998 107.934 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 14.7 m170 -92.21 106.09 18.17 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 114.874 -1.057 . . . . 54.210000000000001 108.312 -178.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 13.6 p -63.85 -43.7 95.35 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.084 0.954 . . . . 73.530000000000001 111.35 -178.533 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -163.83 157.26 18.65 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.551 1.141 . . . . 74.200000000000003 108.766 -179.545 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.43 -26.77 68.08 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.553 0.741 . . . . 74.239999999999995 112.844 -174.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -86.38 -45.84 10.82 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.406 0.682 . . . . 64.340000000000003 110.44 176.422 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -68.66 -29.36 67.82 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.838 0.855 . . . . 74.239999999999995 112.095 -173.744 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -67.06 -27.27 67.24 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.412 0.685 . . . . 74.409999999999997 111.071 -177.286 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 71.0 mmtt -67.61 -33.09 74.29 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.82 0.448 . . . . 73.409999999999997 109.91 -177.14 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -74.16 -58.08 3.53 Favored 'General case' 0 C--N 1.347 0.469 0 CA-C-N 115.674 -0.694 . . . . 54.340000000000003 109.74 172.592 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 48.9 mm-40 -67.06 -31.42 71.91 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 113.735 1.013 . . . . 63.219999999999999 113.735 -167.858 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -78.85 -42.49 27.39 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 118.082 0.401 . . . . 33.130000000000003 110.949 -177.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 53.8 tptt -68.74 -38.63 80.28 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.61 0.764 . . . . 74.519999999999996 111.128 177.259 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.454 ' HE3' ' HB3' ' A' ' 30' ' ' ASP . 76.6 tttt -59.18 -50.04 75.56 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 125.483 1.513 . . . . 55.130000000000003 110.387 172.51 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -70.12 -29.08 65.93 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 114.934 -1.03 . . . . 74.030000000000001 110.48 -177.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.87 -43.71 87.54 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.925 0.89 . . . . 41.140000000000001 110.521 178.369 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.82 -41.95 99.53 Favored 'General case' 0 C--N 1.354 0.798 0 O-C-N 123.987 0.805 . . . . 31.43 110.903 176.429 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.402 HG22 HD12 ' A' ' 37' ' ' LEU . 50.0 mm -62.78 -41.83 93.95 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 C-N-CA 123.66 0.784 . . . . 45.130000000000003 110.894 175.899 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.533 HD23 HD13 ' A' ' 37' ' ' LEU . 47.1 mt -64.76 -37.92 89.23 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.764 0.826 . . . . 75.140000000000001 110.921 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -57.25 -45.14 84.25 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.771 0.828 . . . . 72.310000000000002 110.49 178.146 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 9.7 mmpt? -66.97 -41.26 87.13 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 114.892 -1.049 . . . . 64.439999999999998 110.495 -178.241 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.494 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 54.6 t -65.69 -56.71 13.82 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 C-N-CA 124.071 0.949 . . . . 63.210000000000001 110.571 -177.928 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.518 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 22.0 m-85 -60.13 -38.1 82.05 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 124.098 0.959 . . . . 64.450000000000003 111.569 -177.345 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.74 -30.04 71.18 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.577 0.751 . . . . 71.140000000000001 111.835 177.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -87.59 -9.03 55.5 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.491 0.716 . . . . 62.210000000000001 111.949 177.216 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 59.8 mt -105.0 -15.32 15.14 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 122.724 0.409 . . . . 62.32 110.543 -178.695 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 95.11 13.83 51.07 Favored Glycine 0 C--N 1.348 1.213 0 CA-C-N 116.257 -0.429 . . . . 54.109999999999999 113.484 178.535 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.518 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 14.3 m-85 -87.5 124.32 33.34 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 108.518 -0.919 . . . . 61.32 108.518 173.699 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 38.6 t-20 -81.87 146.84 29.63 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.708 0.803 . . . . 74.219999999999999 110.008 -171.193 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -53.15 -36.15 60.53 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 125.257 1.423 . . . . 75.200000000000003 111.425 173.331 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 17.2 m -57.15 -21.23 31.24 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 124.706 1.202 . . . . 75.430000000000007 113.378 178.572 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -105.89 -10.48 16.63 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.425 1.09 . . . . 70.540000000000006 111.896 -173.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.404 HG13 HG22 ' A' ' 104' ' ' VAL . 60.9 t -87.43 103.43 13.37 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 C-N-CA 123.628 0.771 . . . . 74.5 109.696 -175.196 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 30.8 m -108.89 115.49 30.18 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.015 0.926 . . . . 64.140000000000001 110.798 -172.783 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 55.5 m95 -97.81 144.1 27.76 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.007 0.523 . . . . 73.319999999999993 111.314 177.554 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -132.41 66.54 1.55 Allowed 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 108.172 -1.047 . . . . 73.319999999999993 108.172 170.033 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 42.06 22.7 0.12 Allowed Glycine 0 N--CA 1.488 2.135 0 N-CA-C 118.023 1.969 . . . . 61.420000000000002 118.023 174.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -175.04 -52.73 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.418 0 CA-C-N 118.148 0.974 . . . . 64.349999999999994 110.615 -168.149 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 52.7 m -117.58 151.8 36.42 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.393 1.077 . . . . 73.150000000000006 109.483 -177.402 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 6.5 p -126.05 113.47 34.31 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.198 0 C-N-CA 123.275 0.63 . . . . 74.040000000000006 111.074 176.784 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 53.6 m -92.8 101.21 13.59 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.693 1.197 . . . . 75.349999999999994 109.082 175.859 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.479 HG21 ' CE2' ' A' ' 85' ' ' PHE . 55.8 t -104.9 112.33 38.09 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 C-N-CA 124.623 1.169 . . . . 74.439999999999998 108.419 177.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.426 ' HA ' ' O ' ' A' ' 56' ' ' VAL . 47.4 mt-10 -96.12 156.67 16.24 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.048 -0.723 . . . . 75.219999999999999 109.048 175.0 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -154.05 142.37 9.06 Favored Glycine 0 C--O 1.241 0.541 0 C-N-CA 121.387 -0.435 . . . . 72.239999999999995 112.332 176.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 23.0 tp60 -74.45 99.77 3.64 Favored 'General case' 0 C--N 1.351 0.644 0 N-CA-C 106.897 -1.52 . . . . 64.329999999999998 106.897 171.525 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.44 HD11 ' HG2' ' A' ' 49' ' ' LYS . 20.5 tp -85.57 160.75 19.56 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.768 0.827 . . . . 62.310000000000002 110.185 -176.752 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -68.3 -179.1 1.2 Allowed 'General case' 0 CA--C 1.547 0.861 0 CA-C-O 122.288 1.042 . . . . 75.099999999999994 112.313 175.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 154.07 -106.1 0.29 Allowed Glycine 0 N--CA 1.449 -0.473 0 CA-C-N 113.647 -1.615 . . . . 64.530000000000001 109.368 -177.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 17.6 m -126.33 169.79 17.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 124.251 1.02 . . . . 64.040000000000006 110.519 -179.227 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 37.3 t70 78.46 -32.74 0.16 Allowed 'General case' 0 N--CA 1.5 2.049 0 C-N-CA 125.602 1.561 . . . . 74.329999999999998 114.439 170.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 70.9 mt -65.59 140.78 58.55 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 124.285 1.034 . . . . 60.409999999999997 111.171 -174.133 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.88 -26.82 68.78 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 113.996 1.11 . . . . 73.420000000000002 113.996 -168.649 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -69.01 164.86 21.39 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.356 0.662 . . . . 75.150000000000006 111.555 -179.333 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 28.7 p-80 -61.16 124.95 22.0 Favored 'General case' 0 N--CA 1.485 1.288 0 O-C-N 123.883 0.74 . . . . 75.510000000000005 111.453 -170.345 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 10.8 p80 -142.04 142.32 32.87 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.859 0.864 . . . . 72.530000000000001 109.936 -176.403 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 23.7 m170 -111.66 178.86 4.19 Favored 'General case' 0 C--O 1.241 0.652 0 C-N-CA 124.453 1.101 . . . . 60.409999999999997 108.269 172.086 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 -77.79 81.27 4.22 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 107.803 -1.184 . . . . 74.049999999999997 107.803 167.698 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 44.8 t-80 . . . . . 0 C--O 1.251 1.151 0 C-N-CA 125.1 1.36 . . . . 74.099999999999994 110.033 -178.208 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mpt? . . . . . 0 N--CA 1.478 0.943 0 N-CA-C 108.857 -0.794 . . . . 71.109999999999999 108.857 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.3 m -77.27 70.51 3.67 Favored 'General case' 0 N--CA 1.481 1.075 0 CA-C-O 121.775 0.798 . . . . 75.299999999999997 109.816 178.175 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 131.72 159.85 9.57 Favored Glycine 0 C--N 1.341 0.826 0 CA-C-N 114.805 -1.089 . . . . 73.420000000000002 112.448 -171.442 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.17 150.02 36.01 Favored 'General case' 0 C--O 1.244 0.807 0 C-N-CA 123.315 0.646 . . . . 74.420000000000002 110.674 177.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -97.06 101.95 13.63 Favored 'General case' 0 C--O 1.239 0.513 0 N-CA-C 106.659 -1.608 . . . . 75.109999999999999 106.659 167.168 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.2 p -100.23 134.42 39.93 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 C-N-CA 124.148 0.979 . . . . 63.210000000000001 108.642 -178.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.443 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 34.6 mt-10 -106.29 113.51 27.08 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 108.058 -1.09 . . . . 74.519999999999996 108.058 175.684 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 77.6 t -97.25 107.74 20.46 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 114.827 -1.079 . . . . 65.340000000000003 108.331 -176.579 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -94.52 99.75 11.85 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 107.26 -1.385 . . . . 74.120000000000005 107.26 -177.464 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 97.2 t -94.56 103.31 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 N-CA-C 108.113 -1.069 . . . . 74.120000000000005 108.113 -177.808 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.442 ' HG3' ' HB3' ' A' ' 20' ' ' GLU . 34.7 ttmt -115.0 101.21 8.79 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 107.732 -1.21 . . . . 75.239999999999995 107.732 -176.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.445 HD13 HG13 ' A' ' 48' ' ' ILE . 11.3 tt -116.24 125.95 73.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 C-N-CA 123.376 0.67 . . . . 74.530000000000001 110.373 -169.913 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 55.5 m -92.07 122.47 34.61 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 109.944 -0.391 . . . . 72.420000000000002 109.944 176.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.523 ' SG ' HG23 ' A' ' 48' ' ' ILE . 14.6 t -155.86 147.99 23.45 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.462 1.505 . . . . 52.439999999999998 108.644 -178.88 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.448 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 11.6 t30 67.17 18.51 10.39 Favored 'General case' 0 N--CA 1.499 1.994 0 CA-C-O 121.791 0.805 . . . . 54.030000000000001 110.682 174.881 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.5 7.11 88.73 Favored Glycine 0 C--N 1.358 1.772 0 CA-C-N 115.495 -0.775 . . . . 73.140000000000001 113.586 -176.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.9 mtpm? -124.98 169.2 12.34 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.114 0.965 . . . . 72.239999999999995 110.397 -178.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.4 m -120.05 115.0 22.84 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 109.923 -0.399 . . . . 72.340000000000003 109.923 -178.361 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.409 ' HB3' ' NH2' ' A' ' 44' ' ' ARG . 61.9 m-85 -104.45 102.97 12.6 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.717 1.207 . . . . 75.329999999999998 108.996 -175.423 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.442 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -105.57 161.25 14.53 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 122.84 0.456 . . . . 75.439999999999998 111.282 -179.261 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 20.2 ttt180 -169.15 130.11 1.13 Allowed 'General case' 0 N--CA 1.477 0.888 0 O-C-N 123.893 0.746 . . . . 72.040000000000006 109.778 174.303 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 26.0 m -93.16 111.82 23.57 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.006 0.923 . . . . 74.219999999999999 109.692 178.551 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.428 ' O ' ' HA ' ' A' ' 7' ' ' GLU . 87.5 m-85 -98.69 122.49 41.98 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.646 0.778 . . . . 74.140000000000001 110.363 -177.394 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 24.9 mp0 -88.69 111.07 21.52 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 107.972 -1.122 . . . . 72.239999999999995 107.972 174.479 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.532 HD11 HG21 ' A' ' 40' ' ' VAL . 80.9 mt -124.77 119.26 28.39 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.215 1.006 . . . . 75.040000000000006 108.459 -177.715 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 87.2 t80 -113.74 138.87 49.64 Favored 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 109.751 -0.462 . . . . 53.350000000000001 109.751 179.139 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -156.7 149.79 24.04 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.125 0.57 . . . . 73.239999999999995 110.187 175.073 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 26.7 t -68.48 -26.94 34.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 124.627 1.171 . . . . 64.129999999999995 110.417 175.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.543 ' HB3' ' HG2' ' A' ' 31' ' ' GLU . 74.4 mtt180 -135.35 137.71 42.65 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.111 0.964 . . . . 71.329999999999998 110.017 178.254 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -71.82 -17.78 62.13 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 123.269 0.628 . . . . 63.200000000000003 111.717 176.385 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.543 ' HG2' ' HB3' ' A' ' 29' ' ' ARG . 13.5 pt-20 -70.74 -27.68 64.14 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 122.621 0.368 . . . . 73.230000000000004 110.876 172.116 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.474 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 31.5 mm-40 -83.47 -23.04 32.39 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.22 0.608 . . . . 74.200000000000003 110.476 177.323 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.01 -21.29 65.95 Favored 'General case' 0 CA--C 1.56 1.364 0 C-N-CA 124.168 0.987 . . . . 71.340000000000003 110.106 178.031 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -48.29 -56.56 7.73 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 124.289 1.036 . . . . 74.120000000000005 112.505 178.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.419 ' HA ' ' HD3' ' A' ' 38' ' ' LYS . 1.9 pp20? -60.33 -31.87 70.71 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.215 0.606 . . . . 74.329999999999998 112.08 -176.711 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -70.59 -40.6 73.14 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.378 0.671 . . . . 73.340000000000003 110.59 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.47 HD13 HD23 ' A' ' 81' ' ' LEU . 77.6 mt -63.33 -33.65 75.99 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.717 0.807 . . . . 71.019999999999996 111.067 174.625 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.531 ' HA ' HD11 ' A' ' 88' ' ' LEU . 57.3 mtpt -65.3 -41.85 93.67 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.383 0.673 . . . . 63.409999999999997 110.93 175.54 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.405 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 42.7 mmtm -61.5 -51.51 68.35 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 109.392 -0.596 . . . . 74.400000000000006 109.392 175.762 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.532 HG21 HD11 ' A' ' 25' ' ' LEU . 38.7 t -54.05 -50.86 51.47 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 C-N-CA 124.781 1.232 . . . . 71.430000000000007 111.863 -178.64 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 80.1 mt -67.41 -51.53 50.65 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.165 0.586 . . . . 53.329999999999998 111.534 -177.366 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -66.1 -38.9 89.37 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.088 0.555 . . . . 71.439999999999998 112.296 -174.407 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -70.72 -42.54 70.46 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.022 0.529 . . . . 72.310000000000002 110.736 176.592 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.409 ' NH2' ' HB3' ' A' ' 19' ' ' TYR . 18.6 tpt180 -69.93 -34.49 73.53 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 122.658 0.383 . . . . 72.129999999999995 111.743 -178.23 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 62.0 mtp -91.88 -8.24 46.98 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.532 0.567 . . . . 73.030000000000001 112.532 -177.141 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -59.05 -49.29 94.04 Favored Pre-proline 0 CA--C 1.569 1.674 0 CA-C-O 118.9 -0.572 . . . . 73.340000000000003 111.673 174.692 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -67.54 -25.53 40.99 Favored 'Trans proline' 0 C--N 1.394 2.967 0 C-N-CA 122.035 1.824 . . . . 61.009999999999998 112.571 174.549 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.523 HG23 ' SG ' ' A' ' 14' ' ' CYS . 50.9 mm -72.64 -33.89 45.96 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.114 0 C-N-CA 124.169 0.988 . . . . 70.219999999999999 110.918 -177.831 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -71.09 -31.98 68.5 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.753 0.821 . . . . 75.019999999999996 110.073 176.043 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.7 tmmm? -71.7 -33.11 68.51 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 115.112 -0.949 . . . . 71.5 110.699 172.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 91.2 mt -69.43 -30.68 68.66 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 109.345 -0.613 . . . . 73.549999999999997 109.345 177.009 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 93.28 19.19 36.52 Favored Glycine 0 C--N 1.345 1.067 0 CA-C-N 115.446 -0.797 . . . . 75.400000000000006 113.787 172.16 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.448 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 71.6 m -71.35 102.82 2.7 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.837 0.319 . . . . 73.140000000000001 111.055 -177.856 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -55.67 -56.62 18.31 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.87 1.268 . . . . 72.340000000000003 110.016 176.567 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 14.1 tpp85 -103.23 125.54 49.95 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 114.781 -1.1 . . . . 73.340000000000003 109.366 176.021 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 26.8 m -122.09 142.97 36.31 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.03 0.932 . . . . 74.109999999999999 109.212 172.82 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.3 ttm105 -111.17 106.11 15.02 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 108.006 -1.109 . . . . 63.32 108.006 172.174 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 24.5 mt -101.57 112.46 34.7 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 N-CA-C 108.203 -1.036 . . . . 73.219999999999999 108.203 -179.431 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 46.5 m -100.73 104.61 15.89 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 107.859 -1.163 . . . . 75.129999999999995 107.859 176.302 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 75.8 mt -100.38 115.31 41.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 N-CA-C 109.081 -0.711 . . . . 74.0 109.081 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -101.66 123.97 46.54 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 108.518 -0.919 . . . . 75.420000000000002 108.518 172.383 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 7.8 p -93.19 130.5 42.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 N-CA-C 107.683 -1.229 . . . . 73.549999999999997 107.683 178.304 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.443 ' HB3' ' H ' ' A' ' 7' ' ' GLU . 12.2 tmtt? -81.76 118.79 23.15 Favored 'General case' 0 C--O 1.243 0.713 0 N-CA-C 107.11 -1.441 . . . . 55.109999999999999 107.11 179.429 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 23.1 m170 -72.5 131.65 42.82 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 115.328 -0.851 . . . . 73.200000000000003 108.989 -177.806 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 40.6 t -59.81 -45.05 93.57 Favored 'General case' 0 CA--C 1.55 0.963 0 O-C-N 123.948 0.78 . . . . 52.140000000000001 110.933 -179.73 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -154.97 163.83 39.75 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 123.523 0.729 . . . . 73.109999999999999 110.672 -178.488 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -56.66 -47.69 79.22 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.397 1.479 . . . . 43.100000000000001 112.817 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.43 -31.31 68.44 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 122.642 0.377 . . . . 74.519999999999996 111.015 177.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -76.79 -15.98 59.59 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 115.36 -0.837 . . . . 64.209999999999994 112.747 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -54.0 -54.84 33.51 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.901 0.48 . . . . 63.109999999999999 112.197 -174.632 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -66.85 -44.72 80.28 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.442 0.697 . . . . 53.049999999999997 111.196 -174.361 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 24.4 ttmm -63.62 -59.54 4.48 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 115.47 -0.786 . . . . 73.299999999999997 110.529 -178.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -74.14 -20.66 60.16 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 113.301 0.852 . . . . 71.040000000000006 113.301 -172.024 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.16 -43.34 64.74 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-N 119.386 0.994 . . . . 50.520000000000003 109.559 175.587 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -65.44 -37.91 88.28 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.115 0.966 . . . . 73.019999999999996 111.681 176.016 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -71.11 -44.24 66.05 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.048 0.539 . . . . 64.430000000000007 110.65 177.627 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -76.88 -18.73 58.15 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.253 0.621 . . . . 75.439999999999998 109.784 -176.728 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.12 -45.96 92.53 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.346 0.659 . . . . 75.430000000000007 109.904 169.886 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -73.03 -32.9 65.39 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 124.047 0.842 . . . . 54.030000000000001 111.391 178.313 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.459 ' O ' HG23 ' A' ' 84' ' ' VAL . 46.3 mm -62.81 -54.24 36.37 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 C-N-CA 123.095 0.558 . . . . 74.019999999999996 109.825 174.847 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.47 HD23 HD13 ' A' ' 37' ' ' LEU . 32.2 mt -60.41 -44.99 95.17 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.8 0.84 . . . . 52.100000000000001 110.339 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 57.5 t30 -64.27 -33.7 76.41 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.602 0.761 . . . . 73.430000000000007 110.721 -175.446 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.473 ' O ' ' HG2' ' A' ' 87' ' ' GLU . 27.7 mmtp -73.04 -35.16 66.69 Favored 'General case' 0 C--O 1.213 -0.843 0 CA-C-O 119.007 -0.52 . . . . 71.230000000000004 111.485 174.15 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 80' ' ' ILE . 69.0 t -66.81 -36.44 77.22 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 CA-C-O 121.388 0.614 . . . . 73.420000000000002 110.604 177.286 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.562 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 24.2 m-85 -62.38 -43.24 99.28 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 114.9 -1.045 . . . . 65.219999999999999 109.623 173.33 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -69.45 -28.53 66.19 Favored 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 122.851 0.46 . . . . 74.340000000000003 111.461 175.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.473 ' HG2' ' O ' ' A' ' 83' ' ' LYS . 58.0 mm-40 -65.11 -34.75 79.14 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 124.084 0.954 . . . . 73.109999999999999 110.84 177.65 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.531 HD11 ' HA ' ' A' ' 38' ' ' LYS . 70.9 mt -107.27 -6.6 17.14 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 122.994 0.518 . . . . 74.109999999999999 112.204 -170.188 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 93.28 54.9 1.65 Allowed Glycine 0 C--N 1.346 1.09 0 CA-C-O 121.331 0.406 . . . . 52.420000000000002 113.267 176.083 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.562 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 72.9 m-85 -118.16 145.96 44.55 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 106.816 -1.55 . . . . 73.239999999999995 106.816 169.236 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -76.83 158.44 30.82 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 122.949 0.5 . . . . 63.229999999999997 110.273 178.242 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -64.82 -35.94 82.74 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.333 0.653 . . . . 71.030000000000001 110.359 176.515 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 18.1 m -51.11 -35.38 35.02 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 124.938 1.295 . . . . 72.120000000000005 112.975 174.664 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ASN . . . . . 0.433 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 3.2 m-20 -58.96 -37.88 77.79 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 124.057 0.943 . . . . 75.530000000000001 110.973 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 17.6 t -83.73 110.24 18.23 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 C-N-CA 124.183 0.993 . . . . 54.350000000000001 109.502 -169.758 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 51.8 m -139.26 113.98 9.24 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 122.867 0.467 . . . . 42.329999999999998 109.972 174.035 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.443 ' HA ' ' HA ' ' A' ' 102' ' ' VAL . 60.7 m95 -79.04 121.77 25.38 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.197 0.599 . . . . 72.329999999999998 110.597 176.709 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -101.07 87.9 3.38 Favored 'General case' 0 C--O 1.242 0.678 0 C-N-CA 124.79 1.236 . . . . 75.299999999999997 107.71 168.623 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.87 -103.1 0.78 Allowed Glycine 0 C--N 1.343 0.956 0 CA-C-N 115.82 -0.627 . . . . 64.420000000000002 112.196 -174.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -106.4 -8.51 17.13 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.405 0.682 . . . . 70.239999999999995 111.645 -176.561 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 37.3 m -109.71 127.21 54.44 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 108.881 -0.785 . . . . 51.420000000000002 108.881 178.694 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.443 ' HA ' ' HA ' ' A' ' 97' ' ' TRP . 8.1 p -95.32 118.4 41.43 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 N-CA-C 108.841 -0.8 . . . . 71.420000000000002 108.841 176.458 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 39.4 m -92.72 100.41 12.91 Favored 'General case' 0 C--O 1.242 0.67 0 N-CA-C 107.576 -1.268 . . . . 64.310000000000002 107.576 176.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.451 HG21 ' CZ ' ' A' ' 85' ' ' PHE . 60.8 t -103.69 110.3 29.66 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 N-CA-C 108.301 -1.0 . . . . 72.349999999999994 108.301 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -101.71 111.46 23.71 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 108.526 -0.916 . . . . 71.239999999999995 108.526 176.66 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -116.57 155.16 16.37 Favored Glycine 0 C--N 1.342 0.876 0 CA-C-N 115.421 -0.809 . . . . 70.420000000000002 112.594 -172.692 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -105.47 150.73 25.04 Favored 'General case' 0 C--O 1.243 0.75 0 C-N-CA 123.475 0.71 . . . . 60.32 109.217 170.413 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.32 169.7 20.76 Favored 'General case' 0 C--O 1.244 0.795 0 C-N-CA 124.004 0.922 . . . . 63.049999999999997 109.353 178.716 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -79.09 80.03 5.46 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 108.854 -0.795 . . . . 72.219999999999999 108.854 176.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -85.53 101.43 2.55 Favored Glycine 0 C--N 1.338 0.664 0 CA-C-N 114.785 -1.098 . . . . 63.229999999999997 111.98 -178.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 46.4 t -68.86 114.34 5.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 N-CA-C 109.078 -0.712 . . . . 72.530000000000001 109.078 178.081 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -71.62 108.61 5.06 Favored 'General case' 0 C--O 1.238 0.464 0 O-C-N 123.863 0.727 . . . . 43.130000000000003 109.748 -176.467 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 75.8 mt -99.33 11.09 40.08 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.396 0.678 . . . . 73.219999999999999 110.552 175.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -81.57 105.67 12.91 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 121.225 0.535 . . . . 64.019999999999996 109.951 -177.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 30.2 m170 -72.06 170.43 13.91 Favored 'General case' 0 C--O 1.243 0.715 0 CA-C-N 114.892 -1.049 . . . . 64.099999999999994 110.026 171.563 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 47.4 m-70 65.04 36.92 7.07 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 124.154 0.982 . . . . 73.409999999999997 108.496 -165.436 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 54.4 t60 -70.26 -8.36 49.55 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 114.481 -1.236 . . . . 74.519999999999996 113.024 -167.214 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 58.1 m-70 -63.03 -18.79 63.72 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 122.603 0.361 . . . . 63.420000000000002 111.37 175.422 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 22.0 p80 -115.55 157.67 23.75 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.559 0.744 . . . . 74.340000000000003 109.757 169.552 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 . . . . . 0 CA--C 1.557 1.217 0 N-CA-C 107.872 -1.159 . . . . 62.539999999999999 107.872 168.299 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mpt? . . . . . 0 N--CA 1.477 0.885 0 N-CA-C 109.466 -0.568 . . . . 64.540000000000006 109.466 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.4 m -70.99 103.54 2.71 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 108.097 -1.075 . . . . 63.25 108.097 169.3 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 162.44 47.14 0.02 OUTLIER Glycine 0 C--N 1.339 0.714 0 N-CA-C 110.216 -1.153 . . . . 52.329999999999998 110.216 -179.186 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 57.2 mttm -100.61 154.92 18.18 Favored 'General case' 0 C--O 1.245 0.858 0 C-N-CA 123.624 0.77 . . . . 71.510000000000005 110.61 -169.247 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -80.35 102.67 9.71 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 105.432 -2.062 . . . . 65.209999999999994 105.432 160.959 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.1 p -102.42 134.29 43.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 124.373 1.069 . . . . 53.039999999999999 108.44 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.569 ' HB2' ' HG3' ' A' ' 63' ' ' LYS . 46.8 mt-10 -107.96 115.2 29.69 Favored 'General case' 0 C--O 1.243 0.728 0 N-CA-C 107.876 -1.157 . . . . 71.420000000000002 107.876 175.9 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 99.1 t -95.72 109.27 22.33 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 CA-C-N 114.025 -1.443 . . . . 64.120000000000005 108.333 -174.843 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.46 ' HG2' HG23 ' A' ' 22' ' ' THR . 36.5 mt-30 -94.21 100.97 12.95 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 107.933 -1.136 . . . . 74.150000000000006 107.933 -176.151 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 98.5 t -95.77 104.2 15.56 Favored 'Isoleucine or valine' 0 C--O 1.243 0.753 0 N-CA-C 108.779 -0.823 . . . . 51.229999999999997 108.779 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.491 ' HG3' ' HB3' ' A' ' 20' ' ' GLU . 39.0 ttpt -108.64 102.54 11.59 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 108.042 -1.095 . . . . 73.430000000000007 108.042 -179.261 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.5 HD13 HG13 ' A' ' 48' ' ' ILE . 15.8 tt -111.48 120.19 61.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 C-N-CA 123.364 0.666 . . . . 75.519999999999996 110.29 -176.142 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 7.0 m -92.28 108.46 19.97 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 108.605 -0.887 . . . . 62.43 108.605 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.669 ' SG ' HG23 ' A' ' 48' ' ' ILE . 52.5 t -128.7 119.34 24.46 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.947 0.899 . . . . 75.540000000000006 108.986 -175.157 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.496 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 22.1 t-20 77.3 -8.61 1.65 Allowed 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 126.327 1.851 . . . . 74.340000000000003 112.602 173.619 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 124.17 -4.43 8.96 Favored Glycine 0 C--N 1.341 0.857 0 CA-C-O 119.861 -0.41 . . . . 44.039999999999999 112.588 -175.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -106.25 144.97 32.19 Favored 'General case' 0 C--O 1.241 0.642 0 C-N-CA 123.084 0.554 . . . . 74.140000000000001 109.672 179.485 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 47.2 m -94.32 108.32 20.22 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.809 0.844 . . . . 75.420000000000002 108.731 177.171 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 70.6 m-85 -101.65 101.35 11.86 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 107.843 -1.169 . . . . 75.109999999999999 107.843 177.191 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.491 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 0.2 OUTLIER -123.23 141.84 51.56 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 122.846 0.458 . . . . 75.510000000000005 111.049 -178.146 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 41.1 ttm180 -154.94 135.8 13.69 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.374 -0.83 . . . . 72.209999999999994 108.94 177.055 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.46 HG23 ' HG2' ' A' ' 9' ' ' GLN . 29.8 m -94.6 117.13 29.65 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.377 1.071 . . . . 75.349999999999994 108.31 177.668 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -99.17 120.28 39.24 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.111 0.964 . . . . 71.209999999999994 110.034 -176.644 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -83.33 109.24 17.11 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 108.204 -1.036 . . . . 73.299999999999997 108.204 178.104 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 96.6 mt -119.49 148.36 43.36 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.02 0.928 . . . . 75.340000000000003 109.101 179.718 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 54.0 t80 -136.39 139.86 42.79 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 108.42 -0.955 . . . . 72.299999999999997 108.42 174.372 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.58 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -162.72 151.81 15.12 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 123.683 0.793 . . . . 73.340000000000003 109.377 174.877 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 43.5 t -76.0 -71.14 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 N-CA-C 108.633 -0.877 . . . . 72.530000000000001 108.633 175.377 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.488 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 57.1 mtp85 -82.18 155.36 25.0 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.352 0.596 . . . . 73.540000000000006 110.977 -179.52 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -68.63 -28.65 67.09 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 114.952 -1.022 . . . . 70.140000000000001 110.955 175.857 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 60.8 mm-40 -58.61 -36.07 73.47 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.529 0.732 . . . . 73.530000000000001 111.644 171.801 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.58 ' HB2' ' HB1' ' A' ' 27' ' ' ALA . 9.2 mm-40 -67.58 -34.09 76.34 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 123.717 0.807 . . . . 74.319999999999993 110.822 -179.443 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.424 HD23 ' HB3' ' A' ' 27' ' ' ALA . 0.2 OUTLIER -73.07 -25.26 60.84 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.554 0.742 . . . . 70.549999999999997 110.871 -177.633 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -53.94 -59.73 4.25 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.766 0.826 . . . . 65.310000000000002 112.252 -178.855 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -57.65 -33.46 68.32 Favored 'General case' 0 N--CA 1.479 0.987 0 O-C-N 124.088 0.868 . . . . 63.439999999999998 111.894 -178.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.407 ' O ' HG23 ' A' ' 40' ' ' VAL . 64.6 mttm -68.66 -44.9 73.12 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 123.418 0.687 . . . . 74.530000000000001 109.912 -179.467 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 89.6 mt -65.08 -36.84 85.61 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.767 0.827 . . . . 64.319999999999993 111.482 178.241 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.541 ' HA ' HD11 ' A' ' 88' ' ' LEU . 59.2 mtpt -63.58 -43.22 97.61 Favored 'General case' 0 C--N 1.357 0.897 0 C-N-CA 122.778 0.431 . . . . 71.349999999999994 110.138 177.18 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -66.92 -47.91 70.27 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 123.467 0.479 . . . . 72.109999999999999 111.623 176.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.412 ' O ' ' HB2' ' A' ' 44' ' ' ARG . 54.8 t -57.86 -41.87 80.88 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.227 0 C-N-CA 123.57 0.748 . . . . 64.010000000000005 110.747 -178.552 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.574 HD21 HD11 ' A' ' 60' ' ' ILE . 74.6 mt -72.21 -51.12 22.53 Favored 'General case' 0 C--O 1.217 -0.633 0 CA-C-O 118.755 -0.64 . . . . 75.0 111.425 178.977 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -55.69 -50.21 70.88 Favored 'General case' 0 N--CA 1.496 1.851 0 C-N-CA 122.901 0.48 . . . . 64.510000000000005 112.027 -179.027 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 56.3 mm-40 -63.01 -34.77 78.27 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 115.966 -0.561 . . . . 63.409999999999997 110.827 178.837 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.412 ' HB2' ' O ' ' A' ' 40' ' ' VAL . 20.5 tpt180 -65.7 -45.52 82.48 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.296 0.638 . . . . 75.120000000000005 110.954 176.887 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.471 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 94.6 mmm -80.57 -21.83 41.33 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.698 0.799 . . . . 63.420000000000002 112.379 -170.13 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -57.38 -55.73 41.38 Favored Pre-proline 0 CA--C 1.565 1.531 0 O-C-N 123.721 0.638 . . . . 63.340000000000003 111.521 -178.212 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.418 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 60.8 Cg_endo -69.27 -24.71 31.61 Favored 'Trans proline' 0 C--N 1.389 2.689 0 C-N-CA 121.623 1.549 . . . . 62.119999999999997 112.334 177.942 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.669 HG23 ' SG ' ' A' ' 14' ' ' CYS . 44.7 mm -69.99 -34.42 59.7 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.015 0 C-N-CA 123.938 0.895 . . . . 61.43 111.506 -177.964 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 58.4 mtpt -67.14 -35.6 80.07 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 109.998 -0.371 . . . . 55.229999999999997 109.998 173.591 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.32 -35.65 79.85 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 123.772 0.829 . . . . 73.209999999999994 109.376 176.088 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.452 HD12 HD13 ' A' ' 48' ' ' ILE . 91.7 mt -70.79 -23.29 62.35 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 122.86 0.464 . . . . 72.25 110.008 175.973 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 71.88 39.63 59.0 Favored Glycine 0 C--N 1.343 0.97 0 CA-C-N 115.667 -0.697 . . . . 75.099999999999994 113.968 168.78 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.496 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 72.8 m -79.03 111.76 15.55 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 122.498 0.319 . . . . 64.049999999999997 111.03 -178.462 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -46.74 -37.22 8.16 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 126.177 1.791 . . . . 71.310000000000002 112.864 178.986 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.472 ' HD2' ' N ' ' A' ' 56' ' ' VAL . 0.0 OUTLIER -146.2 136.86 24.16 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 107.469 -1.308 . . . . 75.310000000000002 107.469 175.096 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.472 ' N ' ' HD2' ' A' ' 55' ' ' ARG . 31.0 m -124.66 142.14 42.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 124.472 1.109 . . . . 71.25 109.879 177.075 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 -111.01 105.5 14.28 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 109.056 -0.72 . . . . 72.129999999999995 109.056 176.357 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.44 HD11 ' SD ' ' A' ' 45' ' ' MET . 52.0 mt -94.79 109.59 22.51 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 125.312 1.445 . . . . 71.140000000000001 108.184 176.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 27.4 m -107.19 105.48 15.48 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 108.229 -1.026 . . . . 73.0 108.229 177.069 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.574 HD11 HD21 ' A' ' 41' ' ' LEU . 79.8 mt -97.6 122.83 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 123.564 0.746 . . . . 75.150000000000006 109.341 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 79.6 mtt-85 -110.68 138.01 47.62 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.515 0.726 . . . . 73.109999999999999 109.604 174.712 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.5 p -99.39 139.64 20.62 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 N-CA-C 108.21 -1.033 . . . . 73.549999999999997 108.21 170.235 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.569 ' HG3' ' HB2' ' A' ' 7' ' ' GLU . 10.6 mmpt? -81.97 127.48 33.09 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 122.641 0.376 . . . . 75.349999999999994 110.438 178.81 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 20.2 p80 -147.16 154.16 40.74 Favored 'General case' 0 C--O 1.24 0.564 0 C-N-CA 123.896 0.878 . . . . 55.240000000000002 110.598 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 71.8 p -164.91 32.66 0.06 Allowed 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.981 0.912 . . . . 62.240000000000002 109.056 174.414 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -135.85 82.11 1.93 Allowed 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 107.509 -1.293 . . . . 53.420000000000002 107.509 -175.904 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.61 -6.23 5.04 Favored 'General case' 0 N--CA 1.483 1.181 0 N-CA-C 113.911 1.078 . . . . 44.530000000000001 113.911 -166.08 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -78.48 -66.99 0.78 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.231 0.612 . . . . 74.510000000000005 110.205 170.766 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.414 ' O ' ' HG2' ' A' ' 73' ' ' GLU . 44.5 mm-40 -84.35 -27.65 27.58 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 113.384 0.883 . . . . 75.349999999999994 113.384 -168.876 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -59.73 -29.39 68.11 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 112.943 0.72 . . . . 71.310000000000002 112.943 -172.437 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -76.36 -30.23 57.51 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.029 0.932 . . . . 73.329999999999998 110.496 -178.521 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -72.94 -41.72 64.2 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.417 1.087 . . . . 61.030000000000001 109.884 172.513 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.414 ' HG2' ' O ' ' A' ' 69' ' ' GLU . 10.7 mm-40 -79.92 -23.0 42.06 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 115.781 -0.645 . . . . 72.120000000000005 111.946 -173.345 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -76.48 -40.3 50.71 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 122.824 0.449 . . . . 44.140000000000001 109.947 174.755 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.3 ttmm -57.26 -41.71 80.19 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 124.238 1.015 . . . . 74.239999999999995 110.587 170.603 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -66.75 -45.02 79.88 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 114.423 -1.262 . . . . 50.520000000000003 110.712 178.603 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -72.7 -22.35 60.91 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.411 1.084 . . . . 74.120000000000005 110.089 -176.609 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.423 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -63.87 -46.51 84.6 Favored 'General case' 0 C--N 1.354 0.761 0 C-N-CA 123.812 0.845 . . . . 33.25 110.472 173.861 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.38 -34.96 73.18 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 115.372 -0.831 . . . . 63.009999999999998 111.533 178.531 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.402 ' O ' HG23 ' A' ' 84' ' ' VAL . 31.9 mm -62.13 -54.76 30.1 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 123.636 0.775 . . . . 72.219999999999999 111.224 177.096 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 16.2 mt -67.78 -26.97 66.37 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 122.564 0.345 . . . . 75.230000000000004 111.535 178.076 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -61.63 -37.54 84.34 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.045 0.538 . . . . 63.049999999999997 110.074 174.898 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.1 mmmp? -69.07 -47.37 65.45 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 115.9 -0.591 . . . . 53.009999999999998 110.931 172.322 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.43 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 71.8 t -61.01 -55.96 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 123.745 0.818 . . . . 70.010000000000005 111.083 -172.314 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.458 ' CZ ' HG21 ' A' ' 104' ' ' VAL . 35.0 m-85 -56.6 -44.26 80.93 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 124.218 0.949 . . . . 74.349999999999994 111.607 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.41 -32.06 73.39 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.19 0.596 . . . . 75.319999999999993 111.633 -179.268 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -86.15 -12.34 50.19 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.858 0.863 . . . . 43.329999999999998 111.77 -179.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.541 HD11 ' HA ' ' A' ' 38' ' ' LYS . 41.7 mt -106.64 8.97 31.42 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.126 0.57 . . . . 70.540000000000006 111.253 -179.213 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 86.54 14.8 65.05 Favored Glycine 0 C--N 1.347 1.172 0 N-CA-C 114.221 0.448 . . . . 55.130000000000003 114.221 174.082 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.434 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 63.4 m-85 -94.94 134.66 37.35 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.285 0.634 . . . . 72.450000000000003 110.304 174.636 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -88.47 162.03 16.69 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.001 0.92 . . . . 73.400000000000006 108.957 178.665 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -60.94 -28.29 68.85 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.635 0.774 . . . . 64.0 111.9 177.137 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 35.9 t -59.56 -31.36 69.35 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.087 0.955 . . . . 74.030000000000001 111.466 177.634 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ASN . . . . . 0.574 HD22 ' HA2' ' A' ' 106' ' ' GLY . 18.7 m120 -76.04 -32.89 59.55 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 122.902 0.481 . . . . 71.049999999999997 111.019 178.196 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 44.5 t -106.42 116.21 49.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 123.515 0.726 . . . . 60.32 111.287 -165.336 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 10.6 t -126.07 122.93 37.21 Favored 'General case' 0 CA--C 1.556 1.199 0 C-N-CA 123.06 0.544 . . . . 74.310000000000002 110.065 173.388 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.423 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 37.8 m95 -91.12 146.05 24.17 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.567 0.747 . . . . 64.349999999999994 112.086 -177.795 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -152.31 73.93 1.06 Allowed 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 115.303 -0.862 . . . . 51.530000000000001 109.129 172.404 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 61.47 -93.41 0.08 OUTLIER Glycine 0 C--N 1.352 1.444 0 CA-C-N 114.443 -1.253 . . . . 32.340000000000003 114.656 173.425 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -69.23 -43.99 72.93 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.831 1.253 . . . . 75.519999999999996 111.251 -176.587 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 16.8 m -121.37 139.73 53.05 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.354 -0.839 . . . . 71.430000000000007 110.053 -171.57 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 6.7 p -107.04 126.67 63.09 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 N-CA-C 108.593 -0.891 . . . . 60.549999999999997 108.593 166.785 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 33.5 m -96.23 104.03 15.96 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 107.947 -1.131 . . . . 72.109999999999999 107.947 177.406 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.458 HG21 ' CZ ' ' A' ' 85' ' ' PHE . 58.9 t -105.38 110.6 31.61 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.516 0 N-CA-C 107.623 -1.251 . . . . 75.040000000000006 107.623 178.327 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.409 ' HB3' ' HD3' ' A' ' 55' ' ' ARG . 46.3 mt-10 -109.96 110.03 20.83 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 107.728 -1.212 . . . . 73.340000000000003 107.728 173.433 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.574 ' HA2' HD22 ' A' ' 94' ' ' ASN . . . -118.78 135.22 11.32 Favored Glycine 0 C--N 1.342 0.909 0 N-CA-C 111.437 -0.665 . . . . 71.519999999999996 111.437 -179.286 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 4.3 pm0 -78.92 140.35 38.09 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 108.047 -1.094 . . . . 65.329999999999998 108.047 172.167 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 83.6 mt -117.35 147.5 42.57 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.063 0.458 . . . . 75.150000000000006 110.561 178.101 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -59.92 -34.77 73.67 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 114.385 -1.28 . . . . 63.119999999999997 110.562 169.693 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 65.47 -135.17 36.1 Favored Glycine 0 C--N 1.355 1.637 0 CA-C-N 115.563 -0.744 . . . . 71.299999999999997 111.854 -178.553 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 12.0 t -91.75 56.88 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.989 0 N-CA-C 107.987 -1.116 . . . . 55.020000000000003 107.987 172.555 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 31.8 t70 60.17 23.91 13.24 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 124.568 1.147 . . . . 72.430000000000007 111.374 -176.182 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 80.2 mt -75.0 130.27 39.07 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.28 0.632 . . . . 61.100000000000001 110.025 -175.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -71.09 115.42 10.21 Favored 'General case' 0 C--O 1.24 0.586 0 C-N-CA 123.203 0.601 . . . . 72.239999999999995 109.814 -179.6 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -70.36 92.42 0.8 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 123.646 0.778 . . . . 61.100000000000001 109.728 176.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 -103.41 153.72 20.18 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.241 1.016 . . . . 73.400000000000006 109.677 174.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 57.8 t-80 -154.37 104.5 2.59 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 108.739 -0.837 . . . . 75.420000000000002 108.739 176.362 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 55.9 m-70 -84.84 159.03 20.47 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.805 0.842 . . . . 73.409999999999997 110.78 178.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 14.1 t-80 -143.06 -13.52 0.72 Allowed 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.896 0.878 . . . . 74.409999999999997 110.831 175.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 34.3 m170 . . . . . 0 CA--C 1.557 1.228 0 C-N-CA 122.839 0.455 . . . . 75.409999999999997 110.387 176.462 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.6 ttm . . . . . 0 N--CA 1.478 0.965 0 N-CA-C 109.914 -0.402 . . . . 72.019999999999996 109.914 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.7 m -99.4 36.59 1.72 Allowed 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.979 0.912 . . . . 72.049999999999997 110.174 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -69.45 80.97 0.29 Allowed Glycine 0 C--N 1.354 1.573 0 CA-C-N 115.482 -0.781 . . . . 73.340000000000003 112.379 -178.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.72 144.75 29.65 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.167 0.587 . . . . 74.349999999999994 109.847 -172.349 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.486 ' HA ' ' HA ' ' A' ' 26' ' ' TYR . 5.8 ttpm? -86.71 113.1 22.28 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 108.931 -0.766 . . . . 71.549999999999997 108.931 173.398 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.462 HG21 HG23 ' A' ' 62' ' ' VAL . 1.6 p -100.35 138.09 25.75 Favored 'Isoleucine or valine' 0 C--O 1.241 0.636 0 N-CA-C 107.544 -1.28 . . . . 65.540000000000006 107.544 170.165 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.514 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 40.2 mt-10 -100.16 113.12 25.54 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 107.445 -1.317 . . . . 60.009999999999998 107.445 176.024 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.414 HG13 HG23 ' A' ' 60' ' ' ILE . 90.0 t -95.38 107.25 19.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 N-CA-C 108.033 -1.099 . . . . 74.120000000000005 108.033 -176.898 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -95.08 100.1 11.98 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 108.294 -1.002 . . . . 74.219999999999999 108.294 -175.526 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 64.1 t -95.09 107.98 20.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 N-CA-C 108.968 -0.753 . . . . 60.43 108.968 -177.28 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.0 ttmm -109.82 103.65 12.49 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 108.356 -0.979 . . . . 71.0 108.356 -179.48 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.496 HD13 HG13 ' A' ' 48' ' ' ILE . 15.0 tt -112.29 123.35 67.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 CA-C-O 121.22 0.534 . . . . 74.409999999999997 110.618 -176.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 17.4 m -100.16 103.3 14.77 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 108.726 -0.842 . . . . 75.420000000000002 108.726 -179.033 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 35.1 t -113.73 129.17 56.61 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.784 0.833 . . . . 73.239999999999995 110.004 -178.717 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 72.08 -72.64 0.11 Allowed 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 125.584 1.553 . . . . 61.140000000000001 110.934 176.278 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -163.93 16.54 0.11 Allowed Glycine 0 C--N 1.34 0.793 0 CA-C-O 119.924 -0.375 . . . . 61.420000000000002 112.21 176.512 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -127.92 156.05 43.24 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.741 0.816 . . . . 73.319999999999993 110.638 -179.098 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 62.2 m -104.23 121.72 43.88 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.166 0.986 . . . . 62.119999999999997 109.814 179.151 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 39.6 m-85 -116.11 105.28 12.43 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 108.084 -1.08 . . . . 70.019999999999996 108.084 178.424 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -135.76 154.61 51.18 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 112.291 0.478 . . . . 70.219999999999999 112.291 -173.8 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 75.4 ttt180 -161.52 140.81 10.06 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 114.942 -1.026 . . . . 61.100000000000001 109.65 177.116 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 88.4 m -90.86 114.52 26.97 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 123.818 0.847 . . . . 73.349999999999994 109.208 174.448 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -98.17 129.77 44.94 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.549 0.74 . . . . 74.530000000000001 109.871 -178.162 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -89.95 108.31 19.64 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 108.104 -1.073 . . . . 71.040000000000006 108.104 178.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 82.9 mt -122.96 100.95 7.15 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.326 0.65 . . . . 62.509999999999998 109.83 -173.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.486 ' HA ' ' HA ' ' A' ' 5' ' ' LYS . 80.0 t80 -84.18 131.95 34.71 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 109.637 -0.505 . . . . 75.219999999999999 109.637 172.886 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.567 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -132.63 149.89 52.24 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.399 0.68 . . . . 74.140000000000001 109.445 175.97 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 60.6 t -87.76 -36.66 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-O 122.035 0.921 . . . . 75.340000000000003 109.442 176.69 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.42 ' O ' ' HB1' ' A' ' 27' ' ' ALA . 84.0 mtt180 -121.31 155.93 33.65 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 107.217 -1.401 . . . . 72.230000000000004 107.217 170.121 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.474 ' HB3' ' HZ3' ' A' ' 76' ' ' LYS . 8.3 p-10 -56.51 -30.28 62.84 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.265 0.626 . . . . 74.540000000000006 110.602 166.561 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -65.3 -28.95 69.68 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.646 1.178 . . . . 65.430000000000007 112.086 176.673 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.567 ' HB2' ' HB1' ' A' ' 27' ' ' ALA . 19.9 mm-40 -67.98 -32.78 73.44 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 110.511 -0.181 . . . . 65.310000000000002 110.511 176.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.722 HD22 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -71.34 -16.81 62.45 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.585 0.754 . . . . 72.420000000000002 111.334 -177.08 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -53.51 -64.89 0.68 Allowed 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.554 0.741 . . . . 65.319999999999993 111.949 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -59.67 -30.16 68.56 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 124.218 0.949 . . . . 62.130000000000003 112.383 -178.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.722 ' HD2' HD22 ' A' ' 33' ' ' LEU . 50.4 mttm -66.1 -47.09 75.35 Favored 'General case' 0 C--N 1.355 0.814 0 C-N-CA 123.099 0.56 . . . . 75.230000000000004 110.06 178.31 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.581 HD13 HD23 ' A' ' 81' ' ' LEU . 85.1 mt -59.54 -43.74 93.43 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 124.128 0.893 . . . . 72.450000000000003 110.993 177.456 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.599 ' HA ' HD11 ' A' ' 88' ' ' LEU . 54.3 mtpt -58.3 -50.95 71.8 Favored 'General case' 0 C--N 1.358 0.939 0 O-C-N 123.999 0.812 . . . . 73.310000000000002 111.1 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -66.18 -47.0 75.38 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 123.537 0.523 . . . . 64.439999999999998 111.328 -178.761 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 40.3 t -54.68 -43.73 67.18 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 C-N-CA 123.73 0.812 . . . . 64.310000000000002 111.542 179.269 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.65 HD21 HD11 ' A' ' 60' ' ' ILE . 46.7 mt -66.15 -48.51 70.54 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.206 0.603 . . . . 73.430000000000007 111.246 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -58.61 -49.21 78.3 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.229 0.611 . . . . 74.25 111.439 179.389 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -66.8 -40.02 87.94 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.407 1.083 . . . . 71.310000000000002 111.565 -176.203 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -66.09 -41.14 91.05 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 123.452 0.47 . . . . 75.409999999999997 110.714 176.325 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.473 ' SD ' ' OH ' ' A' ' 90' ' ' TYR . 48.1 mtp -92.49 -7.98 45.88 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 113.905 1.076 . . . . 62.43 113.905 -172.072 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -67.24 -44.8 49.34 Favored Pre-proline 0 CA--C 1.564 1.494 0 CA-C-O 118.995 -0.526 . . . . 73.019999999999996 111.581 -179.695 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.409 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 59.5 Cg_endo -71.2 -22.93 25.07 Favored 'Trans proline' 0 C--N 1.386 2.536 0 C-N-CA 121.692 1.595 . . . . 60.130000000000003 113.139 169.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.521 HD13 HD12 ' A' ' 51' ' ' LEU . 43.5 mm -66.64 -32.67 59.09 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 C-N-CA 123.494 0.717 . . . . 74.230000000000004 110.487 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.435 ' HG3' ' O ' ' A' ' 45' ' ' MET . 90.2 mttt -55.97 -50.45 70.76 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-O 121.512 0.672 . . . . 65.109999999999999 109.268 172.882 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.568 ' HG3' ' HG3' ' A' ' 114' ' ' GLU . 37.5 ttpt -65.55 -29.34 69.94 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 114.044 -1.434 . . . . 64.510000000000005 111.48 -177.383 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.521 HD12 HD13 ' A' ' 48' ' ' ILE . 87.8 mt -71.76 -29.5 64.57 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 122.588 0.355 . . . . 72.239999999999995 110.759 175.605 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 72.13 84.25 0.23 Allowed Glycine 0 C--N 1.35 1.336 0 O-C-N 123.763 0.664 . . . . 53.219999999999999 113.082 170.427 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 1.2 p -131.64 134.08 45.6 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.322 0.649 . . . . 61.43 111.234 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -72.3 -37.07 69.07 Favored 'General case' 0 C--N 1.356 0.869 0 C-N-CA 124.302 1.041 . . . . 71.140000000000001 110.586 -178.634 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 41.8 ttm180 -127.42 131.96 50.17 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 109.627 -0.509 . . . . 72.25 109.627 175.642 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 31.5 m -120.37 137.66 53.44 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 124.961 1.304 . . . . 73.540000000000006 108.385 171.129 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.422 ' O ' ' HA ' ' A' ' 12' ' ' ILE . 24.9 ttm180 -108.26 106.61 16.85 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 108.304 -0.999 . . . . 75.349999999999994 108.304 173.191 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.432 HD11 ' SD ' ' A' ' 45' ' ' MET . 30.9 mt -96.72 105.38 17.03 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 N-CA-C 108.187 -1.042 . . . . 71.030000000000001 108.187 178.062 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 27.7 t -105.13 103.21 12.71 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 107.844 -1.169 . . . . 72.329999999999998 107.844 -179.558 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.65 HD11 HD21 ' A' ' 41' ' ' LEU . 66.6 mt -101.2 121.67 52.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 123.625 0.77 . . . . 75.549999999999997 109.829 -176.809 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -102.14 134.72 44.93 Favored 'General case' 0 C--O 1.241 0.611 0 N-CA-C 109.35 -0.611 . . . . 55.25 109.35 175.771 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.462 HG23 HG21 ' A' ' 6' ' ' VAL . 7.3 p -95.93 116.44 37.72 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.047 0 N-CA-C 106.975 -1.491 . . . . 74.319999999999993 106.975 173.147 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.514 ' HB3' ' H ' ' A' ' 7' ' ' GLU . 24.2 tptm -90.57 110.36 21.5 Favored 'General case' 0 C--O 1.239 0.529 0 O-C-N 121.366 -0.834 . . . . 75.219999999999999 108.903 -176.849 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 18.7 p80 -110.56 111.5 22.77 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.356 1.063 . . . . 63.100000000000001 108.558 178.719 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 27.7 t -70.9 -30.72 67.16 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 122.979 0.512 . . . . 70.140000000000001 110.425 177.4 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -85.64 155.44 21.12 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.009 0.924 . . . . 62.119999999999997 110.276 177.248 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.05 -8.65 11.19 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.143 0.977 . . . . 23.219999999999999 112.375 -176.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -86.22 -68.67 0.72 Allowed 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.068 0.547 . . . . 64.150000000000006 111.652 -175.822 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -76.1 -17.63 59.52 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.385 1.074 . . . . 75.209999999999994 112.685 -174.107 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -58.12 -26.07 62.18 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 114.14 1.163 . . . . 72.530000000000001 114.14 -170.785 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.5 pttp -66.56 -38.42 87.05 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 123.409 0.684 . . . . 74.510000000000005 110.943 174.246 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -70.5 -44.8 66.89 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.794 0.838 . . . . 51.32 109.322 173.031 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.504 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 24.3 mm-40 -68.52 -17.89 64.26 Favored 'General case' 0 C--N 1.353 0.746 0 O-C-N 124.389 1.055 . . . . 71.120000000000005 111.97 -176.018 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.14 -54.77 18.15 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 122.766 0.426 . . . . 64.319999999999993 110.538 174.298 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 50.3 mtpt -63.77 -41.14 98.03 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 124.265 0.978 . . . . 74.319999999999993 111.178 177.437 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.504 ' HB3' ' HA ' ' A' ' 73' ' ' GLU . 50.2 tttm -65.93 -42.16 90.43 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.257 1.423 . . . . 73.219999999999999 111.232 -178.03 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -79.1 -21.85 46.06 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.485 0.714 . . . . 74.510000000000005 110.815 176.561 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.2 -42.73 99.37 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 122.664 0.386 . . . . 60.030000000000001 110.418 176.275 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.64 -35.39 77.79 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.359 0.664 . . . . 64.140000000000001 111.259 176.351 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 49.3 mm -64.57 -46.31 92.95 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.801 0 C-N-CA 124.212 1.005 . . . . 74.420000000000002 110.297 174.863 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.581 HD23 HD13 ' A' ' 37' ' ' LEU . 48.1 mt -64.67 -48.1 76.0 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.683 0.793 . . . . 72.140000000000001 111.52 -178.872 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 61.9 m-80 -62.35 -34.14 76.08 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 123.669 0.606 . . . . 72.430000000000007 111.446 -173.807 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.8 mmmm -72.64 -37.28 68.05 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 123.261 0.351 . . . . 75.239999999999995 111.785 176.674 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.496 HG13 ' HG2' ' A' ' 38' ' ' LYS . 40.4 t -66.61 -52.54 44.69 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.121 0 C-N-CA 123.474 0.71 . . . . 73.310000000000002 110.168 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.572 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 29.9 m-85 -56.25 -42.98 78.25 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 124.36 1.038 . . . . 74.319999999999993 111.229 176.746 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -59.87 -34.0 72.56 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.788 0.835 . . . . 52.310000000000002 112.4 179.574 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -86.37 -15.44 40.44 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.353 0.661 . . . . 55.420000000000002 112.429 -176.278 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.599 HD11 ' HA ' ' A' ' 38' ' ' LYS . 78.2 mt -106.57 -9.51 16.56 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 112.474 0.546 . . . . 72.430000000000007 112.474 -171.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 118.51 14.4 6.36 Favored Glycine 0 N--CA 1.478 1.44 0 N-CA-C 113.918 0.327 . . . . 62.310000000000002 113.918 174.388 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.572 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 12.6 m-85 -109.2 150.08 28.43 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 108.745 -0.835 . . . . 74.209999999999994 108.745 174.651 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -86.12 166.89 15.43 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 109.697 -0.483 . . . . 75.25 109.697 171.029 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -88.48 32.38 0.78 Allowed 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 121.541 0.686 . . . . 31.309999999999999 110.062 174.359 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 79.2 p -110.46 -28.36 8.57 Favored 'General case' 0 C--N 1.343 0.325 0 C-N-CA 125.065 1.346 . . . . 43.219999999999999 108.112 176.018 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -76.97 -9.54 58.76 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.122 -0.944 . . . . 73.510000000000005 110.957 178.342 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 23.3 t -89.34 99.26 9.05 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.796 0 N-CA-C 108.751 -0.833 . . . . 73.329999999999998 108.751 -175.331 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 59.5 m -126.22 106.14 9.33 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.609 0.763 . . . . 60.350000000000001 109.636 -176.556 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 56.1 m95 -77.04 111.88 13.08 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.318 0.647 . . . . 73.120000000000005 110.461 177.028 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -108.44 95.17 5.48 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 105.437 -2.06 . . . . 73.120000000000005 105.437 170.053 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 64.95 -121.87 22.76 Favored Glycine 0 C--N 1.345 1.035 0 O-C-N 123.741 0.65 . . . . 61.240000000000002 112.106 -172.3 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -90.89 0.33 57.52 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.763 0.825 . . . . 52.32 111.444 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 63.5 m -119.48 118.95 32.46 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.543 0.737 . . . . 45.200000000000003 110.362 -169.834 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.476 HG11 HD13 ' A' ' 81' ' ' LEU . 7.2 p -91.9 128.02 43.82 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.184 0 N-CA-C 109.052 -0.722 . . . . 64.040000000000006 109.052 173.96 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 40.5 m -105.08 112.24 25.29 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.567 0.747 . . . . 64.439999999999998 109.129 178.799 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 78.7 t -114.91 113.01 42.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 125.262 1.425 . . . . 75.340000000000003 108.112 179.54 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.4 145.65 46.98 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 109.217 -0.66 . . . . 72.439999999999998 109.217 -179.614 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 161.77 -147.91 14.78 Favored Glycine 0 C--N 1.332 0.35 0 N-CA-C 110.917 -0.873 . . . . 31.210000000000001 110.917 -173.41 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 5.0 pm0 -142.1 165.07 28.45 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 117.226 0.513 . . . . 62.130000000000003 110.103 177.76 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.61 ' H ' HD13 ' A' ' 108' ' ' LEU . 0.0 OUTLIER -100.78 159.61 15.04 Favored 'General case' 0 C--O 1.243 0.729 0 C-N-CA 123.819 0.848 . . . . 72.420000000000002 109.436 173.109 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -97.29 113.49 25.12 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 109.151 -0.685 . . . . 72.519999999999996 109.151 170.238 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -143.35 104.59 0.35 Allowed Glycine 0 C--N 1.335 0.492 0 N-CA-C 109.981 -1.247 . . . . 75.109999999999999 109.981 176.631 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 28.6 m -70.87 -31.52 45.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 CA-C-O 120.857 0.361 . . . . 70.439999999999998 110.422 177.326 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -104.44 104.3 14.15 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 108.331 -0.988 . . . . 73.540000000000006 108.331 176.196 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.413 HD22 ' O ' ' A' ' 49' ' ' LYS . 33.0 mt -98.51 -65.35 0.97 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 106.925 -1.509 . . . . 75.450000000000003 106.925 170.114 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.568 ' HG3' ' HG3' ' A' ' 50' ' ' LYS . 24.4 mt-10 -152.99 133.63 13.79 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.267 1.427 . . . . 74.150000000000006 108.46 167.947 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 68.0 m-70 -76.82 164.97 25.33 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 108.597 -0.89 . . . . 73.120000000000005 108.597 167.619 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 29.4 t-80 -88.33 34.44 0.75 Allowed 'General case' 0 N--CA 1.486 1.337 0 CA-C-O 122.075 0.94 . . . . 73.099999999999994 110.005 176.427 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 82.2 t60 -71.63 -25.71 62.26 Favored 'General case' 0 C--N 1.347 0.482 0 C-N-CA 124.427 1.091 . . . . 63.049999999999997 111.263 179.423 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 45.2 t60 -61.74 98.11 0.09 Allowed 'General case' 0 C--N 1.354 0.788 0 CA-C-O 121.823 0.821 . . . . 70.129999999999995 111.104 -177.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 64.8 m80 -116.73 -41.78 3.03 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 106.187 -1.783 . . . . 73.540000000000006 106.187 165.181 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 56.9 t-80 . . . . . 0 C--O 1.253 1.279 0 CA-C-N 113.962 -1.472 . . . . 73.310000000000002 107.471 172.825 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.7 mmm . . . . . 0 N--CA 1.477 0.898 0 N-CA-C 109.792 -0.447 . . . . 62.130000000000003 109.792 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.8 p -100.35 100.39 11.17 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.044 0.937 . . . . 71.140000000000001 108.504 173.206 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 168.4 72.28 0.03 OUTLIER Glycine 0 C--N 1.341 0.82 0 N-CA-C 110.399 -1.08 . . . . 74.209999999999994 110.399 -177.147 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 63.4 mttm -103.96 127.88 51.49 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.617 0.767 . . . . 51.350000000000001 111.397 -174.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.437 ' HE3' ' HB3' ' A' ' 5' ' ' LYS . 1.0 OUTLIER -101.13 105.25 16.38 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 106.635 -1.617 . . . . 75.099999999999994 106.635 169.664 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.3 p -98.79 144.77 11.22 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 N-CA-C 109.083 -0.71 . . . . 72.409999999999997 109.083 176.341 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.485 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 41.0 mt-10 -100.46 110.6 22.79 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 107.49 -1.3 . . . . 73.519999999999996 107.49 170.03 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.454 HG21 HD12 ' A' ' 25' ' ' LEU . 77.2 t -99.54 106.68 19.41 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 125.072 1.349 . . . . 63.450000000000003 108.282 -179.372 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -98.73 100.28 11.48 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 107.824 -1.176 . . . . 72.319999999999993 107.824 -176.404 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.443 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 95.8 t -93.69 103.08 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 N-CA-C 108.605 -0.887 . . . . 74.420000000000002 108.605 -176.875 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.432 ' HA ' ' HB3' ' A' ' 20' ' ' GLU . 22.5 ttmm -109.61 102.85 11.65 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 108.021 -1.103 . . . . 74.109999999999999 108.021 -178.111 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.528 HD13 HG13 ' A' ' 48' ' ' ILE . 13.7 tt -112.82 141.83 27.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 109.46 -0.57 . . . . 71.519999999999996 109.46 -179.332 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 45.0 m -121.22 133.05 55.15 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.591 0.756 . . . . 75.239999999999995 110.031 -178.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 19.6 t -160.31 133.88 6.95 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.599 1.16 . . . . 40.210000000000001 110.015 176.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 29.7 m120 63.92 23.45 13.34 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 124.705 1.202 . . . . 75.329999999999998 112.17 -178.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 74.72 16.21 80.37 Favored Glycine 0 C--N 1.35 1.333 0 CA-C-N 116.307 -0.406 . . . . 70.420000000000002 113.013 -174.908 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.3 mmpt? -118.71 122.26 42.06 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.977 0.911 . . . . 74.010000000000005 109.859 178.765 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 89.9 m -98.46 121.5 40.47 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 123.15 0.58 . . . . 75.239999999999995 110.122 178.395 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.1 m-85 -106.17 111.11 23.59 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 107.364 -1.347 . . . . 63.140000000000001 107.364 176.736 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.443 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 0.8 OUTLIER -140.51 155.47 46.63 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 112.393 0.516 . . . . 54.210000000000001 112.393 -173.575 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 40.8 ttm180 -168.32 145.06 3.93 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.003 0.921 . . . . 74.200000000000003 109.549 175.108 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 53.5 m -85.47 112.29 20.76 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.669 0.787 . . . . 71.340000000000003 109.05 172.047 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -98.88 138.85 35.41 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.761 0.824 . . . . 72.540000000000006 109.111 178.623 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 26.2 mp0 -104.89 109.43 21.4 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 107.616 -1.253 . . . . 75.129999999999995 107.616 -178.512 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.454 HD12 HG21 ' A' ' 8' ' ' VAL . 81.6 mt -117.02 102.6 9.47 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.865 0.866 . . . . 64.120000000000005 109.322 -175.266 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.427 ' O ' ' HE3' ' A' ' 36' ' ' LYS . 72.5 t80 -94.67 126.27 39.86 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.308 0.643 . . . . 73.219999999999999 109.612 176.741 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.502 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -139.95 153.21 46.85 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.808 0.843 . . . . 72.400000000000006 109.5 175.171 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 47.2 t -74.86 -58.68 4.26 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 N-CA-C 108.664 -0.865 . . . . 72.129999999999995 108.664 174.792 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.505 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 79.2 mtt180 -101.42 168.21 9.66 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 115.571 -0.74 . . . . 54.530000000000001 111.223 -178.874 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.8 -46.15 76.11 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.448 1.499 . . . . 75.109999999999999 110.038 -178.885 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -60.22 -30.15 69.2 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 113.774 -1.557 . . . . 75.219999999999999 111.766 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.505 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 37.4 mm-40 -71.34 -24.58 62.13 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.49 0.716 . . . . 65.209999999999994 111.645 -178.738 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.68 -28.31 61.68 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 122.917 0.487 . . . . 74.239999999999995 110.034 178.843 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.433 ' HE2' ' HB3' ' A' ' 34' ' ' LYS . 39.5 mtpt -52.59 -56.85 12.43 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 123.351 0.66 . . . . 74.420000000000002 112.477 -176.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.461 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 2.8 pp20? -59.65 -32.62 70.63 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 123.993 0.808 . . . . 73.329999999999998 112.153 -175.511 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.427 ' HE3' ' O ' ' A' ' 26' ' ' TYR . 55.3 mttm -67.85 -46.49 71.62 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.296 0.639 . . . . 74.040000000000006 110.206 177.825 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 72.5 mt -58.38 -42.42 87.0 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.168 0.987 . . . . 73.510000000000005 110.844 177.755 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -62.41 -40.98 98.29 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.095 0.958 . . . . 61.149999999999999 111.266 178.866 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 74.3 mmtt -63.46 -51.68 64.65 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 123.434 0.459 . . . . 73.340000000000003 110.837 175.707 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 92.3 t -60.36 -37.95 76.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 124.171 0.988 . . . . 73.230000000000004 111.629 -177.473 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.472 HD21 HD11 ' A' ' 60' ' ' ILE . 65.2 mt -68.46 -51.15 46.75 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 122.901 0.48 . . . . 55.240000000000002 110.257 178.8 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -61.76 -30.51 70.83 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.169 0.588 . . . . 71.409999999999997 111.725 178.906 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -67.56 -53.13 30.98 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.243 0.617 . . . . 72.430000000000007 110.721 175.082 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.417 ' HA ' ' NE ' ' A' ' 44' ' ' ARG . 0.0 OUTLIER -74.97 -26.92 59.93 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 123.324 0.39 . . . . 64.219999999999999 111.763 -173.073 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.578 ' HB3' ' HE3' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -82.04 -27.92 32.75 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.594 0.758 . . . . 64.099999999999994 112.014 -179.405 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -56.99 -52.48 73.77 Favored Pre-proline 0 CA--C 1.562 1.438 0 N-CA-C 113.025 0.75 . . . . 63.450000000000003 113.025 -173.691 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.426 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 41.9 Cg_endo -64.24 -30.99 64.31 Favored 'Trans proline' 0 C--N 1.385 2.453 0 C-N-CA 121.775 1.65 . . . . 44.439999999999998 111.793 176.191 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.528 HG13 HD13 ' A' ' 12' ' ' ILE . 44.8 mm -74.9 -33.34 29.77 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.046 0 C-N-CA 123.999 0.919 . . . . 65.420000000000002 111.003 -174.408 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.578 ' HE3' ' HB3' ' A' ' 45' ' ' MET . 98.9 mttt -70.17 -34.36 72.89 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.39 0.676 . . . . 73.510000000000005 109.743 175.429 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -72.87 -29.22 63.01 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.884 0.874 . . . . 73.340000000000003 110.901 175.371 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 73.6 mt -71.81 -29.74 64.76 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 109.317 -0.623 . . . . 72.019999999999996 109.317 173.642 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 71.52 54.11 9.14 Favored Glycine 0 C--N 1.351 1.4 0 O-C-N 123.791 0.682 . . . . 73.439999999999998 111.982 176.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.492 ' SG ' HG23 ' A' ' 48' ' ' ILE . 12.7 m -73.35 122.0 21.34 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 122.98 0.512 . . . . 72.519999999999996 110.391 -179.321 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -67.4 -25.1 65.78 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.763 0.825 . . . . 75.129999999999995 110.807 177.75 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 16.8 tpp180 -140.38 129.15 23.11 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.132 0.973 . . . . 72.140000000000001 108.931 175.535 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 19.7 m -118.22 143.53 28.78 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 123.298 0.639 . . . . 70.019999999999996 109.601 170.747 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.491 ' HG3' ' HG2' ' A' ' 105' ' ' GLU . 52.0 ttt-85 -131.52 106.43 8.21 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 108.814 -0.81 . . . . 71.25 108.814 172.381 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.418 ' HB ' ' HB ' ' A' ' 104' ' ' VAL . 39.3 mt -99.6 129.42 50.18 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 C-N-CA 124.922 1.289 . . . . 62.450000000000003 107.539 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.2 m -120.68 103.3 9.02 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 107.464 -1.309 . . . . 70.319999999999993 107.464 179.531 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.472 HD11 HD21 ' A' ' 41' ' ' LEU . 73.2 mt -98.77 104.95 16.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 N-CA-C 108.884 -0.784 . . . . 72.329999999999998 108.884 -177.409 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.23 109.99 22.36 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 108.4 -0.963 . . . . 73.109999999999999 108.4 -176.339 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 21.9 t -95.03 127.0 47.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 C-N-CA 124.468 1.107 . . . . 61.420000000000002 110.089 -174.222 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.485 ' HB3' ' H ' ' A' ' 7' ' ' GLU . 3.9 tppp? -87.6 102.52 14.69 Favored 'General case' 0 C--O 1.24 0.565 0 N-CA-C 108.717 -0.845 . . . . 72.430000000000007 108.717 177.627 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 36.7 m80 -71.61 140.92 49.96 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 123.402 0.439 . . . . 75.310000000000002 110.114 178.444 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 17.2 m -62.39 -46.57 88.01 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.698 1.199 . . . . 71.019999999999996 112.532 -166.339 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -141.71 153.24 44.51 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 122.723 0.409 . . . . 62.049999999999997 110.992 -172.763 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -74.57 -15.44 60.84 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 124.196 0.999 . . . . 74.439999999999998 112.803 -175.121 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -86.14 -44.93 11.82 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 122.763 0.425 . . . . 64.319999999999993 109.887 171.43 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -66.28 -35.14 79.63 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-N 115.575 -0.738 . . . . 75.219999999999999 112.551 -177.318 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -43.59 -38.43 2.99 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 115.038 1.496 . . . . 54.140000000000001 115.038 -167.492 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -67.11 -41.97 85.31 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.412 0.685 . . . . 71.409999999999997 111.039 -177.436 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 18.2 tppt? -77.53 -35.74 53.04 Favored 'General case' 0 C--O 1.241 0.642 0 C-N-CA 123.72 0.808 . . . . 75.219999999999999 109.837 174.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.676 ' HG3' ' HD2' ' A' ' 76' ' ' LYS . 34.9 tt0 -74.29 -15.19 60.97 Favored 'General case' 0 C--N 1.351 0.673 0 CA-C-N 115.533 -0.758 . . . . 73.329999999999998 111.345 -175.124 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.77 -62.2 1.64 Allowed 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 108.685 -0.857 . . . . 63.030000000000001 108.685 171.004 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 57.8 tttm -65.1 -24.56 67.47 Favored 'General case' 0 N--CA 1.481 1.1 0 O-C-N 123.514 0.508 . . . . 72.430000000000007 111.715 -179.516 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.676 ' HD2' ' HG3' ' A' ' 73' ' ' GLU . 3.4 ttmp? -59.54 -60.45 3.83 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.93 0.892 . . . . 65.549999999999997 110.685 172.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -77.31 -21.73 53.05 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 115.549 -0.75 . . . . 73.040000000000006 109.961 -174.565 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.42 ' HA ' ' CE2' ' A' ' 97' ' ' TRP . . . -64.11 -43.47 95.24 Favored 'General case' 0 C--N 1.345 0.406 0 C-N-CA 123.488 0.715 . . . . 62.020000000000003 110.142 172.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.88 -48.26 79.75 Favored 'General case' 0 C--N 1.349 0.561 0 O-C-N 124.142 0.901 . . . . 42.219999999999999 110.752 175.532 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.419 ' O ' HG23 ' A' ' 84' ' ' VAL . 38.1 mm -62.54 -50.59 79.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 O-C-N 123.944 0.778 . . . . 71.430000000000007 111.41 -175.204 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 10.7 mt -67.03 -39.11 86.92 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-O 119.253 -0.403 . . . . 74.109999999999999 111.035 -179.312 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -61.09 -36.87 80.81 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 122.967 0.507 . . . . 73.010000000000005 110.65 -179.274 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.494 ' O ' ' HG2' ' A' ' 87' ' ' GLU . 33.2 mmtp -71.31 -37.33 71.81 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 115.482 -0.781 . . . . 44.25 111.04 175.907 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 80' ' ' ILE . 53.8 t -64.64 -38.57 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 123.539 0.736 . . . . 61.32 110.402 178.576 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.565 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 22.0 m-85 -64.34 -36.02 82.78 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 114.955 -1.021 . . . . 73.420000000000002 110.431 174.907 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -73.77 -23.5 59.72 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 123.683 0.793 . . . . 75.319999999999993 111.652 175.693 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 83' ' ' LYS . 37.6 mm-40 -74.71 -29.72 61.29 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.024 0.53 . . . . 64.400000000000006 111.718 176.35 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 82.1 mt -108.35 -18.87 13.64 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.174 0.59 . . . . 74.230000000000004 111.781 -168.44 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 107.18 11.44 25.81 Favored Glycine 0 C--N 1.347 1.174 0 N-CA-C 114.6 0.6 . . . . 50.539999999999999 114.6 174.22 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.565 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 87.7 m-85 -72.1 120.21 17.39 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 108.807 -0.812 . . . . 74.430000000000007 108.807 171.682 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.411 ' O ' HG23 ' A' ' 95' ' ' VAL . 35.2 m-80 -77.6 165.07 24.75 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.671 0.788 . . . . 61.399999999999999 110.329 -173.532 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -53.06 -44.42 67.46 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.771 0.828 . . . . 51.100000000000001 111.701 173.023 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 34.5 t -66.56 -8.51 27.4 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.231 1.012 . . . . 62.439999999999998 112.215 179.191 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ASN . . . . . 0.435 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 12.8 m120 -104.26 -11.03 17.44 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.409 0.684 . . . . 73.409999999999997 111.176 178.921 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 91' ' ' ASN . 57.6 t -109.87 113.46 44.28 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 C-N-CA 123.483 0.713 . . . . 64.340000000000003 109.925 -175.236 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 7.9 m -123.13 97.58 5.49 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.303 0.641 . . . . 71.25 110.159 175.192 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.42 ' CE2' ' HA ' ' A' ' 78' ' ' ALA . 5.1 m95 -74.17 150.08 40.59 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 122.892 0.477 . . . . 75.219999999999999 110.967 178.903 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -159.4 81.76 0.75 Allowed 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.361 0.664 . . . . 73.219999999999999 110.29 -178.703 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 70.08 -101.06 0.83 Allowed Glycine 0 CA--C 1.533 1.194 0 CA-C-N 115.237 -0.892 . . . . 72.25 113.581 174.856 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -90.77 -20.97 21.78 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.678 0.791 . . . . 62.5 111.093 177.791 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 17.0 m -114.64 128.81 56.52 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.198 0.599 . . . . 73.019999999999996 110.74 -169.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.411 HG12 ' HB ' ' A' ' 60' ' ' ILE . 10.3 p -99.91 130.87 48.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 N-CA-C 108.048 -1.093 . . . . 73.400000000000006 108.048 166.476 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 15.1 m -108.1 102.54 11.69 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.495 -0.928 . . . . 73.510000000000005 108.495 179.537 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.435 ' HA ' ' O ' ' A' ' 94' ' ' ASN . 41.0 t -92.91 109.01 21.06 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 N-CA-C 108.008 -1.108 . . . . 71.439999999999998 108.008 -179.184 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.491 ' HG2' ' HG3' ' A' ' 57' ' ' ARG . 42.1 mt-10 -121.55 112.43 18.47 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 107.21 -1.404 . . . . 72.340000000000003 107.21 -176.872 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -164.75 -167.23 24.99 Favored Glycine 0 C--O 1.246 0.88 0 C-N-CA 120.93 -0.652 . . . . 54.520000000000003 113.254 -173.527 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 27.4 pt20 -103.47 146.5 28.42 Favored 'General case' 0 C--O 1.24 0.575 0 C-N-CA 124.499 1.12 . . . . 74.120000000000005 109.833 -178.545 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.566 HD13 ' HA ' ' A' ' 49' ' ' LYS . 64.6 mt -79.5 158.89 27.14 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 115.459 -0.791 . . . . 64.109999999999999 110.865 172.912 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -77.42 75.3 3.98 Favored 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 125.324 1.45 . . . . 53.399999999999999 110.502 173.62 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -125.38 -58.81 0.17 Allowed Glycine 0 N--CA 1.471 1.032 0 CA-C-N 116.101 -0.499 . . . . 62.240000000000002 111.959 -175.687 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.6 t -67.23 -45.34 86.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 N-CA-C 108.853 -0.795 . . . . 64.109999999999999 108.853 177.611 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -81.02 116.74 21.12 Favored 'General case' 0 C--O 1.242 0.691 0 CA-C-N 114.567 -1.197 . . . . 75.25 108.683 175.065 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 67.3 mt -86.43 -14.04 44.47 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.659 0.784 . . . . 73.400000000000006 111.655 -174.392 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -85.22 64.46 8.69 Favored 'General case' 0 C--O 1.241 0.618 0 CA-C-O 121.659 0.742 . . . . 74.219999999999999 110.726 -175.707 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 16.4 t-160 -65.74 133.19 50.52 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 107.828 -1.175 . . . . 75.129999999999995 107.828 167.792 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 45.6 m80 -63.62 94.73 0.09 Allowed 'General case' 0 CA--C 1.54 0.588 0 O-C-N 123.728 0.643 . . . . 70.540000000000006 111.057 -177.798 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 55.7 m80 -78.29 148.47 33.84 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 114.621 -1.172 . . . . 72.439999999999998 108.245 173.13 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 47.3 p-80 -78.03 160.79 27.92 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 109.593 -0.521 . . . . 71.299999999999997 109.593 179.4 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 54.7 t60 -52.89 120.25 5.58 Favored 'General case' 0 N--CA 1.48 1.041 0 O-C-N 124.289 0.993 . . . . 63.140000000000001 112.316 -171.518 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 58.4 m-70 . . . . . 0 C--O 1.248 1.021 0 C-N-CA 124.157 0.983 . . . . 62.329999999999998 108.874 173.088 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.2 mtt . . . . . 0 N--CA 1.477 0.885 0 N-CA-C 109.291 -0.633 . . . . 62.530000000000001 109.291 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.8 t -77.81 -51.2 10.87 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 123.398 0.679 . . . . 61.340000000000003 110.934 -177.005 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -81.87 97.15 1.84 Allowed Glycine 0 C--N 1.347 1.178 0 N-CA-C 111.488 -0.645 . . . . 74.319999999999993 111.488 -179.703 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.546 ' HE2' ' HA ' ' A' ' 4' ' ' LYS . 8.1 mmpt? -115.15 170.33 8.44 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.689 0.795 . . . . 73.409999999999997 111.503 -175.959 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -88.35 98.43 11.6 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 108.163 -1.051 . . . . 53.210000000000001 108.163 178.075 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.448 HG23 HG23 ' A' ' 62' ' ' VAL . 0.2 OUTLIER -98.42 137.4 26.04 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 CA-C-N 114.104 -1.407 . . . . 74.120000000000005 107.516 177.69 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -107.29 114.06 27.85 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 108.412 -0.958 . . . . 75.519999999999996 108.412 176.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.447 HG13 HG23 ' A' ' 60' ' ' ILE . 93.5 t -98.98 107.73 21.04 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 C-N-CA 125.628 1.571 . . . . 70.319999999999993 108.987 -171.982 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.53 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 63.6 mt-30 -95.27 100.89 12.61 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 108.277 -1.008 . . . . 72.400000000000006 108.277 -174.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.529 HG13 HG23 ' A' ' 58' ' ' ILE . 88.4 t -93.02 104.66 15.95 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 C-N-CA 123.579 0.751 . . . . 62.240000000000002 109.382 -175.373 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.4 ttmm -102.91 102.27 12.34 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 107.714 -1.217 . . . . 55.32 107.714 178.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.519 HD11 HG21 ' A' ' 48' ' ' ILE . 12.4 tt -115.9 118.5 58.99 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 CA-C-O 121.157 0.503 . . . . 65.230000000000004 110.889 -174.606 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 19.8 m -97.09 102.97 14.86 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 108.879 -0.785 . . . . 75.450000000000003 108.879 178.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.616 ' SG ' HG23 ' A' ' 48' ' ' ILE . 42.2 t -120.0 125.75 49.13 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.876 1.27 . . . . 75.310000000000002 109.46 178.81 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.533 HD21 ' HB3' ' A' ' 51' ' ' LEU . 88.1 m-20 61.43 25.56 15.48 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 125.051 1.341 . . . . 71.409999999999997 112.115 -177.008 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.98 10.96 85.7 Favored Glycine 0 C--N 1.348 1.195 0 CA-C-N 115.718 -0.674 . . . . 72.450000000000003 113.467 -177.777 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -108.23 133.33 52.61 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.245 1.018 . . . . 64.439999999999998 108.982 176.041 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 49.6 m -106.24 118.03 35.58 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.072 0.549 . . . . 54.520000000000003 110.032 -173.503 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -111.56 101.96 10.33 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 107.243 -1.391 . . . . 75.25 107.243 179.279 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.416 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 14.1 pt-20 -116.95 134.51 54.66 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 122.038 -0.414 . . . . 74.319999999999993 110.46 179.249 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.8 ttt180 -155.35 141.05 18.02 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.657 -0.701 . . . . 74.129999999999995 110.075 -178.097 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 42.9 m -92.28 118.55 31.0 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 124.555 1.142 . . . . 63.009999999999998 110.151 178.432 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 89.6 m-85 -103.91 131.98 50.61 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.937 0.895 . . . . 64.430000000000007 110.332 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -91.49 110.13 21.44 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 108.814 -0.81 . . . . 71.140000000000001 108.814 -179.444 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 80.6 mt -118.98 112.89 20.16 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.674 0.79 . . . . 72.109999999999999 109.843 -179.559 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 88.0 t80 -110.2 138.79 46.1 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.619 0.767 . . . . 73.200000000000003 109.133 172.248 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.514 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -135.96 172.08 13.53 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.726 0.81 . . . . 70.510000000000005 110.075 177.644 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 24.0 t -98.01 -44.14 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 N-CA-C 108.749 -0.834 . . . . 72.129999999999995 108.749 168.78 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.592 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 92.9 mtt180 -116.71 158.3 24.05 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 115.464 -0.789 . . . . 72.019999999999996 110.501 178.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.437 ' HB2' HD11 ' A' ' 80' ' ' ILE . 15.9 p-10 -68.6 -29.14 67.59 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.909 0.883 . . . . 53.32 110.772 178.357 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.552 ' HA ' ' HD3' ' A' ' 34' ' ' LYS . 60.5 mm-40 -60.37 -40.87 92.35 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.488 0.715 . . . . 75.120000000000005 110.925 170.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.592 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 34.6 mm-40 -65.81 -28.16 68.79 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 116.082 -0.508 . . . . 75.109999999999999 110.601 178.96 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.43 -33.16 60.89 Favored 'General case' 0 CA--C 1.56 1.341 0 C-N-CA 122.917 0.487 . . . . 65.030000000000001 110.272 -179.108 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.552 ' HD3' ' HA ' ' A' ' 31' ' ' GLU . 53.3 mtpt -54.08 -55.47 27.18 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.924 0.89 . . . . 52.530000000000001 111.867 179.614 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.504 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 11.6 pt-20 -60.85 -35.98 77.98 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 115.293 -0.867 . . . . 73.299999999999997 111.384 -179.418 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.41 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 64.7 mttm -66.64 -41.05 88.91 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.259 0.624 . . . . 72.409999999999997 111.127 -178.314 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.542 HD13 HD23 ' A' ' 81' ' ' LEU . 94.3 mt -62.81 -40.93 98.91 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 123.746 0.654 . . . . 61.329999999999998 110.767 174.55 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -62.12 -41.71 98.5 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 122.765 0.426 . . . . 40.049999999999997 111.02 175.304 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.504 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 72.8 mmtt -63.94 -55.45 22.46 Favored 'General case' 0 N--CA 1.478 0.961 0 O-C-N 123.415 0.447 . . . . 75.299999999999997 110.275 178.607 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 51.7 t -54.56 -46.66 72.12 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.391 0 C-N-CA 124.541 1.136 . . . . 63.119999999999997 111.524 -178.883 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.431 ' O ' ' HG2' ' A' ' 45' ' ' MET . 67.1 mt -68.34 -41.0 81.36 Favored 'General case' 0 C--O 1.207 -1.14 0 CA-C-O 118.751 -0.643 . . . . 74.349999999999994 110.926 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -61.91 -43.02 99.7 Favored 'General case' 0 N--CA 1.492 1.662 0 CA-C-N 118.531 0.605 . . . . 35.439999999999998 111.857 176.171 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.493 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 21.6 mm-40 -61.32 -46.32 90.75 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 109.526 -0.546 . . . . 60.350000000000001 109.526 177.586 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -67.66 -41.1 84.3 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 114.989 -1.005 . . . . 74.140000000000001 111.481 -176.752 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.634 ' SD ' HD11 ' A' ' 58' ' ' ILE . 92.1 mmm -79.02 -21.36 47.07 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.025 0.53 . . . . 74.230000000000004 111.183 -175.715 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.501 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 13.9 t70 -57.67 -52.4 74.65 Favored Pre-proline 0 CA--C 1.565 1.556 0 N-CA-C 112.929 0.715 . . . . 73.409999999999997 112.929 -171.905 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.433 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 73.3 Cg_endo -71.75 -22.97 23.16 Favored 'Trans proline' 0 C--N 1.39 2.712 0 C-N-CA 121.805 1.67 . . . . 72.340000000000003 112.204 175.089 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.616 HG23 ' SG ' ' A' ' 14' ' ' CYS . 46.9 mm -74.21 -31.67 29.87 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 C-N-CA 124.58 1.152 . . . . 74.209999999999994 110.784 -175.771 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.58 ' HG2' HD11 ' A' ' 108' ' ' LEU . 49.2 mtmt -73.77 -34.58 64.75 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.216 0.606 . . . . 75.129999999999995 110.021 175.003 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -65.83 -27.21 68.08 Favored 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 124.343 1.057 . . . . 53.219999999999999 109.575 174.024 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.533 ' HB3' HD21 ' A' ' 15' ' ' ASN . 83.7 mt -75.27 -39.5 59.69 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 109.617 -0.512 . . . . 54.329999999999998 109.617 173.183 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 77.63 36.49 33.23 Favored Glycine 0 C--N 1.346 1.135 0 CA-C-N 115.237 -0.892 . . . . 65.120000000000005 114.076 174.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.411 ' O ' ' HB3' ' A' ' 108' ' ' LEU . 2.0 p -71.65 119.69 16.17 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 109.55 -0.537 . . . . 75.450000000000003 109.55 171.84 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.404 ' H ' ' HD2' ' A' ' 54' ' ' LYS . 8.9 mptt -70.36 -25.02 63.08 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 124.105 0.962 . . . . 74.5 110.804 -170.437 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 33.0 ttp-105 -129.07 125.74 37.9 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.173 0.989 . . . . 74.209999999999994 108.354 178.148 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 15.3 m -122.17 137.08 56.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 123.419 0.687 . . . . 60.219999999999999 109.44 177.679 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.486 ' O ' ' HA ' ' A' ' 12' ' ' ILE . 18.3 ttm180 -111.19 104.1 12.58 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 108.532 -0.914 . . . . 53.520000000000003 108.532 172.98 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.634 HD11 ' SD ' ' A' ' 45' ' ' MET . 59.4 mt -98.45 105.2 16.96 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 N-CA-C 108.029 -1.1 . . . . 71.25 108.029 174.259 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 27.1 m -101.85 104.34 15.07 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 107.713 -1.217 . . . . 61.219999999999999 107.713 179.106 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.447 HG23 HG13 ' A' ' 8' ' ' VAL . 50.7 mt -95.14 116.03 35.53 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 C-N-CA 123.641 0.776 . . . . 72.340000000000003 109.369 -177.13 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.53 ' HB2' ' HB2' ' A' ' 9' ' ' GLN . 33.1 mtm180 -100.87 113.94 27.34 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 107.395 -1.335 . . . . 71.430000000000007 107.395 174.941 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.448 HG23 HG23 ' A' ' 6' ' ' VAL . 3.2 p -92.43 126.92 44.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 N-CA-C 108.129 -1.063 . . . . 75.439999999999998 108.129 -178.89 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.8 ttpp -81.94 109.36 16.22 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 109.021 -0.733 . . . . 73.099999999999994 109.021 -177.558 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' HIS . . . . . 0.484 ' ND1' ' HB2' ' A' ' 70' ' ' GLU . 31.6 m170 -86.0 108.52 18.26 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 124.073 0.949 . . . . 63.32 109.055 -178.629 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 13.4 m -74.98 -25.87 59.16 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.181 0.992 . . . . 63.439999999999998 112.798 -169.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -146.15 128.01 15.39 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.041 0.536 . . . . 63.049999999999997 109.695 -175.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.29 -27.51 68.67 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 113.813 1.042 . . . . 65.349999999999994 113.813 -172.563 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -84.86 -36.58 21.46 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 122.658 0.383 . . . . 52.229999999999997 110.822 -179.845 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -77.51 -28.08 51.97 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 116.093 -0.503 . . . . 63.229999999999997 112.061 -178.693 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.624 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 0.1 OUTLIER -70.27 -13.11 62.02 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 113.865 1.061 . . . . 64.510000000000005 113.865 -169.301 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 49.0 mtmt -67.68 -51.75 46.01 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-O 121.735 0.779 . . . . 75.230000000000004 109.162 171.839 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -74.9 -31.36 61.54 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.414 1.486 . . . . 75.200000000000003 110.857 -179.011 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.624 ' HB3' ' HA ' ' A' ' 70' ' ' GLU . 0.1 OUTLIER -73.65 -49.23 27.01 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.77 0.828 . . . . 73.209999999999994 110.435 -177.678 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.417 ' HB2' ' CE1' ' A' ' 64' ' ' HIS . . . -64.61 -34.24 77.8 Favored 'General case' 0 N--CA 1.483 1.223 0 O-C-N 123.591 0.557 . . . . 73.109999999999999 111.571 177.525 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 54.8 tptt -58.79 -50.9 72.21 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 124.37 1.044 . . . . 73.239999999999995 109.346 174.862 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.503 ' O ' HG12 ' A' ' 80' ' ' ILE . 39.3 ttmt -68.28 -39.68 82.05 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 114.377 -1.283 . . . . 70.230000000000004 110.838 -178.68 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -75.02 -22.39 58.51 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.314 1.045 . . . . 74.430000000000007 110.071 -171.613 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -67.13 -43.3 82.73 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.483 0.713 . . . . 52.539999999999999 110.616 172.423 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.15 -37.35 85.46 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 115.667 -0.697 . . . . 74.329999999999998 110.763 175.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.503 HG12 ' O ' ' A' ' 76' ' ' LYS . 43.4 mm -62.7 -47.86 90.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 123.893 0.877 . . . . 72.400000000000006 110.188 177.481 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.542 HD23 HD13 ' A' ' 37' ' ' LEU . 39.8 mt -67.71 -33.78 75.58 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.692 0.797 . . . . 74.010000000000005 111.618 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -60.88 -40.84 94.51 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.01 0.524 . . . . 74.420000000000002 110.155 -178.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 49.0 mmtm -64.95 -45.02 87.48 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.672 -0.694 . . . . 65.239999999999995 110.957 176.229 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.511 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 77.4 t -64.81 -59.75 3.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 C-N-CA 123.342 0.657 . . . . 74.439999999999998 110.302 -172.459 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.541 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 30.4 m-85 -57.79 -42.67 84.64 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.116 0.967 . . . . 64.349999999999994 112.342 -177.506 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.02 -34.61 77.94 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.21 0.604 . . . . 55.009999999999998 111.323 179.36 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -89.1 1.14 56.04 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.05 0.94 . . . . 70.140000000000001 111.672 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 37.8 mt -106.11 -26.08 11.76 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.226 0.611 . . . . 74.340000000000003 110.73 175.043 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 124.49 -9.99 8.16 Favored Glycine 0 C--N 1.345 1.072 0 CA-C-O 119.913 -0.382 . . . . 62.299999999999997 112.989 -179.253 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.541 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 70.9 m-85 -79.12 127.8 32.47 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 122.774 0.43 . . . . 71.239999999999995 110.011 177.062 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -84.36 171.02 13.02 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.796 0.838 . . . . 72.439999999999998 109.877 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -56.77 -42.54 79.56 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.031 0.932 . . . . 74.349999999999994 111.642 178.617 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 30.9 t -56.23 -31.64 63.71 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.277 1.031 . . . . 54.340000000000003 112.949 178.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ASN . . . . . 0.458 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 14.1 m120 -65.24 -32.21 73.76 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 122.662 0.385 . . . . 71.329999999999998 111.653 179.492 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 58.9 t -88.86 127.35 41.7 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 C-N-CA 124.02 0.928 . . . . 70.219999999999999 110.427 -172.322 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 63.5 m -143.72 122.38 12.56 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.468 0.707 . . . . 74.450000000000003 110.665 172.562 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 75.2 m95 -87.89 124.47 33.71 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 123.522 0.729 . . . . 72.349999999999994 111.349 177.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -120.81 91.89 3.64 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 107.955 -1.128 . . . . 71.510000000000005 107.955 169.195 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 70.69 -125.81 13.89 Favored Glycine 0 C--N 1.346 1.086 0 CA-C-N 115.79 -0.641 . . . . 64.400000000000006 112.095 -177.72 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -81.96 -6.73 59.36 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.76 0.824 . . . . 72.019999999999996 111.389 178.797 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 76.6 m -103.07 149.73 24.3 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.816 0.846 . . . . 73.510000000000005 109.564 -179.01 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.8 p -130.38 116.73 37.07 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.942 0 C-N-CA 123.975 0.91 . . . . 64.209999999999994 108.604 169.67 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 57.0 m -93.71 117.3 29.92 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 108.219 -1.03 . . . . 72.420000000000002 108.219 176.658 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.458 ' HA ' ' O ' ' A' ' 94' ' ' ASN . 89.9 t -114.57 110.97 33.99 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 C-N-CA 124.258 1.023 . . . . 71.120000000000005 108.261 177.615 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -123.59 116.16 22.68 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 109.118 -0.697 . . . . 72.129999999999995 109.118 178.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -141.15 173.74 23.14 Favored Glycine 0 C--N 1.342 0.873 0 O-C-N 123.477 0.485 . . . . 42.439999999999998 112.425 -177.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -78.84 118.69 21.12 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 122.592 0.357 . . . . 71.219999999999999 110.101 177.872 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.58 HD11 ' HG2' ' A' ' 49' ' ' LYS . 41.2 tp -90.44 149.25 22.32 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 108.683 -0.858 . . . . 75.519999999999996 108.683 167.062 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 70.71 9.88 6.95 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 124.701 1.2 . . . . 63.219999999999999 111.705 177.145 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -78.08 -52.29 5.37 Favored Glycine 0 C--N 1.347 1.177 0 CA-C-N 116.145 -0.48 . . . . 73.109999999999999 111.904 177.887 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 28.3 m -82.8 -14.37 11.97 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 C-N-CA 123.215 0.606 . . . . 62.450000000000003 111.522 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -142.65 98.05 3.22 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.933 0.893 . . . . 63.109999999999999 108.66 -174.777 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 66.6 mt -76.55 -54.19 7.04 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 123.362 0.665 . . . . 63.210000000000001 110.993 -171.526 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -79.76 96.68 6.34 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.317 0.647 . . . . 74.239999999999995 112.634 -170.68 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 32.9 m170 -106.98 -13.74 15.12 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.951 0.9 . . . . 75.019999999999996 110.713 172.497 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -71.38 -59.56 2.7 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 108.945 -0.761 . . . . 65.340000000000003 108.945 172.706 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 16.7 m-70 -80.81 84.88 6.23 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 108.258 -1.016 . . . . 74.129999999999995 108.258 172.24 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 54.4 t-80 -148.63 86.66 1.53 Allowed 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.347 -0.842 . . . . 72.409999999999997 109.161 178.703 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 35.0 m80 -146.08 33.33 1.0 Allowed 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 124.092 0.957 . . . . 52.229999999999997 109.627 173.19 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 61.2 t60 . . . . . 0 C--O 1.254 1.307 0 N-CA-C 108.85 -0.796 . . . . 74.310000000000002 108.85 176.2 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.0 mtt . . . . . 0 N--CA 1.484 1.27 0 CA-C-O 120.402 0.144 . . . . 72.230000000000004 110.9 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.5 m -82.21 113.07 19.79 Favored 'General case' 0 C--N 1.355 0.811 0 C-N-CA 123.347 0.659 . . . . 75.140000000000001 109.962 176.762 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 172.44 112.31 0.28 Allowed Glycine 0 C--N 1.343 0.917 0 N-CA-C 111.57 -0.612 . . . . 74.230000000000004 111.57 -179.582 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -108.54 128.59 54.94 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.738 0.815 . . . . 62.310000000000002 110.741 178.688 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.404 ' HA ' ' HA ' ' A' ' 26' ' ' TYR . 0.9 OUTLIER -90.42 103.32 16.02 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 107.598 -1.26 . . . . 71.439999999999998 107.598 167.06 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.5 p -99.68 142.09 15.81 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 123.987 0.915 . . . . 72.140000000000001 109.238 177.762 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.561 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 34.1 mt-10 -109.67 113.85 26.96 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 108.034 -1.099 . . . . 74.329999999999998 108.034 176.043 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 90.1 t -99.25 110.6 26.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 C-N-CA 124.516 1.126 . . . . 52.109999999999999 109.998 -171.631 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.531 ' O ' ' HA ' ' A' ' 60' ' ' ILE . 77.8 mt-30 -82.43 99.74 9.61 Favored 'General case' 0 C--N 1.347 0.474 0 N-CA-C 107.67 -1.233 . . . . 72.040000000000006 107.67 178.952 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 64.0 t -93.38 114.48 30.18 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 N-CA-C 107.237 -1.394 . . . . 52.200000000000003 107.237 173.787 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.7 ttpm? -122.35 103.89 9.04 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 107.818 -1.178 . . . . 74.420000000000002 107.818 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 14.1 tt -122.33 125.69 73.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 122.759 0.424 . . . . 73.310000000000002 110.542 -174.333 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 51.4 m -102.2 116.54 32.87 Favored 'General case' 0 C--O 1.241 0.657 0 C-N-CA 123.83 0.852 . . . . 75.150000000000006 109.569 176.537 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 54.1 t -138.89 135.15 34.17 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 124.16 0.984 . . . . 74.430000000000007 109.5 175.654 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.488 ' HB2' ' HB3' ' A' ' 51' ' ' LEU . 67.0 t30 70.22 30.29 3.46 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 124.836 1.254 . . . . 72.230000000000004 110.959 175.079 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 83.65 -7.27 69.98 Favored Glycine 0 C--N 1.353 1.487 0 CA-C-N 115.588 -0.733 . . . . 71.019999999999996 113.231 -178.053 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 44.9 mtpt -105.4 131.08 53.28 Favored 'General case' 0 C--N 1.348 0.516 0 C-N-CA 123.954 0.902 . . . . 72.519999999999996 110.252 -173.085 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 85.8 m -95.34 131.45 41.42 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 108.696 -0.853 . . . . 71.230000000000004 108.696 174.729 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -115.93 144.58 43.86 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 107.046 -1.465 . . . . 75.310000000000002 107.046 171.739 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -148.81 130.89 15.36 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 123.105 0.562 . . . . 75.510000000000005 109.798 175.358 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 69.9 ttt180 -154.33 134.85 13.46 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 108.471 -0.936 . . . . 72.409999999999997 108.471 178.8 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.411 HG22 ' HB3' ' A' ' 7' ' ' GLU . 16.6 m -101.47 116.82 33.64 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 123.66 0.784 . . . . 74.120000000000005 109.808 179.109 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 -97.65 128.71 44.55 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.22 1.008 . . . . 72.409999999999997 110.477 -173.362 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.498 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 25.2 mp0 -90.12 108.35 19.68 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 108.029 -1.1 . . . . 73.420000000000002 108.029 -178.136 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.471 HD11 HG21 ' A' ' 40' ' ' VAL . 89.8 mt -121.92 110.11 15.45 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.623 1.169 . . . . 74.430000000000007 108.921 -174.104 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.433 ' O ' ' HE3' ' A' ' 36' ' ' LYS . 82.3 t80 -92.53 134.58 34.84 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 122.732 0.413 . . . . 72.319999999999993 109.977 173.896 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.554 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -146.65 148.66 32.29 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.415 0.686 . . . . 75.109999999999999 110.65 177.686 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 88.5 t -76.38 -56.83 7.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 123.884 0.873 . . . . 75.299999999999997 109.56 175.346 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.554 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 94.5 mtt180 -102.32 164.97 11.38 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 115.534 -0.757 . . . . 72.409999999999997 110.012 175.618 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -69.72 -27.07 64.67 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 123.147 0.579 . . . . 53.009999999999998 110.636 170.605 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -62.34 -35.2 78.37 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.242 1.017 . . . . 53.219999999999999 111.147 176.504 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.554 ' HB2' ' HB1' ' A' ' 27' ' ' ALA . 13.5 mm-40 -70.51 -29.92 66.56 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.358 -0.837 . . . . 71.129999999999995 110.135 -178.924 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.75 HD22 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -75.69 -22.01 57.05 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.107 0.563 . . . . 72.450000000000003 110.741 -178.032 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.513 ' HG2' HG23 ' A' ' 80' ' ' ILE . 53.8 mtpt -57.19 -55.83 29.64 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 122.979 0.512 . . . . 64.129999999999995 111.13 179.807 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.503 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 2.4 pp20? -61.96 -30.11 70.7 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 115.648 -0.705 . . . . 74.120000000000005 112.14 179.7 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.75 ' HD2' HD22 ' A' ' 33' ' ' LEU . 64.3 mttm -70.39 -40.35 74.0 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.197 0.599 . . . . 75.329999999999998 110.857 179.454 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.564 HD13 HD23 ' A' ' 81' ' ' LEU . 95.7 mt -62.11 -39.69 93.37 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 123.73 0.643 . . . . 53.329999999999998 110.803 174.157 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -64.26 -37.68 88.36 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 122.997 0.519 . . . . 62.240000000000002 111.479 175.238 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.503 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 45.0 mmtm -62.88 -55.66 24.18 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 110.054 -0.35 . . . . 73.049999999999997 110.054 174.69 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.471 HG21 HD11 ' A' ' 25' ' ' LEU . 55.2 t -54.66 -49.22 69.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 124.808 1.243 . . . . 75.030000000000001 111.711 -178.542 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 40.5 mt -66.32 -45.59 79.78 Favored 'General case' 0 C--O 1.215 -0.712 0 C-N-CA 123.293 0.637 . . . . 73.109999999999999 111.601 -176.551 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -65.91 -42.16 90.54 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 112.247 0.462 . . . . 72.430000000000007 112.247 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.7 mm-40 -63.13 -50.82 68.94 Favored 'General case' 0 N--CA 1.486 1.344 0 CA-C-O 121.28 0.562 . . . . 52.439999999999998 110.634 177.176 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 15.4 tpt180 -63.7 -41.84 98.06 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.512 1.125 . . . . 73.299999999999997 111.37 -177.796 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.501 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 58.0 mtp -92.23 8.21 39.18 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.682 0.623 . . . . 74.409999999999997 112.682 -174.733 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -73.42 -51.2 5.76 Favored Pre-proline 0 CA--C 1.559 1.295 0 CA-C-O 118.447 -0.787 . . . . 75.439999999999998 111.565 174.262 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -69.4 -16.6 39.19 Favored 'Trans proline' 0 C--N 1.389 2.674 0 C-N-CA 121.452 1.435 . . . . 75.109999999999999 111.894 174.696 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.536 HG22 HD11 ' A' ' 108' ' ' LEU . 48.7 mm -72.58 -32.69 42.35 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.132 0 C-N-CA 124.42 1.088 . . . . 73.109999999999999 110.309 176.087 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.501 ' HG3' ' O ' ' A' ' 45' ' ' MET . 55.1 mttp -62.3 -41.33 98.41 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 109.387 -0.597 . . . . 73.140000000000001 109.387 171.304 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.7 tmmm? -65.58 -32.55 74.2 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.175 0.99 . . . . 43.509999999999998 110.993 178.254 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.488 ' HB3' ' HB2' ' A' ' 15' ' ' ASN . 83.6 mt -70.47 -30.73 67.61 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 110.106 -0.331 . . . . 74.120000000000005 110.106 175.352 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 71.81 56.75 6.31 Favored Glycine 0 C--N 1.348 1.24 0 O-C-N 124.014 0.821 . . . . 52.100000000000001 113.448 170.055 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.435 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 89.4 m -88.72 125.54 34.91 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 122.674 0.39 . . . . 62.020000000000003 111.303 177.637 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 53.5 tptt -59.91 -39.38 85.23 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.475 1.11 . . . . 72.200000000000003 110.256 170.53 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 25.3 ttm180 -139.85 136.44 33.98 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 109.303 -0.629 . . . . 75.0 109.303 174.306 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 15.5 m -114.3 144.2 22.39 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 C-N-CA 124.087 0.955 . . . . 63.200000000000003 109.241 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.533 ' NH1' ' HG2' ' A' ' 105' ' ' GLU . 23.3 tpp180 -100.25 103.64 15.09 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 107.52 -1.289 . . . . 74.230000000000004 107.52 175.04 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 59.6 mt -100.06 133.26 43.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 N-CA-C 107.718 -1.215 . . . . 74.230000000000004 107.718 177.509 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 36.5 t -137.5 102.72 4.85 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 107.529 -1.285 . . . . 72.129999999999995 107.529 -176.626 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.531 ' HA ' ' O ' ' A' ' 9' ' ' GLN . 45.0 mt -115.86 114.28 45.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 C-N-CA 123.214 0.606 . . . . 72.319999999999993 111.061 -172.299 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 80.0 ttt180 -105.74 140.44 38.79 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 109.079 -0.712 . . . . 65.120000000000005 109.079 176.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.1 p -94.86 141.41 15.07 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 N-CA-C 109.227 -0.657 . . . . 60.25 109.227 178.275 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.561 ' HB3' ' H ' ' A' ' 7' ' ' GLU . 5.3 tppp? -90.09 123.57 34.07 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 107.045 -1.465 . . . . 74.549999999999997 107.045 165.781 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 16.4 p80 -92.02 146.01 24.08 Favored 'General case' 0 C--O 1.238 0.498 0 O-C-N 123.722 0.639 . . . . 64.109999999999999 110.963 -179.671 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 27.7 m -84.49 -50.03 8.11 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 115.346 -0.843 . . . . 74.239999999999995 110.955 -176.348 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -93.06 -175.75 3.96 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.308 0.643 . . . . 73.510000000000005 111.266 179.28 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -114.56 -35.19 4.97 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.07 0.948 . . . . 54.020000000000003 111.086 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -89.0 -55.53 3.65 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.134 0.573 . . . . 72.319999999999993 111.146 174.15 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.0 mp0 -64.49 -17.88 64.27 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 125.072 1.349 . . . . 72.430000000000007 112.436 -171.726 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.569 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 0.6 OUTLIER -69.41 -22.34 63.69 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.272 1.029 . . . . 75.120000000000005 113.744 -174.701 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -69.01 -30.84 69.31 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.582 0.753 . . . . 72.140000000000001 109.513 177.432 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -83.14 -40.32 19.9 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.27 1.028 . . . . 62.140000000000001 110.102 172.474 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.569 ' HB3' ' HA ' ' A' ' 70' ' ' GLU . 44.2 tt0 -65.77 -30.26 70.88 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.955 0.902 . . . . 74.129999999999995 111.853 -176.164 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.56 -45.3 75.99 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.041 0.536 . . . . 75.340000000000003 110.314 176.64 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.91 -30.27 67.64 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 123.907 0.754 . . . . 72.099999999999994 111.958 176.386 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.419 ' O ' HG12 ' A' ' 80' ' ' ILE . 34.9 ttmt -65.88 -47.14 75.88 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.693 0.797 . . . . 72.120000000000005 109.383 174.624 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -73.66 -21.91 60.13 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 114.633 -1.167 . . . . 73.439999999999998 109.914 -179.132 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -66.55 -42.93 86.39 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 123.928 0.891 . . . . 72.310000000000002 110.639 173.834 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.18 -38.43 91.02 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 123.798 0.686 . . . . 72.400000000000006 110.382 175.454 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.513 HG23 ' HG2' ' A' ' 34' ' ' LYS . 36.7 mm -65.5 -44.14 94.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 124.272 1.029 . . . . 71.400000000000006 111.055 177.923 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.564 HD23 HD13 ' A' ' 37' ' ' LEU . 35.9 mt -64.54 -45.0 89.04 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.181 0.592 . . . . 74.400000000000006 110.088 177.399 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -59.88 -42.29 93.42 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.681 0.792 . . . . 74.230000000000004 110.694 -176.797 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -61.02 -49.57 76.88 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 124.081 0.863 . . . . 71.040000000000006 111.073 176.419 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 55.9 t -61.69 -51.01 77.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 123.539 0.736 . . . . 75.409999999999997 110.916 -175.395 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.458 ' HZ ' HD12 ' A' ' 60' ' ' ILE . 35.4 m-85 -59.04 -44.04 91.73 Favored 'General case' 0 N--CA 1.477 0.882 0 O-C-N 124.021 0.825 . . . . 73.5 111.217 179.171 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.53 -32.56 74.26 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.049 0.54 . . . . 75.340000000000003 111.681 179.162 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -85.04 -6.46 59.32 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.748 0.819 . . . . 73.519999999999996 111.755 -179.313 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 86.1 mt -104.03 -15.54 15.56 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.388 0.675 . . . . 72.450000000000003 110.517 176.504 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 106.98 20.9 8.44 Favored Glycine 0 C--N 1.345 1.052 0 CA-C-N 116.111 -0.495 . . . . 30.43 113.676 175.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.452 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 95.8 m-85 -88.37 129.05 35.5 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 109.277 -0.638 . . . . 62.149999999999999 109.277 169.688 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -77.23 161.29 28.26 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.435 1.094 . . . . 74.140000000000001 109.653 -178.048 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -59.06 -38.95 80.62 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 124.18 0.992 . . . . 72.030000000000001 111.458 175.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 8.1 t -77.87 9.36 3.62 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 124.089 0.956 . . . . 72.140000000000001 112.503 176.531 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -101.94 -23.33 14.15 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.275 0.63 . . . . 64.209999999999994 110.701 168.659 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 59.6 t -108.78 121.37 61.74 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 C-N-CA 124.038 0.935 . . . . 70.209999999999994 110.433 -172.489 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.9 m -146.06 128.85 16.29 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.996 0.918 . . . . 74.25 109.552 171.446 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.418 ' HA ' ' HA ' ' A' ' 102' ' ' VAL . 33.7 m95 -73.09 152.73 41.1 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-O 121.468 0.651 . . . . 73.430000000000007 111.804 177.214 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -139.45 78.31 1.66 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.953 1.301 . . . . 71.450000000000003 107.555 176.241 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 63.92 -98.98 0.27 Allowed Glycine 0 C--N 1.345 1.074 0 CA-C-N 114.974 -1.012 . . . . 32.439999999999998 113.602 179.567 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -84.24 -25.72 29.22 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.648 0.779 . . . . 72.329999999999998 112.006 -177.127 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 28.7 m -125.33 138.04 54.06 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.504 0.722 . . . . 73.019999999999996 110.282 -168.035 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.418 ' HA ' ' HA ' ' A' ' 97' ' ' TRP . 12.2 p -91.59 137.04 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.009 0 N-CA-C 109.489 -0.56 . . . . 52.350000000000001 109.489 176.676 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 27.1 m -102.18 106.45 17.29 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.616 1.166 . . . . 74.310000000000002 108.266 177.227 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 70.2 t -118.08 112.23 37.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 N-CA-C 108.323 -0.992 . . . . 62.039999999999999 108.323 -179.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.533 ' HG2' ' NH1' ' A' ' 57' ' ' ARG . 0.1 OUTLIER -140.92 140.11 34.43 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 122.695 0.398 . . . . 75.239999999999995 110.087 178.82 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 160.88 -150.07 19.66 Favored Glycine 0 C--O 1.241 0.59 0 N-CA-C 111.098 -0.801 . . . . 71.140000000000001 111.098 -172.845 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -64.98 143.2 58.11 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 123.587 0.755 . . . . 63.130000000000003 112.262 -175.659 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.536 HD11 HG22 ' A' ' 48' ' ' ILE . 2.0 tt -92.17 128.15 37.91 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 107.427 -1.323 . . . . 74.230000000000004 107.427 174.969 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.466 ' O ' ' HE3' ' A' ' 49' ' ' LYS . 10.5 tp10 -73.58 92.1 1.9 Allowed 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 107.922 -1.14 . . . . 61.399999999999999 107.922 167.608 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' GLY . . . . . 0.468 ' HA2' HD12 ' A' ' 113' ' ' LEU . . . 145.23 34.25 0.07 OUTLIER Glycine 0 C--N 1.339 0.735 0 CA-C-N 115.404 -0.816 . . . . 54.229999999999997 112.216 -176.739 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 44.7 t -73.34 99.56 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 N-CA-C 109.253 -0.647 . . . . 73.439999999999998 109.253 178.798 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 34.2 t70 62.7 17.3 9.66 Favored 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 124.769 1.228 . . . . 63.329999999999998 112.065 172.362 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.468 HD12 ' HA2' ' A' ' 110' ' ' GLY . 87.3 mt -73.82 130.7 40.46 Favored 'General case' 0 C--N 1.353 0.749 0 C-N-CA 122.984 0.513 . . . . 73.530000000000001 110.081 -179.472 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.16 167.74 13.58 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 123.476 0.711 . . . . 71.120000000000005 110.863 172.931 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 31.4 m170 73.55 0.03 3.52 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 125.483 1.513 . . . . 70.200000000000003 113.824 176.03 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 6.5 p-80 -67.91 -32.08 72.31 Favored 'General case' 0 N--CA 1.493 1.713 0 N-CA-C 108.944 -0.762 . . . . 72.019999999999996 108.944 170.058 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 31.0 t60 -73.45 82.43 1.45 Allowed 'General case' 0 C--N 1.357 0.903 0 N-CA-C 106.602 -1.629 . . . . 72.329999999999998 106.602 168.039 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 14.7 p-80 -83.15 144.53 29.77 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 114.435 -1.257 . . . . 63.119999999999997 111.46 -171.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 15.6 p80 -98.23 9.47 42.91 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.697 0.799 . . . . 74.430000000000007 110.105 172.218 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 46.8 t-80 . . . . . 0 CA--C 1.556 1.185 0 C-N-CA 124.372 1.069 . . . . 73.040000000000006 109.789 171.596 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.8 mmm . . . . . 0 N--CA 1.478 0.944 0 N-CA-C 109.477 -0.564 . . . . 72.230000000000004 109.477 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.1 t -153.8 74.83 1.01 Allowed 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 107.31 -1.367 . . . . 73.439999999999998 107.31 178.444 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -166.46 64.07 0.21 Allowed Glycine 0 C--N 1.334 0.455 0 N-CA-C 109.077 -1.609 . . . . 73.099999999999994 109.077 178.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 33.6 tptt -90.54 148.24 22.84 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.499 0.72 . . . . 64.319999999999993 111.378 -166.04 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.439 ' HB2' ' HD1' ' A' ' 26' ' ' TYR . 34.8 ttpt -127.27 107.32 9.89 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 109.072 -0.714 . . . . 51.420000000000002 109.072 174.795 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.1 p -100.69 143.97 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 N-CA-C 108.993 -0.743 . . . . 53.119999999999997 108.993 173.363 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.409 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 42.3 mt-10 -113.63 115.09 27.35 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 109.332 -0.618 . . . . 71.420000000000002 109.332 177.738 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 73.1 t -105.59 115.71 47.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 124.944 1.298 . . . . 73.319999999999993 110.062 -168.733 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.412 ' O ' ' HA ' ' A' ' 60' ' ' ILE . 38.7 mt-30 -97.08 99.59 11.09 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 108.576 -0.898 . . . . 62.329999999999998 108.576 -177.043 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.424 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 67.1 t -95.48 109.08 21.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 N-CA-C 109.092 -0.707 . . . . 61.409999999999997 109.092 -177.594 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.518 ' HE2' ' HB2' ' A' ' 59' ' ' SER . 35.6 ttpt -110.15 105.28 14.3 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 108.436 -0.95 . . . . 74.140000000000001 108.436 177.732 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.412 HD11 HG21 ' A' ' 48' ' ' ILE . 10.9 tt -118.15 123.71 72.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 122.983 0.513 . . . . 70.140000000000001 111.015 -174.61 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 41.8 m -95.99 110.82 22.98 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 123.259 0.624 . . . . 63.450000000000003 109.425 176.216 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.644 ' SG ' HG23 ' A' ' 48' ' ' ILE . 8.9 t -145.78 132.63 20.1 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.504 1.122 . . . . 75.409999999999997 110.185 179.655 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 62.78 35.22 13.96 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 124.479 1.111 . . . . 73.540000000000006 110.499 174.024 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.88 12.12 78.6 Favored Glycine 0 C--N 1.351 1.37 0 CA-C-N 115.255 -0.884 . . . . 60.140000000000001 114.234 177.089 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.51 ' HE2' ' HA ' ' A' ' 17' ' ' LYS . 8.0 mmpt? -125.23 142.23 51.62 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.567 0.747 . . . . 64.109999999999999 109.847 175.096 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 88.3 m -110.89 118.53 36.37 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 109.007 -0.738 . . . . 61.439999999999998 109.007 178.906 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.415 ' HB3' ' NH1' ' A' ' 44' ' ' ARG . 13.5 m-85 -108.06 109.76 21.28 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.525 1.13 . . . . 73.420000000000002 108.026 -172.681 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.478 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 1.7 pp20? -127.52 142.02 51.5 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 122.455 0.302 . . . . 64.150000000000006 111.46 -178.8 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 58.2 ttt180 -168.32 143.17 3.48 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.868 0.867 . . . . 70.239999999999995 109.553 178.849 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 23.9 m -89.79 118.16 29.18 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.347 1.059 . . . . 63.030000000000001 109.391 173.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -101.87 135.49 43.33 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.813 0.845 . . . . 65.209999999999994 109.729 -179.043 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -91.68 107.63 19.35 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 107.514 -1.291 . . . . 74.329999999999998 107.514 179.233 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.508 HD21 HG21 ' A' ' 40' ' ' VAL . 70.6 mt -111.14 99.4 8.25 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 109.076 -0.713 . . . . 73.340000000000003 109.076 -178.789 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.439 ' HD1' ' HB2' ' A' ' 5' ' ' LYS . 52.7 t80 -93.28 144.3 25.44 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.652 0.781 . . . . 54.219999999999999 109.571 177.343 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.571 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -158.26 160.62 37.28 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.186 0.995 . . . . 70.310000000000002 109.316 -179.012 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 56.4 t -75.85 -65.78 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 N-CA-C 108.308 -0.997 . . . . 72.140000000000001 108.308 170.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.527 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 97.8 mtt180 -96.03 162.18 13.66 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-O 121.064 0.459 . . . . 74.129999999999995 110.556 175.258 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 18.6 p-10 -69.96 -26.74 64.25 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.114 0.966 . . . . 60.039999999999999 111.222 174.229 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -69.1 -25.22 64.3 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 122.915 0.486 . . . . 71.409999999999997 111.438 175.858 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.571 ' HB2' ' HB1' ' A' ' 27' ' ' ALA . 11.5 mm-40 -70.77 -30.84 67.43 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.226 0.611 . . . . 75.540000000000006 109.997 177.319 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.465 HD22 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -66.19 -23.84 66.52 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 124.388 1.075 . . . . 75.040000000000006 110.97 -178.887 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -54.95 -58.66 6.7 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.661 0.784 . . . . 65.310000000000002 111.906 -178.796 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.8 pp20? -65.69 -25.94 67.55 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 122.52 0.328 . . . . 71.530000000000001 111.783 -178.122 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.465 ' HD2' HD22 ' A' ' 33' ' ' LEU . 59.5 mttm -69.42 -41.91 75.73 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.331 0.652 . . . . 71.430000000000007 110.637 177.175 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.521 HD13 HD23 ' A' ' 81' ' ' LEU . 84.8 mt -61.79 -44.07 97.6 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 123.909 0.755 . . . . 74.120000000000005 110.578 173.443 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -56.79 -42.14 78.95 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 122.931 0.493 . . . . 72.430000000000007 110.822 176.783 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -62.78 -61.78 2.17 Favored 'General case' 0 C--O 1.218 -0.593 0 O-C-N 123.98 0.8 . . . . 74.219999999999999 110.743 177.785 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.508 HG21 HD21 ' A' ' 25' ' ' LEU . 99.1 t -60.04 -37.84 74.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 123.363 0.665 . . . . 64.439999999999998 111.763 -173.416 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.457 HD21 HD11 ' A' ' 60' ' ' ILE . 48.9 mt -71.63 -47.71 52.7 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.326 0.65 . . . . 73.549999999999997 111.362 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -70.01 -32.24 70.31 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 122.906 0.482 . . . . 74.340000000000003 110.923 -177.18 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -82.38 -34.58 28.32 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.112 0.965 . . . . 74.319999999999993 110.686 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.415 ' NH1' ' HB3' ' A' ' 19' ' ' TYR . 5.4 tpm_? -60.09 -44.52 94.75 Favored 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 108.956 -0.757 . . . . 71.150000000000006 108.956 169.276 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.494 ' HA ' ' HB ' ' A' ' 48' ' ' ILE . 68.7 mtp -88.67 1.04 55.8 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-N 114.465 -1.243 . . . . 75.340000000000003 112.531 -178.469 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -65.54 -50.5 56.51 Favored Pre-proline 0 N--CA 1.483 1.199 0 CA-C-N 119.191 0.905 . . . . 71.209999999999994 111.15 178.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.53 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 57.5 Cg_endo -68.28 -23.15 39.02 Favored 'Trans proline' 0 C--N 1.388 2.613 0 C-N-CA 121.634 1.556 . . . . 54.520000000000003 111.707 172.198 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.644 HG23 ' SG ' ' A' ' 14' ' ' CYS . 47.5 mm -75.5 -34.92 30.87 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.034 0 C-N-CA 124.379 1.072 . . . . 70.129999999999995 110.509 -177.03 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' A' ' 45' ' ' MET . 35.7 mtmm -82.8 -12.17 57.69 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.494 0.717 . . . . 71.439999999999998 109.951 177.59 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -80.57 -33.06 36.41 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.24 1.016 . . . . 73.349999999999994 109.586 164.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 95.7 mt -73.26 -28.45 62.14 Favored 'General case' 0 N--CA 1.484 1.245 0 N-CA-C 109.759 -0.46 . . . . 52.43 109.759 178.566 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 67.65 32.58 78.67 Favored Glycine 0 C--N 1.354 1.529 0 CA-C-N 115.645 -0.707 . . . . 71.340000000000003 113.514 173.904 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.421 ' SG ' HG23 ' A' ' 48' ' ' ILE . 1.6 p -67.8 110.32 3.75 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 109.471 -0.566 . . . . 74.310000000000002 109.471 176.137 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.692 ' HE2' ' HG3' ' A' ' 109' ' ' GLU . 6.9 mtpm? -62.38 -20.42 64.4 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.527 1.131 . . . . 72.209999999999994 112.788 -171.758 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 43.4 ttp180 -136.4 131.08 33.7 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 108.585 -0.894 . . . . 74.219999999999999 108.585 173.033 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 35.6 m -124.49 136.88 59.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 109.11 -0.7 . . . . 71.409999999999997 109.11 173.222 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 54.9 ttt180 -106.69 105.38 15.38 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 108.184 -1.043 . . . . 73.310000000000002 108.184 177.057 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.41 HG22 HG13 ' A' ' 60' ' ' ILE . 32.8 mt -107.43 104.15 16.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 123.259 0.623 . . . . 40.109999999999999 109.435 -175.791 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.518 ' HB2' ' HE2' ' A' ' 11' ' ' LYS . 20.3 m -97.78 104.6 16.64 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 108.347 -0.983 . . . . 64.219999999999999 108.347 175.545 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.493 ' HB ' HG13 ' A' ' 102' ' ' VAL . 85.8 mt -97.71 110.24 25.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 123.831 0.852 . . . . 52.329999999999998 109.719 -179.782 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 27.7 mtm105 -98.38 107.72 20.25 Favored 'General case' 0 C--O 1.237 0.442 0 N-CA-C 107.05 -1.463 . . . . 74.129999999999995 107.05 175.639 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.1 p -94.61 137.18 23.76 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 N-CA-C 109.125 -0.695 . . . . 72.129999999999995 109.125 -171.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.409 ' HB3' ' H ' ' A' ' 7' ' ' GLU . 34.5 ttmt -82.37 118.74 23.4 Favored 'General case' 0 C--N 1.35 0.624 0 N-CA-C 109.527 -0.546 . . . . 71.219999999999999 109.527 -176.216 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 50.9 m80 -83.74 150.49 25.78 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 124.634 1.174 . . . . 73.450000000000003 108.922 177.497 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 29.7 t -65.68 -52.66 49.79 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 123.525 0.516 . . . . 74.319999999999993 112.05 -172.635 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.608 ' H ' ' HB2' ' A' ' 69' ' ' GLU . 15.2 m-20 -140.84 -175.9 4.47 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 124.242 1.017 . . . . 71.329999999999998 108.949 -174.11 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.8 -54.13 15.03 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.646 0.778 . . . . 73.319999999999993 111.687 -178.044 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.21 -23.36 62.0 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 122.926 0.49 . . . . 51.109999999999999 110.406 175.086 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.608 ' HB2' ' H ' ' A' ' 66' ' ' ASP . 24.9 mm-40 -76.56 -11.02 59.8 Favored 'General case' 0 C--O 1.211 -0.922 0 CA-C-O 118.755 -0.641 . . . . 71.5 112.51 174.49 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -57.17 -51.63 68.54 Favored 'General case' 0 N--CA 1.488 1.46 0 CA-C-N 119.241 0.928 . . . . 74.140000000000001 110.971 173.523 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -71.89 -30.74 65.71 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.087 0.555 . . . . 73.439999999999998 111.244 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 4.5 tppp? -67.32 -60.61 2.45 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.324 0.65 . . . . 64.230000000000004 109.581 178.682 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -67.0 -15.2 63.58 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.573 1.149 . . . . 73.310000000000002 112.164 178.557 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.36 -62.45 1.67 Allowed 'General case' 0 C--N 1.351 0.671 0 CA-C-N 118.882 0.764 . . . . 74.019999999999996 109.856 172.825 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -69.04 -40.11 78.78 Favored 'General case' 0 CA--C 1.55 0.963 0 O-C-N 124.171 0.919 . . . . 63.43 111.68 -179.318 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 48.3 tttm -67.29 -50.8 58.88 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.907 0.883 . . . . 73.129999999999995 111.95 -176.792 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -75.45 -20.27 58.94 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 110.127 -0.323 . . . . 74.349999999999994 110.127 177.649 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.92 -37.93 74.98 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 122.588 0.355 . . . . 62.340000000000003 111.168 171.44 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.489 ' O ' ' HG2' ' A' ' 83' ' ' LYS . . . -63.77 -45.87 87.84 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.227 0.611 . . . . 53.009999999999998 110.665 175.762 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.468 ' O ' HG23 ' A' ' 84' ' ' VAL . 49.4 mm -61.35 -45.61 98.26 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 C-N-CA 123.914 0.885 . . . . 61.109999999999999 110.325 -178.748 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.547 HD13 HG11 ' A' ' 102' ' ' VAL . 35.8 mt -69.58 -41.82 75.32 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.66 0.784 . . . . 75.25 111.39 178.881 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -56.31 -43.22 78.74 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 124.331 1.052 . . . . 61.409999999999997 110.624 -176.642 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.489 ' HG2' ' O ' ' A' ' 79' ' ' ALA . 33.6 mmtp -68.14 -42.23 80.47 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 114.67 -1.15 . . . . 73.310000000000002 110.758 179.734 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 80' ' ' ILE . 51.1 t -64.34 -47.95 87.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 C-N-CA 123.544 0.738 . . . . 73.120000000000005 110.468 -176.097 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.55 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 25.6 m-85 -61.13 -41.36 96.58 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.28 -0.873 . . . . 74.040000000000006 110.437 177.224 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.66 -25.39 66.54 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.494 0.718 . . . . 70.430000000000007 111.825 176.397 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -86.11 -9.69 56.22 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 124.018 0.927 . . . . 75.349999999999994 111.2 176.681 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 94.5 mt -106.1 -25.17 12.15 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.221 0.608 . . . . 63.43 111.023 -178.679 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 116.34 17.09 6.29 Favored Glycine 0 N--CA 1.475 1.29 0 C-N-CA 122.945 0.307 . . . . 53.130000000000003 113.696 177.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.55 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 10.3 m-85 -104.14 125.72 50.68 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 107.986 -1.116 . . . . 74.209999999999994 107.986 173.159 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -123.71 97.89 5.58 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 122.929 0.491 . . . . 62.210000000000001 110.833 -170.308 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 64.19 -72.09 0.06 Allowed 'General case' 0 N--CA 1.494 1.765 0 C-N-CA 125.254 1.422 . . . . 55.329999999999998 114.176 164.51 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 14.6 m -57.08 -30.45 64.32 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 125.068 1.347 . . . . 64.319999999999993 112.502 -178.051 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ASN . . . . . 0.412 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 10.7 m120 -66.1 -39.73 90.2 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.483 0.713 . . . . 75.219999999999999 111.008 176.476 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.416 ' HA ' HG22 ' A' ' 104' ' ' VAL . 47.6 t -93.02 106.99 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 124.999 1.32 . . . . 75.030000000000001 110.276 -167.619 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 44.5 m -123.93 126.66 46.73 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 122.996 0.518 . . . . 65.540000000000006 110.22 178.617 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 55.1 m95 -89.84 147.16 23.94 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 122.968 0.507 . . . . 74.150000000000006 110.491 174.663 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -156.86 98.15 1.75 Allowed 'General case' 0 CA--C 1.554 1.109 0 C-N-CA 124.658 1.183 . . . . 65.030000000000001 109.166 -177.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 77.54 -99.78 1.5 Allowed Glycine 0 C--N 1.35 1.324 0 CA-C-N 115.36 -0.836 . . . . 64.150000000000006 112.979 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -110.86 -7.3 14.6 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 124.409 1.084 . . . . 71.310000000000002 110.153 177.052 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 22.0 m -103.45 153.68 20.25 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.188 1.395 . . . . 74.420000000000002 110.659 -168.417 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.547 HG11 HD13 ' A' ' 81' ' ' LEU . 2.7 p -128.9 104.62 11.63 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.877 0 C-N-CA 124.323 1.049 . . . . 75.519999999999996 108.627 167.238 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 24.3 m -91.97 104.92 17.28 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.646 0.778 . . . . 73.340000000000003 108.937 -178.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.416 HG22 ' HA ' ' A' ' 95' ' ' VAL . 53.1 t -102.01 121.99 53.68 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 C-N-CA 124.825 1.25 . . . . 74.150000000000006 109.485 179.573 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -89.03 126.27 35.36 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 108.77 -0.826 . . . . 63.520000000000003 108.77 172.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -106.27 154.83 16.81 Favored Glycine 0 N--CA 1.468 0.789 0 N-CA-C 111.131 -0.788 . . . . 65.450000000000003 111.131 173.612 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -136.28 120.38 17.71 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.431 0.692 . . . . 75.420000000000002 109.584 178.262 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.464 ' O ' ' HA ' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -157.19 132.87 9.31 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.459 0.704 . . . . 50.439999999999998 109.647 172.404 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.692 ' HG3' ' HE2' ' A' ' 54' ' ' LYS . 2.3 mp0 -74.95 -47.48 29.34 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.777 0.831 . . . . 73.019999999999996 108.907 176.878 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 172.73 90.52 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.55 0 CA-C-N 114.316 -1.311 . . . . 62.229999999999997 110.07 178.787 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 30.8 m -66.31 156.76 6.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 122.977 0.511 . . . . 74.310000000000002 110.789 -178.805 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -75.51 91.45 2.8 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 115.935 -0.575 . . . . 75.209999999999994 109.978 -178.555 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 67.5 mt -71.2 92.99 1.04 Allowed 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 107.932 -1.136 . . . . 75.340000000000003 107.932 171.68 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.09 -60.59 3.51 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.772 1.229 . . . . 62.450000000000003 112.119 -173.425 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 66.7 m80 -161.39 143.2 11.75 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.032 1.333 . . . . 73.420000000000002 107.978 -174.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 42.5 m80 -95.39 143.35 26.82 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 108.561 -0.903 . . . . 75.519999999999996 108.561 172.855 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 62.9 t60 -127.42 153.72 45.92 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.201 0.601 . . . . 73.230000000000004 109.891 -175.067 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 45.8 m170 -56.45 107.39 0.37 Allowed 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.947 0.899 . . . . 73.010000000000005 110.155 175.48 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 28.4 p-80 -65.57 141.25 58.5 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 123.828 0.705 . . . . 61.119999999999997 110.136 -179.421 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 21.9 m80 . . . . . 0 CA--C 1.549 0.937 0 N-CA-C 108.668 -0.864 . . . . 73.230000000000004 108.668 178.338 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.877 0 N-CA-C 107.842 -1.17 . . . . 72.329999999999998 107.842 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.2 t -85.96 -9.11 57.43 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.934 0.894 . . . . 54.219999999999999 112.089 -174.758 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -76.83 74.91 1.75 Allowed Glycine 0 C--N 1.348 1.218 0 O-C-N 123.288 0.368 . . . . 72.540000000000006 113.435 -177.259 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.06 173.73 6.2 Favored 'General case' 0 C--O 1.243 0.737 0 C-N-CA 123.925 0.89 . . . . 71.150000000000006 108.698 171.428 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.41 ' HD2' ' HB3' ' A' ' 24' ' ' GLN . 38.4 ttpt -89.78 111.88 23.02 Favored 'General case' 0 C--O 1.241 0.655 0 N-CA-C 109.406 -0.59 . . . . 75.140000000000001 109.406 179.321 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.68 HG21 HG13 ' A' ' 62' ' ' VAL . 3.9 p -98.34 142.87 13.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 N-CA-C 107.927 -1.138 . . . . 74.209999999999994 107.927 174.149 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.42 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 44.6 mt-10 -105.52 109.95 22.1 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 107.427 -1.323 . . . . 73.140000000000001 107.427 176.265 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 73.2 t -99.16 113.26 33.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 114.355 -1.293 . . . . 70.430000000000007 108.705 -173.708 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.454 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 46.8 mt-30 -104.35 99.92 9.63 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 108.57 -0.9 . . . . 52.100000000000001 108.57 -176.159 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.441 HG22 HG12 ' A' ' 60' ' ' ILE . 74.9 t -95.18 108.48 20.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 N-CA-C 108.591 -0.892 . . . . 63.25 108.591 -178.227 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.44 ' HE2' ' HB2' ' A' ' 59' ' ' SER . 36.2 ttpt -109.9 107.27 17.15 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.278 -0.874 . . . . 74.400000000000006 108.984 -174.17 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.445 HD13 HG13 ' A' ' 48' ' ' ILE . 14.8 tt -123.55 116.52 48.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 123.086 0.554 . . . . 75.010000000000005 110.126 -177.136 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 93.1 m -94.15 124.28 38.07 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 109.568 -0.53 . . . . 72.0 109.568 178.865 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.436 ' SG ' HG23 ' A' ' 48' ' ' ILE . 47.6 t -150.6 151.56 32.75 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.626 1.17 . . . . 52.119999999999997 109.138 -178.171 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 36.1 t30 69.97 -78.23 0.05 OUTLIER 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 124.89 1.276 . . . . 74.549999999999997 109.798 -176.674 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -165.19 11.69 0.08 OUTLIER Glycine 0 N--CA 1.462 0.431 0 CA-C-N 115.487 -0.779 . . . . 51.109999999999999 111.293 174.176 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -123.19 156.79 34.39 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.231 1.012 . . . . 74.200000000000003 110.45 -173.244 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 93.6 m -103.22 111.9 24.5 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.318 1.047 . . . . 62.229999999999997 109.023 175.101 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 52.8 m-85 -100.46 101.14 12.01 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 108.078 -1.082 . . . . 71.25 108.078 -177.04 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -134.32 156.16 48.96 Favored 'General case' 0 C--O 1.239 0.519 0 C-N-CA 123.276 0.63 . . . . 74.310000000000002 110.695 -177.267 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.3 ttm180 -159.76 146.8 16.53 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.401 -0.818 . . . . 73.5 108.866 175.699 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 31.8 m -89.09 105.75 17.99 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 108.265 -1.013 . . . . 64.140000000000001 108.265 171.529 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 81.9 m-85 -95.9 119.77 34.97 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.8 0.84 . . . . 64.010000000000005 108.859 -177.003 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.42 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 26.6 mp0 -88.2 108.08 19.11 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 107.987 -1.116 . . . . 75.099999999999994 107.987 -179.676 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.455 HD22 ' HB3' ' A' ' 36' ' ' LYS . 78.6 mt -115.17 99.63 7.56 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.745 0.818 . . . . 74.340000000000003 109.189 -175.058 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.407 ' O ' ' HE3' ' A' ' 36' ' ' LYS . 87.8 t80 -94.11 133.61 37.42 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 108.932 -0.766 . . . . 75.140000000000001 108.932 172.614 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.522 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -130.47 171.81 12.58 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.479 0.711 . . . . 73.439999999999998 109.663 175.785 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 26.4 t -95.66 -32.27 4.37 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 N-CA-C 109.319 -0.623 . . . . 74.409999999999997 109.319 172.477 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.486 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 35.1 mtt180 -132.39 169.57 16.34 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.903 0.881 . . . . 64.430000000000007 109.465 179.369 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -66.59 -41.3 88.7 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.871 0.868 . . . . 74.340000000000003 110.976 175.244 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -65.49 -22.01 66.69 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.514 1.126 . . . . 75.510000000000005 111.885 -178.769 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.522 ' HB2' ' HB1' ' A' ' 27' ' ' ALA . 28.5 mm-40 -78.8 -26.5 44.33 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.377 0.671 . . . . 63.240000000000002 111.039 -179.543 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.507 HD22 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -71.4 -23.43 61.87 Favored 'General case' 0 CA--C 1.557 1.24 0 C-N-CA 123.821 0.848 . . . . 55.420000000000002 110.434 -176.344 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.535 ' HG2' HG23 ' A' ' 80' ' ' ILE . 7.8 mtmp? -57.42 -54.19 49.68 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.303 0.641 . . . . 73.349999999999994 111.713 -175.782 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.569 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 1.9 pp20? -60.6 -31.52 70.68 Favored 'General case' 0 C--N 1.354 0.8 0 CA-C-N 115.814 -0.63 . . . . 74.129999999999995 111.115 -176.766 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.507 ' HD2' HD22 ' A' ' 33' ' ' LEU . 58.4 mttm -67.31 -43.58 81.29 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.797 0.839 . . . . 55.140000000000001 110.417 178.87 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.428 HD13 HD23 ' A' ' 81' ' ' LEU . 75.5 mt -61.05 -39.43 89.8 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.902 0.881 . . . . 73.450000000000003 110.687 175.625 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.402 ' HD3' ' HA ' ' A' ' 35' ' ' GLU . 57.3 mtpt -63.87 -42.61 97.47 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.466 0.707 . . . . 74.219999999999999 111.042 175.794 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.569 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 31.7 mmtp -61.03 -48.12 83.26 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 109.698 -0.482 . . . . 65.150000000000006 109.698 177.492 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 52.9 t -57.13 -50.4 76.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 124.847 1.259 . . . . 54.329999999999998 112.032 178.529 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 70.3 mt -70.75 -49.24 48.93 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.256 0.622 . . . . 53.229999999999997 111.12 -173.383 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.402 ' O ' ' HB2' ' A' ' 46' ' ' ASP . 92.3 m-20 -60.92 -39.05 87.94 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 122.887 0.475 . . . . 74.129999999999995 111.162 177.221 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -63.54 -55.01 27.28 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.662 0.785 . . . . 73.430000000000007 110.951 179.24 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.4 tpm_? -71.0 -33.19 70.15 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 115.573 -0.74 . . . . 72.519999999999996 110.92 -173.242 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 59.6 mtp -89.02 -6.65 57.02 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 112.773 0.657 . . . . 71.319999999999993 112.773 -178.19 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.402 ' HB2' ' O ' ' A' ' 42' ' ' ASN . 29.5 t70 -61.61 -50.31 82.89 Favored Pre-proline 0 CA--C 1.569 1.683 0 CA-C-O 118.739 -0.648 . . . . 74.420000000000002 111.855 178.633 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -71.95 -21.32 24.55 Favored 'Trans proline' 0 C--N 1.391 2.767 0 C-N-CA 121.87 1.713 . . . . 62.450000000000003 112.631 174.245 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.445 HG13 HD13 ' A' ' 12' ' ' ILE . 49.3 mm -68.99 -31.46 50.54 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.262 0 C-N-CA 123.549 0.74 . . . . 65.010000000000005 109.91 -178.278 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 60.1 mttm -63.32 -39.93 95.91 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.243 -0.889 . . . . 75.239999999999995 110.412 174.131 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.48 -28.99 62.23 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 123.429 0.691 . . . . 75.430000000000007 109.798 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 94.6 mt -69.85 -33.13 71.86 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 109.703 -0.481 . . . . 63.200000000000003 109.703 176.605 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 69.94 47.98 43.55 Favored Glycine 0 C--N 1.344 0.999 0 CA-C-N 115.097 -0.956 . . . . 51.340000000000003 113.246 173.242 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 99.3 m -75.98 120.98 22.05 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 109.9 -0.408 . . . . 72.040000000000006 109.9 174.05 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 6.6 ptpp? -60.07 -23.19 63.57 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.435 1.094 . . . . 65.510000000000005 112.082 177.592 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 14.3 ttp180 -159.66 139.54 11.61 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.778 0.831 . . . . 53.020000000000003 109.182 175.048 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 17.3 m -129.32 150.57 34.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 124.229 1.012 . . . . 64.150000000000006 109.944 177.286 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 26.6 ttt180 -101.84 115.48 30.63 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 108.353 -0.98 . . . . 73.329999999999998 108.353 170.209 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 21.1 mt -108.58 102.31 13.8 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 N-CA-C 108.424 -0.954 . . . . 75.129999999999995 108.424 177.431 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.44 ' HB2' ' HE2' ' A' ' 11' ' ' LYS . 57.2 m -102.67 104.97 15.35 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 108.551 -0.907 . . . . 64.140000000000001 108.551 178.559 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.473 ' HB ' HG13 ' A' ' 102' ' ' VAL . 63.3 mt -99.13 111.66 29.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 124.227 1.011 . . . . 74.109999999999999 109.537 -176.085 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.454 ' HB2' ' HB2' ' A' ' 9' ' ' GLN . 2.6 mpt_? -90.88 133.8 34.95 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 108.481 -0.933 . . . . 75.409999999999997 108.481 177.044 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.68 HG13 HG21 ' A' ' 6' ' ' VAL . 39.0 t -107.32 110.78 33.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 N-CA-C 107.581 -1.266 . . . . 65.109999999999999 107.581 173.048 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.12 101.96 9.96 Favored 'General case' 0 C--N 1.353 0.751 0 N-CA-C 107.095 -1.446 . . . . 65.010000000000005 107.095 -176.018 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' HIS . . . . . 0.492 ' HD2' HG12 ' A' ' 62' ' ' VAL . 65.0 m170 -68.13 108.73 3.23 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 114.796 -1.093 . . . . 72.25 110.369 -175.204 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 47.8 t -60.22 -58.34 8.92 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 124.147 0.905 . . . . 74.329999999999998 111.379 -173.774 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -106.93 143.17 35.41 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.513 0.725 . . . . 75.409999999999997 110.718 -176.67 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.445 ' O ' ' HG2' ' A' ' 70' ' ' GLU . . . -72.59 -46.41 54.37 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.833 0.853 . . . . 71.0 111.563 -175.898 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -67.81 -31.75 71.83 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.02 0.528 . . . . 75.420000000000002 112.004 -179.735 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -80.51 -32.78 36.84 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 112.47 0.544 . . . . 74.129999999999995 112.47 -174.741 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.604 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 12.8 pt-20 -66.31 -17.63 64.87 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 114.556 1.317 . . . . 62.200000000000003 114.556 -165.889 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -70.59 -44.46 67.3 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 108.899 -0.778 . . . . 72.349999999999994 108.899 176.713 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 16.6 tppt? -71.5 -44.33 64.9 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 114.945 -1.025 . . . . 70.099999999999994 110.277 174.598 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.604 ' HB3' ' HA ' ' A' ' 70' ' ' GLU . 0.3 OUTLIER -63.84 -52.49 59.88 Favored 'General case' 0 C--O 1.209 -1.076 0 CA-C-N 114.603 -1.181 . . . . 73.109999999999999 110.982 -170.365 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.78 -49.58 74.87 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.526 0.73 . . . . 41.43 112.186 -175.909 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -56.36 -47.39 78.95 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 114.945 -1.025 . . . . 31.210000000000001 111.678 177.071 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -78.85 -22.53 45.96 Favored 'General case' 0 CA--C 1.556 1.207 0 C-N-CA 123.355 0.662 . . . . 61.520000000000003 111.317 -177.095 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -81.79 -21.76 37.53 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.939 0.896 . . . . 72.230000000000004 109.204 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -59.73 -36.17 76.05 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.087 0.555 . . . . 73.200000000000003 110.006 169.416 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -74.7 -37.02 62.73 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.895 0.878 . . . . 53.009999999999998 111.324 176.169 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.535 HG23 ' HG2' ' A' ' 34' ' ' LYS . 31.8 mm -62.42 -43.73 98.53 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 C-N-CA 123.853 0.861 . . . . 54.310000000000002 110.456 175.814 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.543 HD13 HG11 ' A' ' 102' ' ' VAL . 47.5 mt -67.34 -39.33 85.76 Favored 'General case' 0 C--O 1.22 -0.486 0 C-N-CA 124.243 1.017 . . . . 72.0 110.289 176.649 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -62.89 -34.9 78.38 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.725 0.81 . . . . 73.510000000000005 110.996 179.725 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 41.6 mmtm -61.56 -51.29 69.19 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 123.511 0.507 . . . . 73.019999999999996 110.306 172.007 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.472 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 73.9 t -61.31 -46.9 95.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 124.174 0.99 . . . . 61.109999999999999 110.73 -173.789 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.512 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 21.1 m-85 -61.5 -35.46 77.74 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 115.267 -0.879 . . . . 75.319999999999993 110.54 179.581 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -76.02 -29.53 58.14 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.999 0.519 . . . . 73.129999999999995 111.366 176.152 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -78.58 -13.7 59.69 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 122.997 0.519 . . . . 72.219999999999999 110.249 178.875 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 57.7 mt -108.86 -25.14 10.93 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.791 0.836 . . . . 61.109999999999999 110.725 178.22 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 119.77 -17.63 10.08 Favored Glycine 0 C--N 1.349 1.278 0 N-CA-C 115.207 0.843 . . . . 51.020000000000003 115.207 176.485 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.512 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 36.9 m-85 -59.83 135.76 57.79 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.619 0.768 . . . . 74.099999999999994 111.476 -177.241 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -99.05 167.75 10.52 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.965 0.906 . . . . 64.219999999999999 111.799 -172.181 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -56.66 -39.43 73.72 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 125.106 1.363 . . . . 73.510000000000005 112.516 -179.408 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 51.2 p -59.5 -29.03 67.57 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.299 1.039 . . . . 54.240000000000002 111.873 179.135 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -84.16 -26.55 28.74 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.706 0.802 . . . . 72.219999999999999 111.72 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 44.7 t -83.52 104.96 12.67 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 N-CA-C 109.364 -0.606 . . . . 74.25 109.364 -175.467 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 97.2 m -133.02 112.88 12.19 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.442 0.697 . . . . 63.340000000000003 110.248 178.813 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 59.8 m95 -76.32 112.3 12.67 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 123.198 0.599 . . . . 74.049999999999997 110.481 178.452 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -121.6 106.08 11.03 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.753 1.221 . . . . 64.209999999999994 109.303 179.608 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 72.86 54.75 6.95 Favored Glycine 0 C--N 1.35 1.342 0 O-C-N 123.518 0.511 . . . . 51.240000000000002 113.99 172.417 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 60.03 22.77 11.93 Favored 'General case' 0 N--CA 1.503 2.179 0 C-N-CA 124.755 1.222 . . . . 64.299999999999997 111.757 -179.383 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 40.4 m -138.96 141.71 38.41 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.073 1.349 . . . . 72.120000000000005 107.685 -171.788 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.543 HG11 HD13 ' A' ' 81' ' ' LEU . 5.1 p -94.99 107.65 19.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 N-CA-C 108.878 -0.786 . . . . 71.430000000000007 108.878 179.271 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 89.0 m -98.55 107.72 20.24 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.766 0.826 . . . . 72.540000000000006 109.145 -178.752 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 45.2 t -94.73 131.87 40.35 Favored 'Isoleucine or valine' 0 C--O 1.243 0.733 0 C-N-CA 124.818 1.247 . . . . 70.450000000000003 109.631 -178.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -85.13 112.92 21.12 Favored 'General case' 0 C--O 1.24 0.556 0 N-CA-C 107.647 -1.242 . . . . 72.219999999999999 107.647 170.361 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -110.29 137.08 14.04 Favored Glycine 0 N--CA 1.465 0.617 0 CA-C-N 117.8 0.273 . . . . 60.049999999999997 112.889 -177.438 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -133.85 104.11 6.15 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 106.126 -1.805 . . . . 63.030000000000001 106.126 164.379 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.531 ' H ' HD13 ' A' ' 108' ' ' LEU . 0.0 OUTLIER -80.49 163.16 23.97 Favored 'General case' 0 C--O 1.244 0.8 0 C-N-CA 123.581 0.752 . . . . 74.299999999999997 111.303 -171.844 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -81.29 -166.36 1.14 Allowed 'General case' 0 CA--C 1.552 1.055 0 CA-C-N 115.156 -0.929 . . . . 64.439999999999998 110.283 174.353 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 95.1 -78.77 0.86 Allowed Glycine 0 C--N 1.345 1.069 0 N-CA-C 110.857 -0.897 . . . . 72.140000000000001 110.857 178.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 82.8 t -66.26 -38.29 81.56 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 C-N-CA 123.658 0.783 . . . . 64.439999999999998 110.589 179.559 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 29.9 t0 -126.12 78.65 1.78 Allowed 'General case' 0 C--O 1.24 0.569 0 CA-C-N 115.353 -0.839 . . . . 75.109999999999999 108.995 -175.681 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 93.8 mt -75.48 131.95 40.46 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.208 -0.906 . . . . 65.420000000000002 110.715 178.365 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 64.25 39.11 7.61 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.881 1.273 . . . . 62.240000000000002 112.788 172.42 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -73.49 -46.93 45.03 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 105.955 -1.869 . . . . 73.239999999999995 105.955 157.735 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 51.2 t-80 -78.15 86.79 4.28 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 105.885 -1.894 . . . . 65.439999999999998 105.885 159.017 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 47.4 t60 -78.92 13.9 1.57 Allowed 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 124.513 1.125 . . . . 74.340000000000003 113.285 -162.452 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 40.6 m80 -140.87 177.9 7.72 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.138 0.975 . . . . 71.530000000000001 109.545 171.685 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 15.1 m-70 -83.53 166.57 18.15 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.523 0.729 . . . . 75.099999999999994 110.04 -178.881 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 77.7 t60 . . . . . 0 CA--C 1.555 1.137 0 N-CA-C 109.147 -0.686 . . . . 73.219999999999999 109.147 174.105 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.4 ttm . . . . . 0 N--CA 1.476 0.829 0 CA-C-O 121.657 0.742 . . . . 64.299999999999997 109.312 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 27.7 t -82.38 105.26 13.31 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 107.306 -1.368 . . . . 73.540000000000006 107.306 173.312 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -178.42 90.57 0.08 OUTLIER Glycine 0 C--N 1.334 0.444 0 N-CA-C 110.168 -1.173 . . . . 41.329999999999998 110.168 -175.599 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? -97.54 143.13 28.54 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.401 0.681 . . . . 73.25 109.707 -178.479 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.483 ' HA ' ' HA ' ' A' ' 26' ' ' TYR . 23.7 ttpp -83.81 115.04 22.05 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.18 -1.044 . . . . 71.540000000000006 108.18 165.637 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -101.53 152.56 5.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 N-CA-C 106.341 -1.725 . . . . 64.319999999999993 106.341 170.944 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.476 ' H ' ' HB2' ' A' ' 63' ' ' LYS . 42.6 mt-10 -120.0 114.55 22.2 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.676 0.75 . . . . 73.120000000000005 109.607 175.59 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.407 HG21 HD12 ' A' ' 25' ' ' LEU . 62.3 t -96.36 113.39 30.61 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 125.105 1.362 . . . . 55.439999999999998 109.165 -174.434 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 91.9 mt-30 -96.94 103.03 14.92 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 108.231 -1.026 . . . . 55.520000000000003 108.231 -178.125 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 79.9 t -95.98 110.01 23.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 N-CA-C 109.028 -0.73 . . . . 64.319999999999993 109.028 -177.678 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.405 ' HG3' ' HB3' ' A' ' 20' ' ' GLU . 39.5 ttmt -113.21 102.79 10.7 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.905 0.882 . . . . 72.349999999999994 108.754 -178.339 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 10.3 tt -118.07 118.07 56.94 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 C-N-CA 123.098 0.559 . . . . 70.129999999999995 110.302 -176.858 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 60.1 m -90.62 110.49 21.64 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 109.079 -0.711 . . . . 72.420000000000002 109.079 175.663 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.609 ' SG ' HG23 ' A' ' 48' ' ' ILE . 42.4 t -112.67 124.47 52.63 Favored 'General case' 0 C--O 1.244 0.796 0 N-CA-C 107.631 -1.248 . . . . 70.329999999999998 107.631 179.353 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.517 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 43.8 t30 70.19 -80.45 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.021 1.328 . . . . 64.219999999999999 109.51 -176.314 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -158.98 18.47 0.27 Allowed Glycine 0 N--CA 1.464 0.536 0 N-CA-C 111.166 -0.774 . . . . 70.219999999999999 111.166 176.398 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.477 ' HE2' ' HA ' ' A' ' 17' ' ' LYS . 11.1 mmpt? -117.46 126.23 52.27 Favored 'General case' 0 C--N 1.348 0.529 0 C-N-CA 124.344 1.058 . . . . 75.319999999999993 108.77 -179.562 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 38.2 m -94.68 122.09 36.92 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.646 0.778 . . . . 51.140000000000001 109.532 -176.729 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.688 ' HB3' HH21 ' A' ' 44' ' ' ARG . 67.3 m-85 -113.71 101.21 9.1 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.807 0.843 . . . . 74.530000000000001 109.639 -175.172 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.405 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 12.8 pt-20 -118.82 149.24 41.85 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.408 0.683 . . . . 74.329999999999998 110.528 -178.476 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 39.8 ttp180 -166.22 137.08 3.52 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.622 0.769 . . . . 72.239999999999995 109.904 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 39.4 m -86.24 109.36 18.88 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 109.009 -0.737 . . . . 60.420000000000002 109.009 175.741 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 28.3 m-85 -96.7 134.33 40.1 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 107.985 -1.117 . . . . 72.540000000000006 107.985 177.338 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -92.58 108.52 20.04 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 107.661 -1.237 . . . . 63.229999999999997 107.661 177.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.407 HD12 HG21 ' A' ' 8' ' ' VAL . 69.7 mt -111.62 96.81 6.31 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 109.187 -0.672 . . . . 44.5 109.187 177.281 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.483 ' HA ' ' HA ' ' A' ' 5' ' ' LYS . 44.6 t80 -93.41 133.92 36.19 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.259 1.024 . . . . 61.009999999999998 109.19 173.536 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.556 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -151.67 144.79 24.61 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 122.453 0.301 . . . . 51.439999999999998 111.217 179.387 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 94.3 t -65.12 -45.98 92.52 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 O-C-N 124.578 1.174 . . . . 30.43 109.586 173.29 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.564 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 58.4 mtt85 -124.05 155.96 37.38 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.42 0.688 . . . . 74.519999999999996 110.118 -179.186 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -65.37 -27.35 68.51 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.58 0.752 . . . . 74.239999999999995 110.37 170.904 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -53.08 -44.88 67.9 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.419 1.088 . . . . 64.329999999999998 110.962 168.421 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.564 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 13.6 mm-40 -73.1 -23.73 60.56 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 115.527 -0.76 . . . . 75.430000000000007 111.143 -177.433 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.418 HD22 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -76.15 -26.83 56.67 Favored 'General case' 0 CA--C 1.559 1.292 0 C-N-CA 123.346 0.658 . . . . 71.200000000000003 110.133 -178.28 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.498 ' HG2' HG23 ' A' ' 80' ' ' ILE . 55.7 mtpt -60.64 -47.38 86.49 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 123.386 0.674 . . . . 74.329999999999998 112.765 -176.037 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -62.33 -35.39 78.94 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.527 0.731 . . . . 75.120000000000005 111.511 175.819 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.418 ' HD2' HD22 ' A' ' 33' ' ' LEU . 66.7 mttm -67.72 -42.82 81.34 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.655 0.782 . . . . 64.109999999999999 110.54 -179.069 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.466 HD13 HD23 ' A' ' 81' ' ' LEU . 88.8 mt -59.27 -45.95 89.85 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 124.15 0.906 . . . . 71.329999999999998 110.216 176.029 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -54.76 -48.47 72.58 Favored 'General case' 0 N--CA 1.482 1.144 0 O-C-N 123.741 0.651 . . . . 72.040000000000006 110.964 174.261 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.477 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 4.5 mmmp? -60.81 -59.51 5.27 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.233 0.613 . . . . 74.439999999999998 110.98 -178.23 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 60.7 t -48.65 -44.49 14.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 C-N-CA 125.196 1.398 . . . . 63.030000000000001 111.894 -178.822 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.468 HD21 HD11 ' A' ' 60' ' ' ILE . 58.5 mt -65.88 -51.41 59.0 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.312 -0.858 . . . . 73.030000000000001 110.802 177.305 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -68.56 -22.35 64.48 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 113.145 0.794 . . . . 72.549999999999997 113.145 -176.438 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 15.6 mm-40 -74.73 -53.56 8.99 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 108.61 -0.885 . . . . 73.439999999999998 108.61 174.453 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.688 HH21 ' HB3' ' A' ' 19' ' ' TYR . 17.7 tpt180 -74.64 -25.86 59.49 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-N 114.888 -1.051 . . . . 74.120000000000005 111.695 -171.133 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 55.6 mtp -92.39 -8.39 45.02 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 112.639 0.607 . . . . 54.399999999999999 112.639 -179.091 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.563 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 33.9 t70 -59.27 -49.84 90.66 Favored Pre-proline 0 CA--C 1.567 1.609 0 CA-C-O 118.791 -0.623 . . . . 72.409999999999997 112.206 177.527 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.442 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 39.5 Cg_endo -65.36 -28.53 54.72 Favored 'Trans proline' 0 C--N 1.39 2.761 0 C-N-CA 121.835 1.69 . . . . 74.439999999999998 112.644 173.698 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.609 HG23 ' SG ' ' A' ' 14' ' ' CYS . 50.0 mm -67.91 -36.97 77.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 C-N-CA 124.148 0.979 . . . . 54.350000000000001 111.511 -170.749 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.563 ' HE2' ' HA ' ' A' ' 46' ' ' ASP . 44.3 mtmt -66.81 -41.15 88.01 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 115.98 -0.554 . . . . 74.340000000000003 109.701 177.167 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -72.52 -24.73 61.19 Favored 'General case' 0 CA--C 1.557 1.233 0 CA-C-N 114.603 -1.18 . . . . 70.349999999999994 110.189 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 83.3 mt -75.7 -33.01 60.32 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.265 0.626 . . . . 75.200000000000003 110.416 173.654 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 72.59 55.05 6.94 Favored Glycine 0 C--N 1.345 1.073 0 CA-C-N 115.91 -0.586 . . . . 43.530000000000001 113.052 178.501 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.517 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 65.6 m -94.54 113.8 25.68 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 108.525 -0.917 . . . . 61.329999999999998 108.525 173.153 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.4 mtpm? -63.73 -78.33 0.05 OUTLIER 'General case' 0 N--CA 1.476 0.851 0 O-C-N 123.601 0.563 . . . . 74.239999999999995 110.216 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 15.1 ttm180 -84.3 121.21 27.2 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 109.321 -0.622 . . . . 71.409999999999997 109.321 178.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 29.3 m -126.26 138.5 54.43 Favored 'Isoleucine or valine' 0 C--O 1.243 0.738 0 C-N-CA 124.275 1.03 . . . . 64.140000000000001 108.589 173.618 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 58.9 ttt180 -103.09 109.43 20.99 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 107.775 -1.195 . . . . 53.32 107.775 169.359 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.409 HG22 HG13 ' A' ' 60' ' ' ILE . 34.0 mt -96.05 102.33 13.4 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 N-CA-C 106.791 -1.559 . . . . 62.210000000000001 106.791 173.927 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.3 m -100.68 102.77 13.96 Favored 'General case' 0 C--O 1.24 0.593 0 N-CA-C 107.597 -1.26 . . . . 75.409999999999997 107.597 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.468 HD11 HD21 ' A' ' 41' ' ' LEU . 72.2 mt -102.75 118.62 49.94 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 C-N-CA 123.343 0.657 . . . . 73.340000000000003 109.279 -178.136 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 51.9 mtm180 -108.5 118.84 37.83 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 108.55 -0.907 . . . . 71.209999999999994 108.55 175.812 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 7.2 p -92.82 138.25 20.49 Favored 'Isoleucine or valine' 0 C--O 1.242 0.679 0 N-CA-C 108.063 -1.088 . . . . 74.329999999999998 108.063 177.656 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.476 ' HB2' ' H ' ' A' ' 7' ' ' GLU . 10.3 mmpt? -80.12 110.1 15.21 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 107.355 -1.35 . . . . 75.219999999999999 107.355 174.134 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 55.6 m80 -75.98 142.65 41.88 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 115.342 -0.844 . . . . 74.109999999999999 109.125 -176.192 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.466 ' H ' ' HG2' ' A' ' 73' ' ' GLU . 32.0 m -52.15 -40.46 61.44 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.627 1.171 . . . . 71.409999999999997 113.641 -170.627 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -169.28 164.88 10.93 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.155 0.982 . . . . 73.150000000000006 108.732 -174.795 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -74.92 -26.19 59.45 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 112.697 0.629 . . . . 74.439999999999998 112.697 -178.299 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.69 -40.51 25.29 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 109.587 -0.523 . . . . 75.329999999999998 109.587 171.682 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -70.01 -17.58 63.28 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 115.436 -0.802 . . . . 73.140000000000001 111.658 175.684 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -49.72 -44.06 48.12 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 125.472 1.509 . . . . 75.049999999999997 112.284 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 24.5 mtpp -61.8 -37.24 83.65 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 114.623 -1.171 . . . . 73.200000000000003 111.357 -178.45 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.5 ' HA ' ' HE3' ' A' ' 72' ' ' LYS . 0.9 OUTLIER -83.65 -39.59 20.06 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 115.474 -0.784 . . . . 53.32 111.206 178.104 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.466 ' HG2' ' H ' ' A' ' 65' ' ' SER . 16.4 tp10 -76.65 -44.4 34.1 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.851 0.861 . . . . 74.209999999999994 111.18 -161.905 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.02 -48.87 74.63 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 123.928 0.767 . . . . 71.109999999999999 110.685 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 49.6 tptt -61.44 -43.81 98.21 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.291 1.037 . . . . 71.340000000000003 111.584 -179.318 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.9 tmmm? -64.18 -50.86 66.45 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 124.522 1.129 . . . . 72.209999999999994 110.137 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -75.21 -24.2 57.71 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 115.445 -0.798 . . . . 74.319999999999993 111.023 -171.314 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.72 -42.71 99.79 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.613 0.765 . . . . 72.120000000000005 110.769 174.729 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.28 -37.11 84.68 Favored 'General case' 0 CA--C 1.547 0.865 0 CA-C-N 115.227 -0.897 . . . . 72.209999999999994 111.214 177.354 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.498 HG23 ' HG2' ' A' ' 34' ' ' LYS . 48.2 mm -63.16 -47.12 93.92 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 C-N-CA 124.055 0.942 . . . . 74.540000000000006 110.728 177.197 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.659 HD13 HG11 ' A' ' 102' ' ' VAL . 56.1 mt -64.37 -46.2 84.41 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.862 0.865 . . . . 65.430000000000007 111.253 -177.178 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -59.59 -32.97 70.88 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.851 0.86 . . . . 75.299999999999997 109.907 -174.976 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -69.15 -48.01 63.46 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.324 0.65 . . . . 73.219999999999999 111.222 174.687 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 77.5 t -64.97 -44.86 96.02 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 C-N-CA 123.03 0.532 . . . . 53.329999999999998 111.371 -172.318 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 33.9 m-85 -61.29 -37.32 82.76 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.189 0.596 . . . . 53.329999999999998 110.942 175.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.53 -30.64 70.35 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.453 0.701 . . . . 75.530000000000001 111.437 175.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -81.18 -2.25 47.88 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.214 1.006 . . . . 75.230000000000004 111.138 178.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.7 mt -104.94 -24.56 12.82 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.924 0.89 . . . . 74.120000000000005 109.772 173.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 128.15 -17.15 5.98 Favored Glycine 0 C--N 1.346 1.118 0 CA-C-O 119.421 -0.655 . . . . 61.43 113.109 178.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -61.05 138.06 58.21 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-N 117.266 0.533 . . . . 72.540000000000006 110.422 178.222 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -81.01 169.25 17.74 Favored 'General case' 0 C--O 1.243 0.756 0 C-N-CA 123.26 0.624 . . . . 73.319999999999993 109.525 176.359 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -61.94 -37.16 83.65 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.009 0.524 . . . . 44.020000000000003 111.448 -178.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 40.4 p -63.54 -25.41 68.24 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.367 1.067 . . . . 73.310000000000002 113.083 179.203 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ASN . . . . . 0.428 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 12.7 m120 -63.56 -39.92 95.64 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 122.687 0.395 . . . . 70.430000000000007 110.251 172.548 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 36.3 t -83.74 102.58 9.9 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.93 0 C-N-CA 124.352 1.061 . . . . 74.439999999999998 109.8 -171.887 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.412 ' O ' ' HA ' ' A' ' 102' ' ' VAL . 5.9 m -111.21 152.86 26.61 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.683 0.793 . . . . 62.329999999999998 109.079 -179.258 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 20.6 m95 -128.6 115.7 18.48 Favored 'General case' 0 N--CA 1.484 1.243 0 CA-C-N 118.335 0.516 . . . . 74.329999999999998 109.777 176.02 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -157.77 126.78 5.75 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.426 1.09 . . . . 72.310000000000002 110.131 -174.383 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 62.48 46.75 93.15 Favored Glycine 0 C--N 1.352 1.47 0 C-N-CA 123.049 0.356 . . . . 72.420000000000002 112.981 179.024 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 59.08 9.3 1.24 Allowed 'General case' 0 N--CA 1.503 2.198 0 C-N-CA 126.632 1.973 . . . . 73.400000000000006 113.243 -176.575 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 33.0 m -109.27 145.12 36.46 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.637 1.175 . . . . 73.219999999999999 109.199 -174.526 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.659 HG11 HD13 ' A' ' 81' ' ' LEU . 6.0 p -97.89 108.85 22.51 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.852 0 N-CA-C 107.961 -1.126 . . . . 64.219999999999999 107.961 166.006 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 80.0 m -92.64 100.93 13.35 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 108.564 -0.902 . . . . 74.409999999999997 108.564 179.205 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.428 ' HA ' ' O ' ' A' ' 94' ' ' ASN . 52.3 t -95.29 108.43 20.92 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 N-CA-C 107.483 -1.303 . . . . 73.230000000000004 107.483 175.345 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -119.06 129.47 55.11 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 107.644 -1.243 . . . . 74.030000000000001 107.644 179.594 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -160.71 -164.88 16.43 Favored Glycine 0 C--O 1.241 0.54 0 N-CA-C 111.344 -0.702 . . . . 73.439999999999998 111.344 -178.529 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -127.24 119.38 26.24 Favored 'General case' 0 C--O 1.243 0.751 0 C-N-CA 123.064 0.546 . . . . 73.409999999999997 110.049 177.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 4.9 tt -72.44 129.0 37.31 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 107.083 -1.451 . . . . 65.530000000000001 107.083 166.38 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -56.87 105.24 0.2 Allowed 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.527 0.731 . . . . 71.319999999999993 111.206 -174.585 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -169.57 43.4 0.21 Allowed Glycine 0 C--N 1.34 0.758 0 CA-C-N 114.996 -1.002 . . . . 70.239999999999995 110.684 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 4.2 t -78.19 80.06 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 123.735 0.814 . . . . 72.340000000000003 110.682 -170.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -172.07 -36.81 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.919 1.288 . . . . 61.439999999999998 108.09 177.194 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 71.2 mt -68.48 82.12 0.26 Allowed 'General case' 0 CA--C 1.55 0.952 0 CA-C-N 114.868 -1.06 . . . . 72.310000000000002 110.474 177.168 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.76 144.94 52.57 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 114.998 -1.001 . . . . 44.229999999999997 110.803 -177.097 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -66.4 96.47 0.36 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 123.75 0.82 . . . . 65.120000000000005 111.002 -176.264 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 67.7 m-70 -67.95 -18.49 64.76 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 122.801 0.44 . . . . 74.019999999999996 110.322 172.096 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 70.0 m-70 -68.01 86.89 0.25 Allowed 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 108.72 -0.844 . . . . 75.439999999999998 108.72 162.649 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 26.4 p80 -161.44 170.08 20.69 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.834 1.254 . . . . 75.219999999999999 108.395 177.481 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 48.0 t-80 -78.98 126.5 30.77 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 122.873 0.469 . . . . 72.299999999999997 110.981 -178.462 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 25.5 t-80 . . . . . 0 C--O 1.249 1.064 0 C-N-CA 124.43 1.092 . . . . 74.230000000000004 108.246 175.794 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.7 tpp . . . . . 0 N--CA 1.481 1.118 0 N-CA-C 109.139 -0.689 . . . . 74.349999999999994 109.139 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 45.3 m -84.65 54.72 3.13 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.567 0.747 . . . . 72.310000000000002 111.002 -177.154 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 124.43 -144.12 15.13 Favored Glycine 0 C--N 1.348 1.215 0 CA-C-N 116.085 -0.507 . . . . 74.049999999999997 113.576 177.434 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.48 ' HA ' ' HE3' ' A' ' 4' ' ' LYS . 0.8 OUTLIER -154.1 130.91 10.83 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.972 0.909 . . . . 72.120000000000005 110.305 -171.996 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -97.84 139.81 33.14 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 108.434 -0.95 . . . . 72.109999999999999 108.434 168.749 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 5.6 p -143.05 146.68 21.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 123.547 0.739 . . . . 75.450000000000003 109.919 177.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.525 ' HG3' ' HG3' ' A' ' 24' ' ' GLN . 3.4 mp0 -106.19 117.85 35.1 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 107.917 -1.142 . . . . 70.219999999999999 107.917 174.517 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.583 HG22 HG23 ' A' ' 62' ' ' VAL . 95.0 t -104.48 127.92 58.45 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 124.324 1.05 . . . . 74.129999999999995 108.757 -176.99 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.421 ' O ' ' HA ' ' A' ' 60' ' ' ILE . 45.7 mt-30 -111.1 101.88 10.38 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 109.198 -0.668 . . . . 52.450000000000003 109.198 176.126 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 88.0 t -93.84 112.07 26.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 N-CA-C 108.466 -0.939 . . . . 60.32 108.466 -179.533 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.437 ' O ' ' HA ' ' A' ' 58' ' ' ILE . 39.6 ttmt -106.48 104.4 14.08 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 108.455 -0.943 . . . . 65.140000000000001 108.455 179.548 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 14.9 tt -116.49 116.91 53.73 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 CA-C-O 121.381 0.61 . . . . 72.239999999999995 109.813 -178.709 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 50.7 m -104.81 135.79 45.53 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 123.372 0.669 . . . . 73.230000000000004 111.122 -175.383 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 39.8 t -163.32 141.21 7.78 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.179 0.992 . . . . 75.349999999999994 111.339 174.344 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 14.2 m120 60.49 32.24 20.46 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 125.279 1.432 . . . . 64.510000000000005 112.74 171.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 87.97 -1.98 85.33 Favored Glycine 0 C--N 1.345 1.056 0 CA-C-N 115.974 -0.557 . . . . 34.520000000000003 113.837 177.084 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 24.4 mmmt -115.21 147.63 40.09 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.243 0.617 . . . . 62.200000000000003 110.392 178.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 53.2 m -116.15 130.46 56.81 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 124.102 0.961 . . . . 54.130000000000003 108.731 175.69 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.1 m-85 -114.76 100.36 8.18 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 108.407 -0.96 . . . . 61.32 108.407 -179.518 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -127.84 142.05 51.39 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.108 0.563 . . . . 74.430000000000007 110.254 -177.953 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.3 tpt180 -159.4 145.27 16.14 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 115.87 -0.605 . . . . 73.409999999999997 109.939 -173.243 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 22.6 m -98.33 109.08 21.89 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 124.307 1.043 . . . . 63.240000000000002 109.706 178.028 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.402 ' HE1' HH21 ' A' ' 44' ' ' ARG . 5.8 m-85 -100.83 137.87 38.64 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.555 1.142 . . . . 74.120000000000005 108.67 -179.107 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.525 ' HG3' ' HG3' ' A' ' 7' ' ' GLU . 27.0 mp0 -103.59 108.23 19.42 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 108.349 -0.982 . . . . 65.400000000000006 108.349 178.457 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 80.4 mt -112.07 99.29 7.96 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.335 1.054 . . . . 55.32 109.637 -174.367 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 89.1 t80 -92.93 135.55 34.04 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 108.88 -0.785 . . . . 64.120000000000005 108.88 169.837 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.565 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -141.03 150.22 42.72 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.989 0.916 . . . . 70.230000000000004 109.467 179.718 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.0 t -80.87 -38.92 17.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-O 121.263 0.554 . . . . 74.219999999999999 110.338 175.285 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.542 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 52.2 mtt180 -119.92 163.34 17.71 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.279 0.631 . . . . 73.530000000000001 110.174 175.386 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -65.18 -34.57 78.69 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 115.253 -0.885 . . . . 52.439999999999998 109.919 170.869 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.524 ' HA ' ' HD3' ' A' ' 34' ' ' LYS . 25.4 mm-40 -56.99 -39.66 75.08 Favored 'General case' 0 C--N 1.359 1.015 0 C-N-CA 124.297 1.039 . . . . 71.140000000000001 111.573 173.255 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.565 ' HB2' ' HB1' ' A' ' 27' ' ' ALA . 29.9 mm-40 -68.04 -40.85 82.76 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 116.005 -0.543 . . . . 51.509999999999998 110.274 178.599 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.49 -33.92 76.64 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.637 0.775 . . . . 74.299999999999997 110.368 -179.305 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.524 ' HD3' ' HA ' ' A' ' 31' ' ' GLU . 59.6 mtpt -59.43 -51.79 68.4 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.629 0.772 . . . . 72.420000000000002 112.21 -178.649 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.524 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 1.2 pp20? -67.86 -28.04 67.19 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-O 119.467 -0.301 . . . . 63.020000000000003 111.33 179.659 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -64.89 -40.99 95.96 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.137 0.575 . . . . 75.040000000000006 111.054 174.743 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.475 HD13 HD23 ' A' ' 81' ' ' LEU . 70.3 mt -61.18 -44.17 97.72 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 123.747 0.655 . . . . 74.140000000000001 110.729 173.736 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -61.23 -39.35 89.95 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 122.834 0.453 . . . . 71.310000000000002 111.474 176.718 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.524 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 33.7 mmtp -61.39 -54.42 43.9 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.45 0.7 . . . . 74.040000000000006 110.691 176.828 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 47.1 t -58.43 -51.52 70.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 124.549 1.139 . . . . 71.5 112.169 -177.66 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 70.3 mt -65.72 -48.79 70.79 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 124.054 0.846 . . . . 65.340000000000003 111.384 -174.304 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 31.0 t-20 -60.79 -46.52 90.19 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.256 0.622 . . . . 64.519999999999996 110.419 -178.618 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -60.7 -43.87 97.25 Favored 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 123.622 0.769 . . . . 73.519999999999996 112.177 177.371 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.402 HH21 ' HE1' ' A' ' 23' ' ' TYR . 17.1 tpp180 -66.45 -24.89 66.51 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 123.504 0.722 . . . . 75.0 111.298 -178.829 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.483 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 65.3 mtp -85.43 -14.03 47.43 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-O 118.205 -0.902 . . . . 62.140000000000001 112.877 176.774 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.462 ' HA ' ' HD2' ' A' ' 49' ' ' LYS . 0.8 OUTLIER -60.34 -43.98 94.73 Favored Pre-proline 0 N--CA 1.503 2.21 0 CA-C-N 119.861 1.209 . . . . 73.329999999999998 113.42 -179.746 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.469 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 12.3 Cg_endo -56.71 -37.19 98.35 Favored 'Trans proline' 0 C--N 1.394 2.956 0 C-N-CA 121.715 1.61 . . . . 73.439999999999998 111.802 167.556 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.438 HG23 ' SG ' ' A' ' 53' ' ' CYS . 35.1 mm -72.78 -29.2 29.09 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.211 0 C-N-CA 124.77 1.228 . . . . 74.319999999999993 110.844 -174.06 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.66 ' HA ' HD11 ' A' ' 108' ' ' LEU . 80.9 mttt -75.1 -39.25 60.82 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.288 0.635 . . . . 73.340000000000003 109.681 179.401 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.6 ttpm? -69.44 -26.05 64.41 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 115.185 -0.916 . . . . 73.349999999999994 111.233 173.168 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 69.8 mt -72.3 -32.48 66.62 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 109.311 -0.626 . . . . 73.25 109.311 171.839 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 82.59 38.31 12.45 Favored Glycine 0 C--N 1.348 1.212 0 CA-C-N 115.897 -0.592 . . . . 42.5 112.297 178.497 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.438 ' SG ' HG23 ' A' ' 48' ' ' ILE . 33.1 m -73.51 118.98 17.11 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.563 0.745 . . . . 74.209999999999994 110.541 -179.076 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.95 -55.47 16.66 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 122.909 0.484 . . . . 71.439999999999998 110.349 177.417 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.1 ttm180 -121.51 144.57 48.64 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.984 0.913 . . . . 75.200000000000003 109.05 178.479 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 35.2 m -125.78 145.0 33.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 124.191 0.996 . . . . 75.519999999999996 109.326 179.165 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 38.6 ttm180 -109.37 109.61 20.53 Favored 'General case' 0 C--O 1.238 0.5 0 N-CA-C 107.948 -1.13 . . . . 74.530000000000001 107.948 173.418 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.437 ' HA ' ' O ' ' A' ' 11' ' ' LYS . 36.6 mt -105.95 134.85 46.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 C-N-CA 123.82 0.848 . . . . 70.129999999999995 108.933 179.329 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 50.9 m -129.35 106.97 9.15 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 107.45 -1.315 . . . . 44.200000000000003 107.45 173.372 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.474 ' HB ' HG13 ' A' ' 102' ' ' VAL . 76.3 mt -98.88 122.21 50.33 Favored 'Isoleucine or valine' 0 C--O 1.24 0.563 0 C-N-CA 123.513 0.725 . . . . 75.239999999999995 110.066 -177.784 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -104.28 103.4 13.15 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 107.078 -1.453 . . . . 75.319999999999993 107.078 172.918 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.583 HG23 HG22 ' A' ' 8' ' ' VAL . 6.7 p -95.98 146.09 7.63 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 N-CA-C 108.776 -0.824 . . . . 74.329999999999998 108.776 -177.774 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.441 ' HG3' ' HB2' ' A' ' 7' ' ' GLU . 12.7 mmmm -81.35 109.26 15.68 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.123 0.487 . . . . 71.150000000000006 110.236 177.967 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' HIS . . . . . 0.428 ' HB2' ' HG2' ' A' ' 70' ' ' GLU . 53.4 m-70 -80.88 111.66 17.55 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 107.501 -1.296 . . . . 74.409999999999997 107.501 178.592 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 38.8 t -20.29 -68.35 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 C-N-CA 127.249 2.22 . . . . 45.039999999999999 115.281 -166.579 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.558 ' H ' ' HB2' ' A' ' 69' ' ' GLU . 6.6 m-20 -137.1 173.17 11.98 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 108.057 -1.09 . . . . 74.439999999999998 108.057 174.81 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.8 -41.91 97.81 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.431 0.693 . . . . 75.219999999999999 111.479 -173.682 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -73.57 -26.87 61.02 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.097 0.559 . . . . 71.140000000000001 111.372 176.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.558 ' HB2' ' H ' ' A' ' 66' ' ' ASP . 18.4 mm-40 -74.97 -27.55 60.21 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-O 118.697 -0.668 . . . . 52.539999999999999 111.707 179.74 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.428 ' HG2' ' HB2' ' A' ' 64' ' ' HIS . 48.5 mt-10 -46.98 -40.03 13.63 Favored 'General case' 0 N--CA 1.498 1.959 0 N-CA-C 114.449 1.277 . . . . 75.140000000000001 114.449 -166.976 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 58.2 mttp -65.99 -58.21 6.05 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.23 0.612 . . . . 74.340000000000003 111.088 -176.65 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.9 tptt -66.19 -35.71 81.17 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.192 0.997 . . . . 72.230000000000004 111.048 -178.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -64.61 -48.02 76.43 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.433 1.093 . . . . 71.329999999999998 109.438 -179.371 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.48 -39.84 92.41 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 124.129 0.893 . . . . 24.329999999999998 111.631 -177.233 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -62.01 -43.64 98.4 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.495 0.718 . . . . 71.150000000000006 110.949 175.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.16 -44.55 83.76 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 124.109 0.964 . . . . 71.219999999999999 110.351 178.394 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -76.15 -20.27 57.73 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 115.55 -0.75 . . . . 74.109999999999999 110.523 -174.473 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.83 -43.07 94.29 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.344 0.657 . . . . 72.530000000000001 109.915 171.128 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.4 -41.03 85.6 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 123.439 0.696 . . . . 52.009999999999998 111.092 176.392 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.446 HG23 ' HG2' ' A' ' 34' ' ' LYS . 31.8 mm -57.71 -53.45 44.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 124.514 1.126 . . . . 63.25 110.914 177.125 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.475 HD23 HD13 ' A' ' 37' ' ' LEU . 43.8 mt -69.24 -33.25 72.99 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.779 0.832 . . . . 62.140000000000001 112.294 -178.934 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 62.3 t30 -59.32 -38.22 79.75 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.318 0.647 . . . . 65.239999999999995 110.394 -178.639 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -71.11 -46.08 62.4 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 114.575 -1.193 . . . . 75.450000000000003 111.756 175.757 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 54.6 t -62.34 -54.33 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 C-N-CA 123.949 0.9 . . . . 75.230000000000004 110.801 -173.921 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.581 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 22.2 m-85 -59.5 -37.08 77.34 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 115.017 -0.992 . . . . 61.100000000000001 111.93 -179.609 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.69 -26.64 67.12 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.306 0.643 . . . . 74.299999999999997 112.015 179.454 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -85.85 -12.76 49.94 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.023 0.929 . . . . 72.329999999999998 110.683 177.582 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.7 mt -107.21 0.51 23.32 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.608 0.763 . . . . 74.329999999999998 111.751 -174.868 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 103.18 -7.13 51.51 Favored Glycine 0 C--N 1.345 1.061 0 N-CA-C 114.252 0.461 . . . . 71.239999999999995 114.252 176.328 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.581 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 46.6 m-85 -84.44 131.82 34.63 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.469 0.708 . . . . 65.219999999999999 110.059 178.389 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -116.44 -166.06 1.12 Allowed 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 124.509 1.124 . . . . 61.219999999999999 109.874 -177.479 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -50.65 -51.13 51.94 Favored 'General case' 0 N--CA 1.492 1.668 0 C-N-CA 124.024 0.929 . . . . 72.510000000000005 112.278 -179.216 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 20.1 m -63.17 -17.69 62.66 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 124.205 1.002 . . . . 74.230000000000004 112.838 -176.564 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ASN . . . . . 0.426 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 18.4 m120 -94.12 -38.98 10.82 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.511 0.725 . . . . 72.340000000000003 110.827 -175.936 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 42.1 t -89.82 127.32 42.5 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 122.708 0.403 . . . . 74.219999999999999 109.98 -176.154 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 27.1 m -145.74 113.68 6.49 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.314 0.646 . . . . 75.200000000000003 109.862 178.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 68.2 m95 -82.07 142.34 32.39 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 122.778 0.431 . . . . 73.439999999999998 110.411 174.193 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -144.22 94.62 2.6 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.344 1.057 . . . . 73.310000000000002 108.93 -177.039 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 67.5 -92.98 0.23 Allowed Glycine 0 C--N 1.348 1.204 0 CA-C-N 115.531 -0.758 . . . . 74.319999999999993 113.686 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -114.72 -19.45 11.05 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.348 1.059 . . . . 72.510000000000005 110.395 -175.42 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 89.0 m -100.14 149.65 23.3 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.998 1.319 . . . . 72.450000000000003 110.541 -177.385 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.474 HG13 ' HB ' ' A' ' 60' ' ' ILE . 3.3 p -110.99 113.39 44.14 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 N-CA-C 108.523 -0.917 . . . . 75.200000000000003 108.523 169.863 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 48.7 m -100.54 111.19 23.41 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 108.957 -0.757 . . . . 54.450000000000003 108.957 178.725 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.426 ' HA ' ' O ' ' A' ' 94' ' ' ASN . 86.1 t -110.37 109.93 30.29 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 N-CA-C 109.297 -0.631 . . . . 55.119999999999997 109.297 177.419 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -110.46 111.49 22.78 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 107.463 -1.31 . . . . 73.430000000000007 107.463 177.059 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -157.85 172.87 35.12 Favored Glycine 0 C--N 1.342 0.903 0 C-N-CA 121.802 -0.237 . . . . 70.530000000000001 112.718 -174.405 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -85.78 158.51 19.98 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 121.906 0.86 . . . . 73.420000000000002 112.142 -172.591 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.66 HD11 ' HA ' ' A' ' 49' ' ' LYS . 2.2 tt -74.3 135.58 42.59 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 113.796 -1.547 . . . . 64.299999999999997 107.823 172.26 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -53.96 -63.12 1.25 Allowed 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.965 0.906 . . . . 73.439999999999998 111.692 178.67 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -169.18 128.66 1.72 Allowed Glycine 0 C--N 1.339 0.715 0 CA-C-N 115.412 -0.813 . . . . 41.399999999999999 111.169 179.083 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 92.6 t -69.01 105.86 1.11 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.879 0 N-CA-C 108.945 -0.761 . . . . 60.130000000000003 108.945 174.746 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 29.6 t70 67.8 87.14 0.12 Allowed 'General case' 0 C--N 1.35 0.629 0 C-N-CA 125.069 1.348 . . . . 74.329999999999998 110.072 -178.048 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 96.6 mt -69.37 129.64 40.33 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.49 -0.777 . . . . 73.120000000000005 111.341 -176.336 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -65.95 -49.85 66.44 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.109 0.964 . . . . 75.329999999999998 109.257 172.147 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 29.6 t60 -80.94 77.19 7.85 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 107.907 -1.146 . . . . 75.200000000000003 107.907 173.594 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 21.9 p80 -104.07 -6.18 21.37 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 115.81 -0.632 . . . . 74.510000000000005 112.627 -172.464 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 34.5 m170 -76.71 82.69 3.34 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 109.259 -0.645 . . . . 70.129999999999995 109.259 173.255 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 24.7 p80 -166.83 157.45 11.94 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.987 1.315 . . . . 74.109999999999999 108.249 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -70.17 155.28 40.85 Favored 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 109.52 -0.548 . . . . 70.310000000000002 109.52 177.464 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 73.7 m-70 . . . . . 0 CA--C 1.556 1.177 0 N-CA-C 109.101 -0.703 . . . . 75.099999999999994 109.101 175.812 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.6 ptt? . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 119.971 -0.062 . . . . 63.140000000000001 111.019 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 45.7 t -60.87 127.05 29.67 Favored 'General case' 0 C--O 1.246 0.915 0 C-N-CA 123.469 0.708 . . . . 71.310000000000002 110.722 -175.865 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -74.05 73.07 1.31 Allowed Glycine 0 C--N 1.346 1.138 0 N-CA-C 110.53 -1.028 . . . . 62.43 110.53 171.254 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -111.22 172.89 6.61 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 124.545 1.138 . . . . 74.219999999999999 110.218 -174.921 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.7 ttpm? -98.05 113.32 25.15 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 107.884 -1.154 . . . . 73.120000000000005 107.884 170.052 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -100.42 127.74 53.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 N-CA-C 107.396 -1.335 . . . . 63.409999999999997 107.396 172.98 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -102.34 113.76 27.35 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 108.303 -0.999 . . . . 74.409999999999997 108.303 177.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 75.0 t -95.05 106.14 17.83 Favored 'Isoleucine or valine' 0 C--O 1.239 0.522 0 C-N-CA 125.147 1.379 . . . . 72.129999999999995 108.606 -174.274 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.506 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 65.5 mt-30 -99.84 98.84 9.59 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 108.373 -0.973 . . . . 52.030000000000001 108.373 -172.51 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.404 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 57.3 t -93.67 107.37 19.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 N-CA-C 108.919 -0.771 . . . . 70.109999999999999 108.919 -173.609 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.414 ' HG3' ' HB3' ' A' ' 20' ' ' GLU . 40.1 ttmt -106.19 101.65 11.11 Favored 'General case' 0 C--N 1.346 0.416 0 N-CA-C 107.817 -1.179 . . . . 64.510000000000005 107.817 178.902 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.489 ' HA ' ' O ' ' A' ' 57' ' ' ARG . 14.6 tt -119.09 122.08 68.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 122.965 0.506 . . . . 73.450000000000003 110.301 -174.062 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 30.0 m -90.33 123.16 33.86 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 109.178 -0.675 . . . . 75.310000000000002 109.178 178.062 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.639 ' SG ' HG23 ' A' ' 48' ' ' ILE . 16.2 t -156.66 126.27 6.23 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.142 0.977 . . . . 74.349999999999994 109.01 -173.856 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.492 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 6.3 t-20 66.33 25.22 10.45 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 125.218 1.407 . . . . 74.400000000000006 110.975 175.569 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.19 1.51 86.34 Favored Glycine 0 C--N 1.352 1.443 0 CA-C-N 115.585 -0.734 . . . . 72.219999999999999 113.843 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm -109.85 153.07 24.95 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.937 0.895 . . . . 75.129999999999995 110.023 -179.729 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 28.0 m -113.26 107.5 15.98 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.266 0.627 . . . . 71.120000000000005 109.415 -179.494 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -100.89 99.2 9.65 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 107.586 -1.265 . . . . 71.319999999999993 107.586 -175.135 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.414 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 8.4 pt-20 -115.4 122.61 46.34 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 109.578 -0.527 . . . . 73.099999999999994 109.578 -179.533 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.5 tpm_? -140.76 127.36 20.18 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.554 -0.748 . . . . 71.439999999999998 110.243 -169.699 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 27.3 m -86.67 111.35 20.59 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 123.661 0.784 . . . . 73.540000000000006 109.891 176.43 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -97.66 119.81 36.9 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.724 0.81 . . . . 74.219999999999999 109.374 177.29 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 26.8 mp0 -86.69 109.26 19.08 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 108.135 -1.061 . . . . 74.409999999999997 108.135 -179.674 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.466 HD11 HG21 ' A' ' 40' ' ' VAL . 86.1 mt -120.26 132.58 55.39 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.922 0.889 . . . . 51.210000000000001 109.286 -178.069 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 39.8 t80 -126.4 135.97 52.09 Favored 'General case' 0 C--O 1.24 0.577 0 N-CA-C 108.673 -0.862 . . . . 72.0 108.673 177.771 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.444 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -156.15 152.55 28.04 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.245 0.618 . . . . 64.120000000000005 109.439 173.157 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 95.8 t -67.99 -60.05 2.99 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 O-C-N 124.158 0.911 . . . . 65.299999999999997 109.294 174.031 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.577 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 97.4 mtt180 -96.57 162.87 13.27 Favored 'General case' 0 C--O 1.242 0.665 0 CA-C-O 121.837 0.827 . . . . 61.32 111.61 -178.267 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 18.2 p-10 -67.29 -37.16 82.95 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 113.598 -1.637 . . . . 65.140000000000001 111.055 174.057 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -67.68 -31.83 72.08 Favored 'General case' 0 C--N 1.353 0.747 0 C-N-CA 124.244 1.017 . . . . 71.25 111.58 -175.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.577 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 26.1 mm-40 -66.4 -35.63 80.8 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.861 -0.609 . . . . 64.349999999999994 109.926 177.961 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.407 HD23 ' HB3' ' A' ' 27' ' ' ALA . 0.1 OUTLIER -69.86 -25.85 63.92 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 123.893 0.877 . . . . 54.399999999999999 110.784 -176.243 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.508 ' HG2' HG23 ' A' ' 80' ' ' ILE . 53.2 mtmt -55.19 -62.13 1.87 Allowed 'General case' 0 C--N 1.365 1.28 0 C-N-CA 122.944 0.498 . . . . 75.540000000000006 111.556 -178.71 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.542 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 3.1 pp20? -61.29 -29.99 70.21 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 115.979 -0.555 . . . . 72.109999999999999 111.857 -176.972 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 56.4 mttm -67.08 -43.38 82.75 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.231 0.612 . . . . 71.25 110.423 177.687 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.493 HD13 HD23 ' A' ' 81' ' ' LEU . 88.8 mt -59.7 -40.55 88.27 Favored 'General case' 0 N--CA 1.474 0.746 0 O-C-N 123.989 0.806 . . . . 73.209999999999994 110.496 176.269 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -58.91 -46.51 87.73 Favored 'General case' 0 C--N 1.359 0.995 0 C-N-CA 123.025 0.53 . . . . 74.25 110.971 175.65 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.542 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 14.2 mmmm -60.58 -52.0 67.02 Favored 'General case' 0 N--CA 1.48 1.046 0 O-C-N 123.586 0.554 . . . . 75.439999999999998 110.04 179.183 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.466 HG21 HD11 ' A' ' 25' ' ' LEU . 46.5 t -55.16 -42.87 67.84 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 125.127 1.371 . . . . 70.239999999999995 111.996 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 67.0 mt -71.95 -36.64 69.93 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 122.869 0.468 . . . . 70.219999999999999 110.611 -179.402 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.3 m-80 -65.52 -30.95 71.77 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 122.78 0.432 . . . . 74.120000000000005 111.643 173.182 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 13.6 mm-40 -75.18 -54.54 6.94 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 122.501 0.32 . . . . 64.25 110.624 179.158 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.7 tpp180 -66.58 -36.38 82.5 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.29 0.636 . . . . 63.130000000000003 111.113 -175.823 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.505 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 69.9 mtp -86.41 -10.8 53.54 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 118.728 -0.653 . . . . 71.519999999999996 112.613 -178.159 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.54 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 22.4 t70 -58.79 -53.22 68.57 Favored Pre-proline 0 CA--C 1.564 1.49 0 CA-C-O 118.41 -0.805 . . . . 73.530000000000001 111.479 178.705 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -61.59 -29.67 84.65 Favored 'Trans proline' 0 C--N 1.395 2.988 0 C-N-CA 121.877 1.718 . . . . 75.209999999999994 111.912 174.253 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.639 HG23 ' SG ' ' A' ' 14' ' ' CYS . 49.4 mm -70.25 -34.0 56.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 123.893 0.877 . . . . 71.109999999999999 110.804 -173.158 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.582 ' HG2' HD21 ' A' ' 108' ' ' LEU . 45.6 mtmt -71.01 -38.97 72.64 Favored 'General case' 0 C--N 1.353 0.722 0 N-CA-C 109.667 -0.494 . . . . 75.019999999999996 109.667 178.195 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.1 tmmt? -73.85 -26.05 60.38 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 116.046 -0.524 . . . . 73.519999999999996 110.34 177.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.6 mt -70.9 -27.79 64.06 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 108.726 -0.842 . . . . 63.030000000000001 108.726 170.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 69.43 37.73 79.45 Favored Glycine 0 C--N 1.353 1.473 0 O-C-N 124.275 0.985 . . . . 70.319999999999993 112.933 172.767 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.492 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 71.4 m -70.74 111.25 6.06 Favored 'General case' 0 C--O 1.241 0.635 0 O-C-N 124.282 0.637 . . . . 51.210000000000001 109.917 177.881 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -58.01 -55.01 40.41 Favored 'General case' 0 C--O 1.215 -0.746 0 O-C-N 124.804 1.315 . . . . 75.540000000000006 110.465 -173.231 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 73.9 ttt180 -108.62 136.06 48.83 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 108.641 -0.874 . . . . 64.140000000000001 108.641 172.207 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 30.1 m -124.75 139.76 49.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 123.546 0.739 . . . . 73.109999999999999 109.623 175.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.489 ' O ' ' HA ' ' A' ' 12' ' ' ILE . 48.8 ttt180 -109.05 106.92 17.05 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 108.569 -0.9 . . . . 71.239999999999995 108.569 171.654 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 41.9 mt -102.31 106.16 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 N-CA-C 108.383 -0.969 . . . . 72.329999999999998 108.383 -179.67 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 17.5 m -109.22 102.5 11.44 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 107.963 -1.125 . . . . 63.229999999999997 107.963 -177.578 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 71.2 mt -99.67 113.83 36.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 123.496 0.718 . . . . 74.420000000000002 109.884 -174.261 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.506 ' HB2' ' HB2' ' A' ' 9' ' ' GLN . 58.5 mtm180 -98.96 122.72 42.59 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 107.705 -1.22 . . . . 73.430000000000007 107.705 -179.042 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.2 p -93.59 129.01 44.6 Favored 'Isoleucine or valine' 0 C--O 1.242 0.673 0 N-CA-C 108.932 -0.766 . . . . 61.450000000000003 108.932 -177.377 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.3 tmtt? -97.1 121.97 39.58 Favored 'General case' 0 C--O 1.239 0.532 0 N-CA-C 107.524 -1.287 . . . . 54.299999999999997 107.524 176.866 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 5.9 p80 -113.12 131.51 55.81 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.765 1.226 . . . . 74.409999999999997 109.369 -179.578 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 16.9 m -89.32 -59.22 2.27 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.611 0.765 . . . . 54.100000000000001 111.227 -173.365 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -87.53 131.81 34.25 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 116.276 -0.42 . . . . 74.409999999999997 110.244 -175.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -75.3 -24.27 57.45 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 123.653 0.781 . . . . 34.32 112.815 -173.223 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -81.33 -40.19 23.96 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 122.918 0.487 . . . . 61.0 110.417 178.356 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 -68.81 -49.19 60.55 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.017 0.527 . . . . 72.519999999999996 111.983 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -49.84 -30.02 9.09 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 124.911 1.382 . . . . 72.0 114.692 -166.07 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.9 ttpm? -64.96 -48.26 74.67 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.018 0.927 . . . . 44.420000000000002 110.725 -176.322 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 4.6 ttmp? -79.39 -40.98 28.78 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.123 0.569 . . . . 64.120000000000005 110.26 173.619 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -63.15 -37.97 89.32 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.321 1.049 . . . . 65.120000000000005 111.524 -166.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.71 -36.78 62.72 Favored 'General case' 0 C--N 1.356 0.871 0 C-N-CA 123.494 0.718 . . . . 55.25 111.623 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -66.41 -36.83 83.81 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 122.997 0.519 . . . . 63.340000000000003 111.179 174.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.454 ' O ' HG12 ' A' ' 80' ' ' ILE . 79.3 tttt -76.19 -31.71 58.61 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.719 -0.673 . . . . 63.25 109.456 177.897 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -75.96 -21.97 56.43 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.811 0.845 . . . . 71.049999999999997 109.605 176.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.37 -40.3 93.37 Favored 'General case' 0 C--N 1.35 0.615 0 C-N-CA 123.574 0.75 . . . . 71.349999999999994 109.757 172.137 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.94 -43.25 93.32 Favored 'General case' 0 C--N 1.351 0.632 0 O-C-N 123.969 0.793 . . . . 52.200000000000003 110.38 174.138 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.508 HG23 ' HG2' ' A' ' 34' ' ' LYS . 29.3 mm -62.4 -46.27 96.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 124.306 1.042 . . . . 73.120000000000005 111.267 -179.396 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.506 HD13 HG11 ' A' ' 102' ' ' VAL . 39.2 mt -63.05 -46.9 85.31 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.839 0.856 . . . . 55.229999999999997 110.013 178.606 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -62.47 -36.94 84.05 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 123.999 0.812 . . . . 73.319999999999993 109.819 -175.022 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.426 ' O ' ' HG2' ' A' ' 87' ' ' GLU . 30.2 mmmt -65.54 -41.63 92.83 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 122.902 0.481 . . . . 73.209999999999994 111.115 175.916 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.458 HG21 ' HB2' ' A' ' 37' ' ' LEU . 53.6 t -65.69 -43.16 93.78 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 123.428 0.691 . . . . 71.030000000000001 110.919 -178.453 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.461 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 26.4 m-85 -60.31 -41.62 93.83 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 115.308 -0.86 . . . . 72.310000000000002 109.808 175.617 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.75 -31.75 73.11 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.588 0.755 . . . . 40.530000000000001 111.711 177.275 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 83' ' ' LYS . 23.5 mm-40 -76.2 -19.6 58.26 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.65 0.78 . . . . 73.049999999999997 111.336 178.819 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 78.5 mt -109.32 14.32 23.78 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.551 0.74 . . . . 64.299999999999997 110.999 -177.838 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 81.17 28.5 44.71 Favored Glycine 0 C--N 1.35 1.356 0 N-CA-C 114.488 0.555 . . . . 63.030000000000001 114.488 171.831 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.639 ' HB3' HD21 ' A' ' 94' ' ' ASN . 13.7 m-85 -111.04 146.7 36.26 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 107.856 -1.164 . . . . 64.450000000000003 107.856 171.744 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.413 ' O ' HG23 ' A' ' 95' ' ' VAL . 89.6 m-20 -101.18 172.11 7.21 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.064 0.546 . . . . 62.119999999999997 111.402 -178.115 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -65.64 -36.93 85.1 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.372 1.069 . . . . 70.530000000000001 111.594 -173.879 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 18.3 m -62.51 -36.01 81.2 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 124.029 0.931 . . . . 61.520000000000003 112.776 -175.527 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ASN . . . . . 0.639 HD21 ' HB3' ' A' ' 90' ' ' TYR . 2.1 p-10 -86.08 -0.53 55.84 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 111.936 0.347 . . . . 64.109999999999999 111.936 178.124 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.553 ' HA ' HG22 ' A' ' 104' ' ' VAL . 57.9 t -101.07 106.59 19.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 N-CA-C 107.908 -1.145 . . . . 72.299999999999997 107.908 174.789 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 26.2 m -136.74 133.41 36.01 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.195 0.598 . . . . 74.230000000000004 109.622 -175.18 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 40.5 m95 -87.77 152.91 21.76 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-O 121.703 0.763 . . . . 74.219999999999999 111.826 -179.658 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -149.89 79.2 1.37 Allowed 'General case' 0 C--O 1.242 0.688 0 C-N-CA 126.254 1.821 . . . . 74.109999999999999 106.57 -175.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 72.99 -117.38 5.96 Favored Glycine 0 CA--C 1.531 1.091 0 CA-C-N 115.149 -0.932 . . . . 73.230000000000004 112.173 -173.728 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -97.43 11.16 37.68 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.764 0.825 . . . . 73.019999999999996 110.912 175.829 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 61.6 m -119.58 125.87 49.83 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.663 0.785 . . . . 50.240000000000002 109.976 -178.669 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.506 HG11 HD13 ' A' ' 81' ' ' LEU . 8.9 p -96.02 116.78 38.72 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.763 0 N-CA-C 107.866 -1.161 . . . . 65.109999999999999 107.866 170.879 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 4.3 m -99.64 108.14 20.44 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 108.337 -0.986 . . . . 62.539999999999999 108.337 -177.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.583 HG13 HD22 ' A' ' 94' ' ' ASN . 83.6 t -115.12 112.28 39.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 C-N-CA 124.819 1.248 . . . . 50.25 108.549 -177.609 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.426 ' HG2' ' HA ' ' A' ' 57' ' ' ARG . 28.1 mt-10 -111.22 152.23 27.35 Favored 'General case' 0 C--O 1.241 0.631 0 N-CA-C 109.484 -0.562 . . . . 70.040000000000006 109.484 177.561 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -170.39 145.87 9.41 Favored Glycine 0 N--CA 1.449 -0.436 0 CA-C-N 115.748 -0.66 . . . . 74.510000000000005 112.189 177.799 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 57.8 tt0 -71.54 108.58 5.0 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 109.025 -0.731 . . . . 75.439999999999998 109.025 168.238 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.582 HD21 ' HG2' ' A' ' 49' ' ' LYS . 49.5 tp -83.03 96.35 8.32 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 107.424 -1.325 . . . . 72.239999999999995 107.424 168.626 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 38.79 -78.9 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 126.479 1.911 . . . . 71.420000000000002 114.133 177.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 126.5 34.29 0.62 Allowed Glycine 0 C--N 1.344 1.022 0 N-CA-C 110.105 -1.198 . . . . 73.140000000000001 110.105 -172.211 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 2.8 m -62.57 92.63 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 CA-C-O 122.197 0.998 . . . . 74.450000000000003 111.902 -177.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -134.89 98.42 4.02 Favored 'General case' 0 C--O 1.239 0.539 0 CA-C-N 114.332 -1.304 . . . . 71.349999999999994 107.872 176.506 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 80.0 mt -86.27 101.08 12.74 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.15 0.98 . . . . 75.329999999999998 109.723 -175.008 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -73.49 -51.98 15.23 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 124.001 0.921 . . . . 72.010000000000005 112.327 -170.88 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 22.2 t-80 -116.65 -32.13 5.28 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.344 0.658 . . . . 71.340000000000003 109.886 178.518 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 34.0 m80 -82.03 57.32 3.46 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 123.535 0.734 . . . . 63.219999999999999 110.018 174.606 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 38.7 p-80 -53.9 152.39 5.67 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 124.654 1.181 . . . . 55.399999999999999 112.944 -171.046 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 80.4 t60 -68.19 104.24 1.76 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 123.387 0.675 . . . . 74.430000000000007 110.439 -178.578 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 31.8 m80 -69.67 173.84 5.71 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.943 0.897 . . . . 74.129999999999995 110.572 172.165 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 81.3 t60 . . . . . 0 C--O 1.254 1.295 0 C-N-CA 122.919 0.487 . . . . 72.319999999999993 110.548 179.605 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.5 tppt? . . . . . 0 CA--C 1.537 0.468 0 CA-C-O 120.591 0.234 . . . . 72.24 110.973 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -84.83 93.5 8.51 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 106.792 -1.559 . . . . 74.13 106.792 169.383 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.445 HG21 HG22 ' A' ' 62' ' ' VAL . 5.9 p -106.36 152.82 7.87 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 C-N-CA 123.982 0.913 . . . . 74.0 110.395 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.429 ' OE2' ' HG3' ' A' ' 24' ' ' GLN . 11.1 mp0 -100.32 114.32 27.73 Favored 'General case' 0 C--N 1.351 0.631 0 N-CA-C 107.935 -1.135 . . . . 72.13 107.935 173.546 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.438 HG22 HG23 ' A' ' 62' ' ' VAL . 78.1 t -112.63 113.62 44.66 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 C-N-CA 124.617 1.167 . . . . 70.23 108.314 -177.424 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -101.0 108.45 20.17 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 108.906 -0.776 . . . . 73.41 108.906 -175.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 91.8 t -93.53 108.25 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 N-CA-C 108.062 -1.088 . . . . 70.3 108.062 179.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -112.72 103.47 11.5 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.269 1.028 . . . . 74.02 108.422 -174.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 11.7 tt -120.61 125.92 74.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 CA-C-O 121.337 0.589 . . . . 51.1 111.156 -171.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 19.9 m -98.34 121.38 40.2 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.974 0.909 . . . . 62.44 109.193 -177.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 5.4 t -148.06 131.78 16.94 Favored 'General case' 0 C--O 1.242 0.696 0 N-CA-C 109.579 -0.526 . . . . 72.34 109.579 179.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.648 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 2.8 t-20 78.49 -65.31 0.24 Allowed 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 125.93 1.692 . . . . 73.44 110.56 172.548 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -170.44 6.82 0.04 OUTLIER Glycine 0 N--CA 1.465 0.586 0 CA-C-N 116.474 -0.33 . . . . 35.15 112.624 172.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -119.72 154.55 33.96 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.126 0.971 . . . . 74.1 109.782 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 7.3 m -115.58 122.16 44.81 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 108.073 -1.084 . . . . 75.43 108.073 175.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -106.77 99.9 9.44 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 108.283 -1.006 . . . . 72.3 108.283 -174.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -114.77 146.1 41.36 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 121.063 0.459 . . . . 73.31 110.014 175.627 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -155.55 132.41 10.61 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 107.812 -1.181 . . . . 71.4 107.812 -176.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 51.7 m -87.47 111.25 20.96 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 109.536 -0.542 . . . . 74.35 109.536 177.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -98.71 140.66 32.58 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.48 0.712 . . . . 72.31 109.621 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.429 ' HG3' ' OE2' ' A' ' 7' ' ' GLU . 21.5 mp0 -97.21 105.91 18.14 Favored 'General case' 0 C--O 1.24 0.578 0 N-CA-C 107.151 -1.426 . . . . 73.12 107.151 174.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 45.7 mt -107.09 115.28 29.91 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 109.051 -0.722 . . . . 70.12 109.051 -179.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -107.12 123.63 48.52 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 109.21 -0.663 . . . . 75.21 109.21 177.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -145.9 122.05 10.81 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 122.738 0.415 . . . . 73.34 110.02 175.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 60.3 t -73.29 -30.86 31.96 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 C-N-CA 123.815 0.846 . . . . 54.45 109.774 171.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.422 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 58.4 mtt-85 -112.78 150.37 31.72 Favored 'General case' 0 CA--C 1.552 1.033 0 CA-C-N 114.96 -1.018 . . . . 72.2 110.043 -174.589 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -67.23 -44.85 78.44 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 123.939 0.896 . . . . 72.5 110.937 -178.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.403 ' HA ' ' HD3' ' A' ' 34' ' ' LYS . 56.2 mm-40 -61.77 -30.9 71.1 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.801 0.84 . . . . 74.52 111.633 179.247 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.422 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 35.0 mm-40 -61.7 -46.14 90.97 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 122.705 0.402 . . . . 61.14 111.293 177.142 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.7 -33.88 75.77 Favored 'General case' 0 CA--C 1.553 1.063 0 N-CA-C 109.871 -0.418 . . . . 62.04 109.871 -177.842 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.403 ' HD3' ' HA ' ' A' ' 31' ' ' GLU . 54.7 mtpt -54.31 -58.2 8.3 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.131 0.572 . . . . 74.22 111.395 176.159 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.8 pp20? -66.91 -26.89 67.08 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 115.92 -0.582 . . . . 71.43 112.354 -177.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 40.2 mttp -71.59 -35.17 70.43 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.129 0.571 . . . . 54.12 111.048 176.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.604 HD13 HD23 ' A' ' 81' ' ' LEU . 81.5 mt -64.23 -45.31 88.77 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 123.334 0.397 . . . . 73.24 110.058 171.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.434 ' HG2' HG13 ' A' ' 84' ' ' VAL . 50.1 mtpt -58.88 -38.11 78.1 Favored 'General case' 0 C--N 1.357 0.917 0 C-N-CA 122.782 0.433 . . . . 74.13 111.086 174.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 43.3 mmtm -60.32 -62.83 1.58 Allowed 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 122.865 0.466 . . . . 62.41 110.515 175.542 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 93.9 t -59.7 -45.94 93.92 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 123.583 0.753 . . . . 62.34 111.695 -172.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.619 HD21 HD11 ' A' ' 60' ' ' ILE . 68.9 mt -64.95 -58.33 6.4 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.382 0.673 . . . . 74.45 111.271 -179.252 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -60.32 -38.4 83.59 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 123.357 0.663 . . . . 71.33 112.054 -176.366 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -67.67 -48.24 67.2 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 122.577 0.351 . . . . 74.44 111.027 178.207 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -73.55 -32.96 64.47 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 116.342 -0.39 . . . . 72.32 111.287 -172.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.406 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 43.3 mtp -83.62 -11.53 57.18 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 122.972 0.509 . . . . 74.41 112.059 -177.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -61.02 -53.34 64.76 Favored Pre-proline 0 CA--C 1.564 1.484 0 CA-C-O 118.577 -0.725 . . . . 71.51 111.684 178.116 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.526 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 56.8 Cg_endo -68.47 -25.23 35.53 Favored 'Trans proline' 0 C--N 1.387 2.581 0 CA-C-N 121.169 1.453 . . . . 72.42 112.435 173.258 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 32.1 mm -63.52 -43.66 98.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 123.434 0.694 . . . . 54.02 111.398 -178.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.406 ' HG3' ' O ' ' A' ' 45' ' ' MET . 48.4 mtmt -67.12 -32.51 73.69 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 121.035 0.445 . . . . 61.31 110.098 178.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -71.57 -29.04 64.27 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.616 1.166 . . . . 71.41 111.101 176.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.526 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 86.9 mt -70.5 -33.86 71.69 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 109.312 -0.625 . . . . 71.43 109.312 175.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 89.58 119.99 1.91 Allowed Glycine 0 C--N 1.344 0.987 0 CA-C-N 115.448 -0.796 . . . . 64.43 113.315 168.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.648 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 72.3 m -153.24 156.11 37.88 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.322 1.049 . . . . 73.12 108.755 -179.33 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.49 ' HD2' ' H ' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -74.8 -37.2 62.42 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 109.152 -0.685 . . . . 73.14 109.152 171.377 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 29.0 ttm180 -157.81 148.47 20.9 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 123.951 0.901 . . . . 73.33 109.102 -175.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 15.7 m -114.68 140.47 35.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 123.527 0.731 . . . . 64.12 109.97 177.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 45.5 ttm105 -104.96 103.36 12.91 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 108.25 -1.018 . . . . 61.53 108.25 173.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 40.5 mt -94.76 146.11 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 N-CA-C 107.886 -1.153 . . . . 74.34 107.886 178.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 28.8 m -144.15 103.37 3.99 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 106.836 -1.542 . . . . 63.4 106.836 177.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.619 HD11 HD21 ' A' ' 41' ' ' LEU . 72.7 mt -101.92 107.44 21.64 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 N-CA-C 108.827 -0.805 . . . . 70.44 108.827 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 38.1 ttp85 -97.53 121.16 39.11 Favored 'General case' 0 C--O 1.238 0.468 0 N-CA-C 108.036 -1.098 . . . . 74.02 108.036 176.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.445 HG22 HG21 ' A' ' 6' ' ' VAL . 4.1 p -94.85 140.29 17.04 Favored 'Isoleucine or valine' 0 C--O 1.243 0.744 0 N-CA-C 107.49 -1.3 . . . . 74.31 107.49 178.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 19.6 ttpp -81.52 136.39 35.61 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 109.262 -0.644 . . . . 73.34 109.262 178.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . 0.579 ' HE1' ' HB2' ' A' ' 100' ' ' ASP . 37.6 m80 -85.89 117.3 24.66 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 108.663 -0.865 . . . . 71.25 108.663 178.444 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 30.7 p -65.79 -62.13 1.68 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.742 0.817 . . . . 62.31 111.79 -173.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -148.29 140.39 24.07 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 107.969 -1.123 . . . . 73.32 107.969 -177.199 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -53.67 -34.53 58.99 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.939 0.895 . . . . 72.13 113.379 -172.046 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.6 -42.16 74.79 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 122.783 0.433 . . . . 62.52 111.272 178.292 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -74.97 -47.63 28.41 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.372 0.669 . . . . 45.3 111.494 -176.591 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.3 pp20? -68.16 -20.61 64.9 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 114.458 1.281 . . . . 63.01 114.458 -159.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 64.6 mttm -65.48 -42.46 92.2 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-O 121.407 0.623 . . . . 74.22 109.848 173.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -79.71 -40.79 28.15 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 114.858 -1.064 . . . . 63.42 110.566 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -74.03 -33.4 63.74 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 112.429 0.529 . . . . 75.05 112.429 -172.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.91 -35.93 64.67 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 117.795 0.271 . . . . 64.22 110.694 177.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 65.1 tttp -65.65 -39.85 91.86 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.101 0.56 . . . . 75.22 110.243 175.005 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 5.6 tmmm? -67.15 -40.06 86.61 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.974 0.909 . . . . 63.51 109.825 175.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -72.76 -23.72 60.86 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.788 0.835 . . . . 73.33 110.702 -175.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.56 -46.15 89.69 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 123.576 0.547 . . . . 71.53 109.913 173.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.439 ' O ' ' HG2' ' A' ' 83' ' ' LYS . . . -65.98 -40.73 91.48 Favored 'General case' 0 CA--C 1.545 0.75 0 CA-C-N 115.531 -0.759 . . . . 43.12 111.223 177.389 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 37.5 mm -56.09 -47.43 80.47 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 C-N-CA 124.287 1.035 . . . . 74.03 110.773 176.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.604 HD23 HD13 ' A' ' 37' ' ' LEU . 45.8 mt -67.09 -40.02 86.89 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.865 0.866 . . . . 72.24 111.762 -179.685 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 -60.13 -33.15 71.74 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.259 0.624 . . . . 64.4 111.433 -178.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.439 ' HG2' ' O ' ' A' ' 79' ' ' ALA . 32.9 mmtp -67.2 -49.54 64.18 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 123.697 0.623 . . . . 74.33 110.706 173.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.434 HG13 ' HG2' ' A' ' 38' ' ' LYS . 71.1 t -65.13 -49.26 80.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 123.988 0.915 . . . . 61.31 111.456 -171.273 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.496 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 26.4 m-85 -63.24 -33.71 76.08 Favored 'General case' 0 N--CA 1.477 0.902 0 O-C-N 123.582 0.552 . . . . 65.34 111.326 179.062 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -68.06 -30.06 69.18 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.104 0.562 . . . . 73.2 111.389 175.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -85.47 -13.51 48.94 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.905 0.882 . . . . 75.41 111.89 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 94.3 mt -107.49 -16.04 14.46 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 122.984 0.513 . . . . 64.3 111.385 -175.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 97.57 49.23 1.85 Allowed Glycine 0 C--N 1.345 1.079 0 CA-C-O 120.857 0.143 . . . . 63.3 113.373 176.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.496 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 40.6 m-85 -126.31 134.66 51.06 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 107.889 -1.152 . . . . 75.24 107.889 174.441 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -78.1 159.27 28.77 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.297 0.639 . . . . 73.54 111.528 -174.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -62.38 -46.06 90.32 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.859 0.864 . . . . 72.15 112.173 -175.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 63.9 p -58.53 -34.82 71.42 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 124.05 0.94 . . . . 74.23 112.16 177.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . 0.409 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 2.5 m-20 -65.19 -25.66 67.81 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 115.412 -0.813 . . . . 53.44 110.932 -179.098 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 45.4 t -91.74 114.71 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.87 0 C-N-CA 124.333 1.053 . . . . 63.24 108.897 178.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 32.9 m -144.41 129.62 18.71 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 122.879 0.472 . . . . 74.51 110.389 178.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 66.3 m95 -86.05 137.97 32.3 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.403 0.681 . . . . 72.52 110.509 177.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -169.17 123.52 0.83 Allowed 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.481 1.112 . . . . 72.0 109.245 179.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 69.76 51.97 22.34 Favored Glycine 0 C--N 1.349 1.26 0 O-C-N 123.883 0.739 . . . . 55.54 113.193 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . 0.579 ' HB2' ' HE1' ' A' ' 64' ' ' HIS . 4.4 p-10 46.67 26.09 0.5 Allowed 'General case' 0 N--CA 1.499 2.018 0 C-N-CA 126.444 1.898 . . . . 71.51 113.537 -176.359 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 50.0 m -135.54 148.01 48.99 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 125.313 1.445 . . . . 72.23 107.931 -177.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . 0.601 HG11 HD13 ' A' ' 81' ' ' LEU . 13.4 p -103.35 121.58 54.83 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 N-CA-C 108.709 -0.849 . . . . 64.41 108.709 171.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 24.7 m -97.79 111.31 23.65 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 107.532 -1.284 . . . . 33.05 107.532 178.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.409 ' HA ' ' O ' ' A' ' 94' ' ' ASN . 55.1 t -119.35 125.0 74.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 N-CA-C 108.533 -0.914 . . . . 72.31 108.533 -178.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -107.95 153.83 22.49 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 109.578 -0.527 . . . . 73.14 109.578 174.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -148.51 136.98 6.15 Favored Glycine 0 C--O 1.238 0.368 0 N-CA-C 110.643 -0.983 . . . . 73.54 110.643 173.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 58.9 tp60 . . . . . 0 CA--C 1.543 0.697 0 N-CA-C 108.081 -1.081 . . . . 72.31 108.081 179.046 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.608 0 N-CA-C 110.225 -0.287 . . . . 71.32 110.225 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 33.6 ttpt -100.57 117.02 33.86 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.51 0.724 . . . . 72.41 110.593 -178.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.419 HG21 HG13 ' A' ' 62' ' ' VAL . 3.7 p -101.06 138.83 23.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 107.673 -1.232 . . . . 72.31 107.673 164.634 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -104.32 111.66 24.38 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 108.07 -1.085 . . . . 72.05 108.07 174.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.624 HG13 HG23 ' A' ' 60' ' ' ILE . 56.7 t -98.98 107.36 20.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 CA-C-N 113.593 -1.639 . . . . 73.41 108.841 -174.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.418 ' HB2' ' HB3' ' A' ' 61' ' ' ARG . 42.1 mt-30 -97.16 101.57 13.16 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 108.16 -1.052 . . . . 75.04 108.16 -176.537 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 67.0 t -93.23 111.95 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 108.848 -0.797 . . . . 72.21 108.848 -176.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -119.46 103.5 9.51 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.416 1.086 . . . . 61.51 108.259 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.48 HD13 HG13 ' A' ' 48' ' ' ILE . 12.3 tt -118.53 122.02 68.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 CA-C-O 121.036 0.446 . . . . 62.31 111.436 -173.648 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 31.9 m -97.39 112.08 24.06 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 108.361 -0.978 . . . . 75.12 108.361 178.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.666 ' SG ' HG23 ' A' ' 48' ' ' ILE . 14.6 t -122.24 115.92 23.22 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.464 1.106 . . . . 54.2 108.253 179.694 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 40.4 t-20 71.57 -73.1 0.1 Allowed 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 125.222 1.409 . . . . 60.14 110.29 178.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -161.48 10.18 0.12 Allowed Glycine 0 N--CA 1.469 0.894 0 N-CA-C 111.465 -0.654 . . . . 62.43 111.465 175.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.424 ' HA ' ' HE3' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -110.98 123.89 51.06 Favored 'General case' 0 C--N 1.349 0.559 0 C-N-CA 124.197 0.999 . . . . 75.01 109.264 177.207 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 91.5 m -106.81 123.89 48.81 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.688 0.795 . . . . 73.3 109.62 -179.398 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -109.64 101.84 10.72 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.487 1.115 . . . . 71.44 108.316 -176.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -114.58 142.42 46.46 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.05 0.54 . . . . 74.45 110.043 -177.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 52.6 ttm-85 -168.05 140.74 3.1 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 122.863 0.465 . . . . 65.14 111.393 175.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 24.7 m -86.68 109.24 19.06 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.661 1.185 . . . . 43.31 109.549 174.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -97.36 135.44 39.25 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.618 0.767 . . . . 75.44 109.41 177.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -94.48 109.46 21.34 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 107.85 -1.167 . . . . 51.42 107.85 177.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.417 HD22 ' HB3' ' A' ' 36' ' ' LYS . 58.0 mt -113.7 116.48 29.5 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.561 0.744 . . . . 70.31 109.344 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -114.79 120.53 40.33 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.438 1.095 . . . . 73.41 108.969 -176.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.498 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -150.98 150.88 31.31 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 122.946 0.499 . . . . 74.41 110.425 176.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.2 t -78.81 -42.94 25.08 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.773 0 CA-C-N 114.957 -1.019 . . . . 70.03 109.459 174.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.52 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 59.5 mtt-85 -116.83 164.33 14.83 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.846 0.858 . . . . 61.25 111.451 -169.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -62.39 -48.65 78.78 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 124.467 1.107 . . . . 61.54 111.662 178.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.425 ' HA ' ' HD3' ' A' ' 34' ' ' LYS . 49.4 mm-40 -64.29 -28.75 69.93 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 115.586 -0.733 . . . . 72.01 111.453 -176.543 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.52 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 29.1 mm-40 -74.52 -26.2 59.83 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.026 0.53 . . . . 52.41 111.123 177.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.434 HD23 ' HB3' ' A' ' 27' ' ' ALA . 0.2 OUTLIER -81.69 -37.87 26.72 Favored 'General case' 0 CA--C 1.555 1.147 0 N-CA-C 109.788 -0.449 . . . . 71.11 109.788 178.885 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.462 ' HG2' HG23 ' A' ' 80' ' ' ILE . 56.8 mtpt -56.12 -52.13 65.45 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 124.094 0.958 . . . . 73.24 112.452 -176.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -54.67 -37.87 66.27 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.667 0.787 . . . . 73.4 111.868 177.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.417 ' HB3' HD22 ' A' ' 25' ' ' LEU . 54.2 mttm -70.63 -38.0 73.85 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.232 0.613 . . . . 73.51 110.811 -178.667 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 57.6 mt -62.35 -40.86 97.79 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.571 0.748 . . . . 75.31 110.984 175.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.501 ' HG2' HG13 ' A' ' 84' ' ' VAL . 57.2 mtpt -63.71 -41.11 98.13 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.544 0.738 . . . . 55.44 111.326 175.236 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.6 mmmp? -61.61 -53.09 60.85 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.332 0.653 . . . . 73.51 110.638 176.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 46.4 t -60.05 -38.95 78.88 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 124.826 1.25 . . . . 73.43 111.988 -179.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.448 HD21 HD11 ' A' ' 60' ' ' ILE . 23.3 mt -71.28 -50.11 35.97 Favored 'General case' 0 C--O 1.212 -0.877 0 CA-C-O 118.948 -0.549 . . . . 72.02 110.943 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 56.5 m-80 -66.4 -21.8 66.23 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-N 118.513 0.597 . . . . 72.13 111.594 177.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -74.87 -55.65 5.58 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.048 0.539 . . . . 72.24 110.252 176.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.419 ' HA ' ' CZ ' ' A' ' 44' ' ' ARG . 0.3 OUTLIER -72.94 -26.28 61.33 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.437 0.695 . . . . 74.35 111.312 -176.666 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 57.0 mtp -96.43 2.58 52.72 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.191 0.596 . . . . 63.4 112.326 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -59.37 -55.8 42.44 Favored Pre-proline 0 CA--C 1.566 1.579 0 CA-C-O 118.697 -0.668 . . . . 73.43 110.973 170.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.408 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 56.3 Cg_endo -66.79 -20.93 51.75 Favored 'Trans proline' 0 C--N 1.39 2.718 0 C-N-CA 121.788 1.659 . . . . 75.43 112.429 176.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.666 HG23 ' SG ' ' A' ' 14' ' ' CYS . 48.2 mm -74.46 -40.19 48.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 124.434 1.094 . . . . 73.24 111.513 -174.446 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -68.44 -32.53 72.61 Favored 'General case' 0 N--CA 1.48 1.028 0 N-CA-C 109.424 -0.584 . . . . 74.4 109.424 176.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -69.45 -28.09 65.82 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 124.357 1.063 . . . . 73.14 110.959 175.343 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 83.9 mt -72.31 -39.37 68.3 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 109.004 -0.739 . . . . 74.33 109.004 172.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 62.42 62.27 5.76 Favored Glycine 0 C--N 1.352 1.433 0 CA-C-N 115.269 -0.878 . . . . 71.01 111.833 179.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 63.6 m -84.96 152.44 23.49 Favored 'General case' 0 C--O 1.242 0.686 0 C-N-CA 123.069 0.547 . . . . 64.14 112.145 -174.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -67.53 -39.5 85.04 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 115.073 -0.967 . . . . 63.44 110.018 178.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 11.4 ttm180 -142.53 140.77 31.91 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.387 1.075 . . . . 74.54 109.582 176.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 27.0 m -123.76 136.89 58.73 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 C-N-CA 124.471 1.109 . . . . 64.05 109.0 171.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.468 ' O ' ' HA ' ' A' ' 12' ' ' ILE . 47.1 mtt180 -112.09 106.63 15.31 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 108.749 -0.834 . . . . 60.32 108.749 172.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.473 HG12 HD12 ' A' ' 12' ' ' ILE . 17.8 mt -94.86 106.96 18.8 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 N-CA-C 108.014 -1.106 . . . . 65.3 108.014 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.9 m -99.64 102.45 13.94 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 107.045 -1.465 . . . . 75.32 107.045 179.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.624 HG23 HG13 ' A' ' 8' ' ' VAL . 72.2 mt -96.59 107.99 20.65 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 N-CA-C 108.314 -0.995 . . . . 73.34 108.314 179.22 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.418 ' HB3' ' HB2' ' A' ' 9' ' ' GLN . 0.2 OUTLIER -93.17 106.71 18.64 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 107.204 -1.406 . . . . 73.54 107.204 -178.713 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.419 HG13 HG21 ' A' ' 6' ' ' VAL . 22.6 t -92.57 114.27 29.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 N-CA-C 107.966 -1.124 . . . . 74.52 107.966 177.557 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -84.92 105.7 15.88 Favored 'General case' 0 C--O 1.239 0.507 0 N-CA-C 108.118 -1.068 . . . . 72.3 108.118 177.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 25.6 p80 -64.64 139.36 58.76 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 109.336 -0.616 . . . . 75.22 109.336 177.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 30.4 t -80.46 -36.79 33.01 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.208 0.603 . . . . 74.01 111.389 -174.078 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.525 ' HB2' ' HB2' ' A' ' 69' ' ' GLU . 7.2 m-20 -125.07 137.94 54.2 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.606 0.763 . . . . 74.24 110.232 -174.555 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -79.68 -15.52 57.41 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.715 0.806 . . . . 41.33 112.502 -174.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -86.22 -44.54 12.08 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.168 0.587 . . . . 63.44 109.538 171.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.525 ' HB2' ' HB2' ' A' ' 66' ' ' ASP . 11.2 mm-40 -76.81 -14.3 59.93 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 114.711 -1.131 . . . . 72.44 112.821 -175.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.601 ' HG3' ' HD2' ' A' ' 71' ' ' LYS . 9.4 pt-20 -50.55 -31.42 15.61 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 114.554 1.316 . . . . 62.05 114.554 -176.44 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.601 ' HD2' ' HG3' ' A' ' 70' ' ' GLU . 3.7 mptp? -67.15 -42.09 84.93 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 109.418 -0.586 . . . . 64.41 109.418 176.187 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -71.3 -36.35 71.61 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.421 1.088 . . . . 74.14 110.664 177.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -77.7 -42.81 33.18 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.88 0.872 . . . . 72.22 112.159 -172.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.82 -41.81 67.76 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-O 120.806 0.336 . . . . 70.25 110.272 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -63.59 -33.46 75.66 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.134 0.974 . . . . 75.31 111.465 172.151 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 20.8 ttmm -60.97 -53.25 59.53 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.675 0.79 . . . . 73.42 109.703 173.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.562 ' HA ' ' HB ' ' A' ' 80' ' ' ILE . 19.1 m-85 -69.67 -20.11 63.58 Favored 'General case' 0 C--O 1.221 -0.443 0 C-N-CA 123.57 0.748 . . . . 74.23 111.943 -178.076 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.478 ' O ' ' HB2' ' A' ' 82' ' ' ASN . . . -55.55 -55.17 35.08 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 109.765 -0.458 . . . . 72.42 109.765 171.123 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.434 ' O ' ' HG2' ' A' ' 83' ' ' LYS . . . -69.86 -45.7 67.17 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.503 0.721 . . . . 71.23 111.389 178.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.562 ' HB ' ' HA ' ' A' ' 77' ' ' PHE . 21.6 mm -60.81 -52.38 62.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 C-N-CA 124.624 1.17 . . . . 54.01 111.823 -175.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 37.5 mt -67.09 -36.25 81.58 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 118.97 -0.538 . . . . 74.33 111.202 177.237 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.579 HD21 ' HB3' ' A' ' 92' ' ' ASP . 0.2 OUTLIER -60.55 -36.74 79.19 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 123.413 0.445 . . . . 73.53 109.892 178.655 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.434 ' HG2' ' O ' ' A' ' 79' ' ' ALA . 75.0 mmtt -61.74 -47.19 86.32 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.014 0.526 . . . . 74.54 110.261 174.796 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.501 HG13 ' HG2' ' A' ' 38' ' ' LYS . 74.2 t -62.26 -45.44 98.75 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 C-N-CA 124.03 0.932 . . . . 65.14 110.601 -175.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.5 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 20.0 m-85 -62.52 -41.07 98.61 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.617 0.767 . . . . 75.22 110.731 177.235 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -69.87 -24.76 63.47 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.607 0.763 . . . . 73.31 111.516 178.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -84.78 -11.42 55.79 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.614 0.766 . . . . 64.42 111.566 176.213 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 82.1 mt -99.71 -32.7 10.92 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 109.519 -0.548 . . . . 75.33 109.519 177.143 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 131.32 -19.43 4.84 Favored Glycine 0 C--N 1.349 1.268 0 C-N-CA 123.265 0.46 . . . . 45.33 112.938 -179.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.5 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 23.8 m-85 -68.48 145.93 53.61 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.452 0.701 . . . . 70.1 110.995 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -92.87 159.56 15.3 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.368 0.667 . . . . 72.15 110.142 -177.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . 0.579 ' HB3' HD21 ' A' ' 82' ' ' ASN . 9.2 p-10 -64.85 -25.24 67.82 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.875 0.87 . . . . 72.24 110.969 172.645 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 80.4 p -67.03 -11.02 55.88 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.933 0.893 . . . . 54.43 112.643 176.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -90.91 -19.69 23.05 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.697 0.799 . . . . 64.21 110.723 175.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.52 HG13 HG21 ' A' ' 102' ' ' VAL . 59.3 t -90.71 115.18 29.47 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.975 0 C-N-CA 124.702 1.201 . . . . 74.51 110.757 -166.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 63.7 m -120.89 108.61 14.12 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.603 0.761 . . . . 62.44 110.299 178.234 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 68.2 m95 -87.91 121.86 30.84 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.367 0.667 . . . . 75.43 111.672 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -117.92 81.85 1.74 Allowed 'General case' 0 C--O 1.243 0.748 0 C-N-CA 124.621 1.169 . . . . 73.54 107.895 169.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.05 -115.1 4.38 Favored Glycine 0 C--N 1.345 1.07 0 CA-C-N 114.908 -1.042 . . . . 71.51 112.535 -178.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -96.72 1.88 51.43 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.888 0.875 . . . . 64.32 111.363 -178.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 43.1 m -118.58 140.29 50.13 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 108.911 -0.774 . . . . 61.14 108.911 179.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . 0.52 HG21 HG13 ' A' ' 95' ' ' VAL . 5.9 p -121.19 128.07 75.94 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 C-N-CA 123.22 0.608 . . . . 71.42 110.087 174.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 85.7 m -101.75 104.56 15.36 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 107.375 -1.343 . . . . 73.34 107.375 172.137 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.401 HG21 ' CZ ' ' A' ' 85' ' ' PHE . 59.1 t -94.01 111.84 25.82 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 N-CA-C 107.639 -1.245 . . . . 65.14 107.639 178.728 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -113.17 118.79 35.69 Favored 'General case' 0 C--O 1.241 0.658 0 N-CA-C 108.297 -1.001 . . . . 74.22 108.297 -177.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -167.78 -173.62 36.0 Favored Glycine 0 CA--C 1.502 -0.772 0 N-CA-C 110.884 -0.887 . . . . 61.24 110.884 -178.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 . . . . . 0 C--O 1.241 0.634 0 N-CA-C 108.579 -0.897 . . . . 74.53 108.579 175.216 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.3 tpmt? . . . . . 0 N--CA 1.472 0.638 0 CA-C-O 121.06 0.457 . . . . 72.2 110.82 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.8 ttmt -86.54 122.43 30.46 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.654 -0.703 . . . . 71.05 109.147 167.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -103.89 136.56 36.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 107.241 -1.392 . . . . 52.32 107.241 167.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.421 ' HB2' ' HD3' ' A' ' 63' ' ' LYS . 53.6 mt-10 -107.83 115.04 29.41 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 108.958 -0.756 . . . . 75.25 108.958 -179.75 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 92.2 t -96.34 114.41 33.08 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.688 0 C-N-CA 124.21 1.004 . . . . 75.55 109.572 -174.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -94.62 98.74 11.02 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 108.312 -0.996 . . . . 52.21 108.312 -177.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 90.7 t -93.76 108.23 20.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 N-CA-C 108.693 -0.854 . . . . 73.44 108.693 -176.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -108.04 103.93 13.26 Favored 'General case' 0 C--O 1.216 -0.709 0 N-CA-C 109.065 -0.717 . . . . 74.14 109.065 179.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.514 HD12 ' SD ' ' A' ' 45' ' ' MET . 12.8 tt -107.38 130.19 59.99 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 CA-C-O 121.085 0.469 . . . . 72.23 111.025 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 11.0 m -99.66 107.66 19.83 Favored 'General case' 0 C--O 1.241 0.61 0 C-N-CA 123.916 0.886 . . . . 75.14 108.652 177.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 37.5 t -130.66 120.31 23.72 Favored 'General case' 0 C--O 1.246 0.899 0 C-N-CA 123.911 0.884 . . . . 75.32 109.966 -179.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 57.9 t30 56.75 53.36 8.39 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.492 1.117 . . . . 60.34 110.986 178.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 68.95 6.87 54.65 Favored Glycine 0 C--N 1.343 0.922 0 CA-C-N 114.85 -1.068 . . . . 71.1 115.055 174.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -117.08 139.67 50.43 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.603 0.761 . . . . 52.24 110.376 -178.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 92.0 m -102.15 118.22 36.43 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.075 0.95 . . . . 62.14 110.17 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.559 ' HB3' ' NH2' ' A' ' 44' ' ' ARG . 50.4 m-85 -114.28 101.01 8.77 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.123 0.969 . . . . 71.23 109.0 -178.518 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -116.47 136.85 52.64 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 120.911 0.386 . . . . 71.32 110.719 178.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 51.8 ttt85 -147.43 139.88 24.63 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 123.518 0.727 . . . . 74.5 109.473 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 27.6 m -98.47 108.95 21.77 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 123.91 0.884 . . . . 64.34 109.671 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -97.37 127.09 43.03 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.094 0.957 . . . . 70.32 109.339 -176.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 26.2 mp0 -87.04 109.33 19.33 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 108.765 -0.828 . . . . 64.11 108.765 -178.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 70.4 mt -113.79 130.45 56.45 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.772 0.829 . . . . 65.1 109.144 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -121.79 119.06 30.58 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 108.473 -0.936 . . . . 74.24 108.473 -177.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.511 ' HB3' HD23 ' A' ' 33' ' ' LEU . . . -149.45 166.07 30.21 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-O 121.576 0.703 . . . . 71.11 110.753 177.478 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 41.6 t -106.33 -57.6 4.28 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 CA-C-N 114.38 -1.282 . . . . 65.23 108.825 176.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.663 ' HB2' ' HG3' ' A' ' 32' ' ' GLU . 66.5 mtp180 -87.97 158.29 18.69 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.805 1.242 . . . . 74.11 109.977 -179.783 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -77.07 -37.12 55.15 Favored 'General case' 0 N--CA 1.493 1.682 0 C-N-CA 124.485 1.114 . . . . 72.53 110.654 -172.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -64.08 -30.64 71.69 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 114.91 -1.041 . . . . 72.25 111.167 174.112 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.663 ' HG3' ' HB2' ' A' ' 29' ' ' ARG . 49.8 mt-10 -69.35 -23.18 63.72 Favored 'General case' 0 C--N 1.358 0.943 0 C-N-CA 122.161 0.184 . . . . 70.54 110.698 175.514 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.511 HD23 ' HB3' ' A' ' 27' ' ' ALA . 0.2 OUTLIER -84.24 -34.56 23.83 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-O 119.152 -0.451 . . . . 75.2 110.1 178.047 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.603 ' HG2' HG23 ' A' ' 80' ' ' ILE . 29.9 mtpt -53.75 -53.52 51.02 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 123.794 0.684 . . . . 62.23 112.033 -177.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.52 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 4.4 pt-20 -50.85 -47.21 60.35 Favored 'General case' 0 N--CA 1.474 0.772 0 O-C-N 124.515 1.135 . . . . 65.22 111.551 176.503 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 55.3 mttm -63.93 -38.05 89.65 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.415 0.686 . . . . 72.23 111.365 -173.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.456 HD13 HD23 ' A' ' 81' ' ' LEU . 79.8 mt -62.24 -50.48 71.56 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 124.098 0.874 . . . . 74.21 110.479 175.33 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.423 ' HG2' HG13 ' A' ' 84' ' ' VAL . 7.1 mtpm? -59.72 -34.69 73.25 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.76 0.824 . . . . 74.25 111.535 177.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.52 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 32.5 mmmt -65.49 -61.33 2.16 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 123.527 0.517 . . . . 73.03 110.739 176.152 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 46.4 t -57.6 -39.72 71.2 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.226 0 C-N-CA 124.672 1.189 . . . . 75.32 111.537 -175.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 63.5 mt -63.63 -57.19 10.85 Favored 'General case' 0 C--O 1.217 -0.642 0 CA-C-N 115.732 -0.667 . . . . 75.04 110.27 175.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.457 HD21 HD22 ' A' ' 88' ' ' LEU . 0.9 OUTLIER -60.5 -26.23 66.68 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 112.58 0.585 . . . . 75.31 112.58 -179.399 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.4 mm-40 -70.89 -51.86 23.64 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 120.879 0.371 . . . . 73.22 110.681 174.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.559 ' NH2' ' HB3' ' A' ' 19' ' ' TYR . 7.9 tpt180 -76.37 -32.29 58.51 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 115.481 -0.781 . . . . 73.14 112.139 -172.614 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.514 ' SD ' HD12 ' A' ' 12' ' ' ILE . 97.2 mmm -80.17 -12.8 59.61 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.161 0.584 . . . . 71.21 111.94 -172.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.77 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 9.5 t70 -70.85 -51.7 10.99 Favored Pre-proline 0 CA--C 1.569 1.707 0 CA-C-O 118.525 -0.75 . . . . 62.3 111.7 -177.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -62.04 -23.95 76.2 Favored 'Trans proline' 0 C--N 1.386 2.549 0 C-N-CA 122.031 1.821 . . . . 63.12 113.927 173.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.403 HG21 HD11 ' A' ' 12' ' ' ILE . 46.2 mm -65.27 -37.59 80.51 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 C-N-CA 123.889 0.876 . . . . 74.14 111.858 -178.32 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.77 ' HE2' ' HA ' ' A' ' 46' ' ' ASP . 45.1 mtmt -62.19 -34.41 76.39 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 122.777 0.431 . . . . 54.11 110.323 175.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -74.86 -29.09 60.92 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.767 0.827 . . . . 54.12 111.278 177.058 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 82.4 mt -68.28 -23.87 64.81 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 109.476 -0.564 . . . . 64.53 109.476 173.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.56 46.96 5.86 Favored Glycine 0 C--N 1.347 1.168 0 CA-C-N 115.163 -0.926 . . . . 24.11 112.481 166.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 20.8 p -117.03 107.35 14.42 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 123.803 0.841 . . . . 74.45 108.799 175.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -78.0 -12.8 60.02 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 110.293 -0.262 . . . . 71.54 110.293 177.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 37.1 ttt180 -116.7 127.71 54.66 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 108.781 -0.822 . . . . 73.33 108.781 170.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 28.7 m -130.8 142.11 44.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 123.825 0.85 . . . . 70.42 109.578 178.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 42.0 ttm180 -118.0 108.29 15.08 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.434 0.694 . . . . 64.3 109.819 173.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 36.6 mt -105.17 105.76 19.25 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 C-N-CA 124.593 1.157 . . . . 62.02 109.944 -177.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.416 ' HA ' ' O ' ' A' ' 102' ' ' VAL . 29.0 m -96.36 105.5 17.59 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 108.414 -0.958 . . . . 75.01 108.414 174.305 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 50.8 mt -97.5 125.11 50.7 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 123.017 0.527 . . . . 70.0 110.428 178.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 1.4 mpp_? -112.79 121.32 44.35 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 107.243 -1.391 . . . . 72.24 107.243 178.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.4 p -94.59 131.12 42.32 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 N-CA-C 109.563 -0.532 . . . . 55.44 109.563 -175.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.421 ' HD3' ' HB2' ' A' ' 7' ' ' GLU . 53.6 mtpt -95.85 133.3 40.16 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 108.29 -1.004 . . . . 64.13 108.29 -178.22 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 94.6 m-70 -101.17 155.89 17.75 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 114.009 1.115 . . . . 75.12 114.009 -161.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 34.0 t -69.47 -49.36 55.52 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 113.184 -1.825 . . . . 62.44 110.863 176.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -160.19 162.21 33.77 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 122.682 0.393 . . . . 74.02 110.688 -177.242 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.32 -37.5 83.49 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.171 0.989 . . . . 74.02 111.858 177.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.17 -39.05 78.96 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.921 -0.581 . . . . 72.21 111.421 177.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -83.01 -25.94 31.7 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 115.322 -0.854 . . . . 75.3 112.362 -173.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -62.58 -36.84 83.98 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 113.204 0.816 . . . . 72.32 113.204 -167.057 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.504 ' O ' ' HD3' ' A' ' 75' ' ' LYS . 21.3 pttp -67.11 -19.89 65.7 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.941 0.896 . . . . 74.41 112.139 178.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -86.24 -50.42 6.97 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.029 0.532 . . . . 60.32 110.69 169.312 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -52.44 -48.58 65.69 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 124.427 1.091 . . . . 62.01 112.132 -173.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.88 -49.56 75.74 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.877 0.871 . . . . 61.12 112.541 -176.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.504 ' HD3' ' O ' ' A' ' 71' ' ' LYS . 3.3 mptp? -69.8 -34.12 73.27 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 115.575 -0.738 . . . . 71.2 111.035 -175.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -64.67 -48.04 76.24 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.165 0.586 . . . . 72.0 110.106 171.16 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -70.18 -21.27 63.07 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.481 1.112 . . . . 75.33 110.111 -173.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.487 ' HA ' ' NE1' ' A' ' 97' ' ' TRP . . . -63.72 -48.77 75.71 Favored 'General case' 0 C--N 1.343 0.324 0 C-N-CA 123.955 0.902 . . . . 42.01 110.722 172.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.09 -42.21 85.01 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.573 -0.739 . . . . 44.13 111.021 176.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.603 HG23 ' HG2' ' A' ' 34' ' ' LYS . 44.0 mm -58.73 -50.33 79.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 123.966 0.907 . . . . 62.44 110.797 179.633 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.456 HD23 HD13 ' A' ' 37' ' ' LEU . 23.3 mt -68.12 -36.85 80.4 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 122.928 0.491 . . . . 74.13 111.883 179.027 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -59.74 -36.96 77.67 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.295 0.638 . . . . 75.32 110.21 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -71.98 -48.55 44.12 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 115.332 -0.849 . . . . 75.02 111.119 175.069 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.479 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 23.2 t -58.76 -55.33 23.82 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 C-N-CA 123.989 0.916 . . . . 74.51 111.323 -174.307 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.448 ' CE2' HG21 ' A' ' 104' ' ' VAL . 55.3 m-85 -59.89 -36.43 76.94 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 123.929 0.768 . . . . 64.21 112.231 179.257 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -71.19 -24.18 62.18 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 122.941 0.496 . . . . 75.11 111.858 178.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -84.8 -5.78 59.34 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.824 0.85 . . . . 70.31 111.004 175.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 68.4 mt -105.41 -31.06 9.2 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 122.701 0.4 . . . . 41.12 110.873 -179.578 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 143.6 -10.77 2.17 Favored Glycine 0 C--N 1.348 1.234 0 CA-C-O 119.404 -0.665 . . . . 64.11 114.287 177.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.443 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 97.1 m-85 -74.75 126.56 31.16 Favored 'General case' 0 N--CA 1.484 1.229 0 CA-C-N 118.271 1.036 . . . . 73.14 110.682 176.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . 0.416 HD22 ' N ' ' A' ' 91' ' ' ASN . 0.8 OUTLIER -95.62 91.72 6.27 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.494 0.718 . . . . 75.11 111.333 -174.023 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 20.8 t70 54.8 -81.19 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 124.819 1.247 . . . . 73.04 113.989 165.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 20.1 m -66.73 -13.8 61.8 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 124.172 0.989 . . . . 50.21 113.144 -175.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . 0.459 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 10.6 m120 -55.37 -37.44 67.53 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.175 0.59 . . . . 73.51 110.671 168.506 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 45.1 t -99.03 118.32 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 125.137 1.375 . . . . 71.45 110.092 -174.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 45.5 m -144.69 128.05 16.87 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-N 118.442 0.565 . . . . 73.51 110.568 173.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.487 ' NE1' ' HA ' ' A' ' 78' ' ' ALA . 27.7 m95 -87.17 152.49 22.28 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 124.129 0.971 . . . . 73.41 111.513 -179.317 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -159.72 92.76 1.05 Allowed 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.139 0.975 . . . . 73.03 109.036 177.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 59.25 58.54 13.92 Favored Glycine 0 C--N 1.346 1.105 0 CA-C-N 115.887 -0.597 . . . . 73.25 113.501 177.273 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 71.03 3.41 4.64 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 124.88 1.272 . . . . 61.41 113.055 179.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 37.7 m -119.59 110.75 17.23 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 108.916 -0.772 . . . . 74.24 108.916 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . 0.416 ' O ' ' HA ' ' A' ' 59' ' ' SER . 6.9 p -99.76 119.8 48.3 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 N-CA-C 109.471 -0.566 . . . . 72.13 109.471 179.842 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 87.0 m -92.35 104.4 16.75 Favored 'General case' 0 C--O 1.241 0.634 0 N-CA-C 108.221 -1.029 . . . . 73.15 108.221 176.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.459 ' HA ' ' O ' ' A' ' 94' ' ' ASN . 48.8 t -108.48 109.49 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 C-N-CA 124.234 1.013 . . . . 72.35 108.37 179.056 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -135.76 147.24 48.32 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 122.465 0.306 . . . . 62.32 110.269 -176.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . 0.413 ' HA3' ' ND2' ' A' ' 94' ' ' ASN . . . 168.27 -160.39 33.9 Favored Glycine 0 C--O 1.245 0.782 0 CA-C-N 115.825 -0.625 . . . . 72.12 112.338 -177.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 27.2 pt20 . . . . . 0 CA--C 1.55 0.964 0 CA-C-O 121.758 0.789 . . . . 70.34 111.623 -174.775 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.9 mmmm . . . . . 0 C--O 1.24 0.604 0 CA-C-O 121.221 0.534 . . . . 72.14 110.975 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.52 ' HA ' ' HA ' ' A' ' 26' ' ' TYR . 40.5 ttpt -83.05 110.9 18.39 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 106.89 -1.522 . . . . 74.44 106.89 166.591 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.539 HG21 HG22 ' A' ' 62' ' ' VAL . 7.2 p -98.21 149.91 5.05 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 N-CA-C 108.87 -0.789 . . . . 74.1 108.87 -176.101 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.446 ' HB3' HG22 ' A' ' 22' ' ' THR . 37.2 mt-10 -109.85 113.19 25.73 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 108.988 -0.745 . . . . 72.41 108.988 -176.002 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 79.5 t -100.71 118.24 47.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 C-N-CA 124.614 1.166 . . . . 73.43 109.333 -176.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -96.84 102.48 14.27 Favored 'General case' 0 C--O 1.24 0.588 0 N-CA-C 108.034 -1.099 . . . . 75.43 108.034 -178.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.433 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 48.2 t -93.67 104.65 15.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 N-CA-C 108.442 -0.947 . . . . 44.43 108.442 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -108.17 105.17 14.78 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.946 0.898 . . . . 71.35 109.009 -175.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.546 HD13 HG13 ' A' ' 48' ' ' ILE . 17.6 tt -123.41 118.4 54.36 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-O 121.256 0.551 . . . . 74.11 110.973 -178.337 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 21.8 m -95.01 121.03 36.21 Favored 'General case' 0 C--O 1.242 0.703 0 N-CA-C 108.676 -0.861 . . . . 64.11 108.676 177.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.422 ' SG ' HG23 ' A' ' 48' ' ' ILE . 26.3 t -145.26 141.92 29.04 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 124.213 1.005 . . . . 62.43 109.756 -178.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 46.6 t-20 72.03 -74.02 0.09 Allowed 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 125.182 1.393 . . . . 72.52 109.471 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -168.2 11.56 0.06 OUTLIER Glycine 0 C--N 1.338 0.662 0 N-CA-C 111.024 -0.83 . . . . 53.04 111.024 172.018 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 27.8 mmmt -122.3 138.29 54.56 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 124.743 1.217 . . . . 65.4 109.368 -175.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 53.7 m -98.09 122.78 41.65 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 108.819 -0.808 . . . . 63.54 108.819 174.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -106.13 101.47 10.95 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 107.106 -1.442 . . . . 73.33 107.106 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.433 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 12.8 pt-20 -130.7 141.75 50.41 Favored 'General case' 0 C--O 1.241 0.619 0 CA-C-O 121.217 0.532 . . . . 71.14 110.17 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 57.9 ttt85 -155.29 148.01 24.28 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 114.805 -1.089 . . . . 74.52 108.497 174.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.446 HG22 ' HB3' ' A' ' 7' ' ' GLU . 22.4 m -93.38 108.69 20.31 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.88 0.872 . . . . 74.03 108.926 177.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 80.3 m-85 -98.76 132.14 44.36 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.121 0.968 . . . . 64.14 110.169 -174.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.426 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 1.9 mp0 -88.96 107.59 19.11 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 108.365 -0.976 . . . . 61.13 108.365 178.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 33.5 mt -112.06 106.82 15.56 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.119 0.967 . . . . 73.32 109.288 179.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.52 ' HA ' ' HA ' ' A' ' 5' ' ' LYS . 55.0 t80 -81.07 128.16 33.42 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.165 0.586 . . . . 73.44 109.844 176.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.427 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -141.19 147.88 39.07 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.182 0.593 . . . . 73.03 110.461 174.096 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 58.7 t -84.85 -40.23 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 CA-C-N 115.645 -0.707 . . . . 53.25 109.163 172.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.53 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 40.0 mtt180 -120.16 162.49 19.26 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 115.043 -0.98 . . . . 74.42 109.841 -178.166 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -63.56 -38.01 89.52 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 115.133 -0.939 . . . . 64.21 110.797 171.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -65.91 -27.49 68.23 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.942 0.897 . . . . 65.21 111.781 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.53 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 12.4 mm-40 -68.0 -39.13 83.3 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 122.399 0.28 . . . . 72.41 110.362 177.682 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.572 HD22 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -66.11 -20.19 66.08 Favored 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 123.583 0.753 . . . . 71.5 110.986 -175.136 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.1 mtpp -54.03 -62.97 1.31 Allowed 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.661 0.785 . . . . 73.33 111.994 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.554 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 2.5 pp20? -65.0 -30.37 71.36 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 116.107 -0.497 . . . . 73.53 111.471 -176.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.572 ' HD2' HD22 ' A' ' 33' ' ' LEU . 53.8 mttm -64.42 -41.69 96.47 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.665 0.786 . . . . 65.4 110.495 178.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.437 HD13 HD23 ' A' ' 81' ' ' LEU . 74.4 mt -56.31 -52.75 63.37 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 124.014 0.821 . . . . 43.13 109.746 171.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.2 mtpm? -56.77 -37.79 71.57 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 124.121 0.888 . . . . 64.21 112.004 -178.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.554 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 29.9 mmtp -61.84 -55.29 31.45 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 122.948 0.499 . . . . 74.14 110.137 177.105 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 92.7 t -64.55 -34.11 67.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-N 115.008 -0.997 . . . . 73.32 111.422 -176.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.462 HD21 HD11 ' A' ' 60' ' ' ILE . 64.2 mt -72.4 -41.0 66.78 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.358 0.663 . . . . 74.3 111.023 -177.17 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.8 m-80 -64.94 -40.38 94.95 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 122.356 0.262 . . . . 70.31 111.109 174.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 47.7 mm-40 -65.95 -46.81 76.78 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.262 0.625 . . . . 64.52 111.4 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? -69.58 -39.26 77.45 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.35 0.66 . . . . 74.25 111.54 -177.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.476 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 54.3 mtp -88.45 -7.91 55.81 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 113.169 0.803 . . . . 74.1 113.169 -175.63 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -63.27 -51.47 68.59 Favored Pre-proline 0 CA--C 1.569 1.693 0 CA-C-O 118.548 -0.739 . . . . 73.3 111.573 178.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -66.49 -23.28 50.58 Favored 'Trans proline' 0 C--N 1.398 3.181 0 C-N-CA 122.383 2.056 . . . . 74.33 112.801 175.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.546 HG13 HD13 ' A' ' 12' ' ' ILE . 51.2 mm -67.07 -29.98 47.95 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 C-N-CA 124.148 0.979 . . . . 71.44 110.077 179.693 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.476 ' HG3' ' O ' ' A' ' 45' ' ' MET . 92.7 mttt -70.02 -34.5 73.37 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 115.272 -0.877 . . . . 74.44 110.6 175.625 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.4 ttmp? -74.24 -26.64 60.35 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.088 0.555 . . . . 71.45 111.319 178.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 88.8 mt -70.99 -45.01 64.76 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 108.995 -0.743 . . . . 62.33 108.995 172.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 88.21 17.87 56.64 Favored Glycine 0 C--N 1.342 0.903 0 CA-C-N 115.392 -0.822 . . . . 63.14 114.671 171.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.537 ' SG ' HG12 ' A' ' 56' ' ' VAL . 6.6 p -62.04 122.45 15.54 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 123.602 0.761 . . . . 70.11 110.131 175.209 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm -62.65 -57.15 12.06 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.212 0.605 . . . . 75.13 110.445 -177.189 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 33.5 ttp180 -103.48 128.23 50.71 Favored 'General case' 0 C--N 1.345 0.384 0 CA-C-N 115.504 -0.771 . . . . 71.54 109.11 176.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.537 HG12 ' SG ' ' A' ' 53' ' ' CYS . 34.5 m -116.08 142.96 27.32 Favored 'Isoleucine or valine' 0 C--O 1.244 0.785 0 C-N-CA 123.62 0.768 . . . . 75.32 109.437 176.467 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -100.42 103.1 14.46 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 108.52 -0.918 . . . . 73.05 108.52 177.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 36.9 mt -102.09 140.07 21.56 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 N-CA-C 107.994 -1.113 . . . . 64.03 107.994 179.065 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 32.4 t -141.9 104.24 4.47 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 107.327 -1.36 . . . . 60.32 107.327 175.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.462 HD11 HD21 ' A' ' 41' ' ' LEU . 78.2 mt -103.26 107.55 22.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 N-CA-C 108.511 -0.922 . . . . 74.31 108.511 -178.308 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 28.0 ttt180 -102.27 131.79 48.62 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 108.518 -0.919 . . . . 71.02 108.518 173.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.539 HG22 HG21 ' A' ' 6' ' ' VAL . 8.0 p -95.04 139.2 19.16 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 N-CA-C 106.979 -1.489 . . . . 75.13 106.979 174.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -82.77 136.99 34.52 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-O 121.134 0.492 . . . . 73.25 109.872 -175.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . 0.57 ' HB3' ' HG3' ' A' ' 70' ' ' GLU . 73.7 m80 -105.43 127.61 53.08 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 124.47 1.108 . . . . 61.33 109.397 -169.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 23.3 t -83.35 -47.81 11.07 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.643 0.777 . . . . 64.23 111.481 -171.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -109.29 -105.04 0.36 Allowed 'General case' 0 CA--C 1.56 1.329 0 C-N-CA 123.439 0.696 . . . . 74.23 109.998 -175.027 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.405 ' O ' ' HG2' ' A' ' 71' ' ' LYS . . . 176.71 -60.25 0.01 OUTLIER 'General case' 0 C--N 1.362 1.111 0 C-N-CA 125.351 1.46 . . . . 75.54 107.9 -177.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.27 -42.79 68.31 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 115.436 -0.802 . . . . 73.52 110.419 178.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -62.19 -36.04 80.69 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 115.572 -0.74 . . . . 43.42 110.461 173.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.57 ' HG3' ' HB3' ' A' ' 64' ' ' HIS . 41.5 mm-40 -73.2 -22.61 60.42 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.23 0.612 . . . . 71.14 112.137 -175.024 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.405 ' HG2' ' O ' ' A' ' 67' ' ' ALA . 3.1 mmmp? -63.39 -33.58 75.85 Favored 'General case' 0 N--CA 1.483 1.187 0 CA-C-O 121.285 0.564 . . . . 73.0 110.128 172.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 34.1 ttpt -84.29 -46.0 12.25 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.764 1.226 . . . . 71.34 110.96 177.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -80.5 -30.81 37.3 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 112.873 0.694 . . . . 70.43 112.873 -168.293 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -78.62 -30.6 46.58 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 122.594 0.358 . . . . 73.4 110.279 175.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 51.9 tttm -63.39 -40.5 97.39 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.618 0.767 . . . . 61.5 110.201 168.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -67.19 -40.69 86.57 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.693 0.797 . . . . 71.43 110.384 175.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -76.47 -19.04 58.43 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.984 0.914 . . . . 72.12 110.588 -175.215 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.2 -45.74 83.5 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.286 0.634 . . . . 40.53 110.448 173.221 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.69 -34.17 75.28 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.54 -0.755 . . . . 74.13 111.255 176.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 46.4 mm -67.68 -50.72 58.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 123.86 0.864 . . . . 74.1 110.918 -179.249 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.437 HD23 HD13 ' A' ' 37' ' ' LEU . 34.4 mt -66.11 -50.72 63.07 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 123.625 0.578 . . . . 72.34 110.174 -176.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -56.89 -41.29 77.78 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 124.029 0.932 . . . . 64.35 111.543 -177.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 19.7 mmmt -64.96 -44.71 88.5 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 123.76 0.663 . . . . 74.35 111.255 176.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.419 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 25.0 t -62.61 -44.7 99.62 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 C-N-CA 123.017 0.527 . . . . 64.2 110.124 -176.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.558 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 20.6 m-85 -60.77 -42.3 97.2 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 124.091 0.869 . . . . 74.42 110.273 177.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.39 -34.13 77.07 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.529 0.731 . . . . 73.51 111.331 177.558 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -81.27 -8.02 59.67 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.022 0.929 . . . . 74.25 110.85 -178.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 93.1 mt -107.22 -9.77 16.01 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.821 0.848 . . . . 70.01 110.397 176.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 109.4 -5.73 31.65 Favored Glycine 0 N--CA 1.478 1.485 0 N-CA-C 114.096 0.399 . . . . 50.14 114.096 175.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.619 ' HB3' HD21 ' A' ' 94' ' ' ASN . 9.9 m-85 -79.66 138.85 37.51 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.374 0.67 . . . . 63.13 109.438 179.048 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 28.3 m-80 -96.53 168.77 10.34 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.548 0.739 . . . . 71.23 111.735 -176.167 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -54.45 -45.46 73.11 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.926 1.29 . . . . 75.43 111.041 177.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 23.9 m -57.48 -46.45 83.69 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 124.71 1.204 . . . . 61.31 113.424 -173.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . 0.619 HD21 ' HB3' ' A' ' 90' ' ' TYR . 3.7 p-10 -83.05 -11.24 58.23 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 122.743 0.417 . . . . 51.35 111.675 -177.111 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 97.0 t -88.6 102.1 12.48 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 N-CA-C 107.956 -1.127 . . . . 51.5 107.956 172.031 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 22.7 m -108.25 103.78 13.03 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.572 0.749 . . . . 64.14 110.458 -173.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 43.0 m95 -79.94 150.48 30.5 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.347 0.659 . . . . 74.11 111.65 178.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -144.28 69.88 1.28 Allowed 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 106.966 -1.494 . . . . 72.31 106.966 170.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 52.37 -82.4 0.01 OUTLIER Glycine 0 C--N 1.361 1.955 0 CA-C-N 114.156 -1.384 . . . . 41.12 114.777 179.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -72.55 -39.1 67.75 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 126.041 1.736 . . . . 34.04 112.776 -174.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 35.6 m -131.4 149.65 52.46 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.754 0.822 . . . . 50.43 110.475 -174.422 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 7.4 p -116.82 137.98 48.93 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 C-N-CA 123.329 0.652 . . . . 75.04 110.361 176.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 39.4 m -114.28 108.76 17.36 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.864 1.266 . . . . 71.01 109.073 176.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.4 t -101.04 119.69 49.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 C-N-CA 123.406 0.682 . . . . 73.43 109.475 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -86.32 113.07 22.01 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 107.333 -1.358 . . . . 75.22 107.333 171.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -105.02 167.31 14.99 Favored Glycine 0 C--N 1.34 0.804 0 N-CA-C 111.815 -0.514 . . . . 43.53 111.815 -176.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.241 0.633 0 C-N-CA 123.79 0.836 . . . . 65.03 110.179 -175.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.7 tppp? . . . . . 0 C--O 1.24 0.593 0 CA-C-O 120.802 0.334 . . . . 72.45 110.126 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 26.8 ttpt -85.94 111.07 19.9 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-N 115.436 -0.802 . . . . 72.31 109.12 174.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.4 p -99.66 142.38 15.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 N-CA-C 108.122 -1.066 . . . . 61.22 108.122 171.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.548 ' HB3' HG22 ' A' ' 22' ' ' THR . 50.2 mt-10 -113.71 118.91 35.65 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 109.521 -0.548 . . . . 41.12 109.521 177.507 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 59.2 t -106.75 116.02 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 124.429 1.092 . . . . 62.11 109.688 -171.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.409 ' O ' ' HA ' ' A' ' 60' ' ' ILE . 43.4 tt0 -92.26 102.7 15.2 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 107.987 -1.116 . . . . 54.43 107.987 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 98.0 t -96.89 102.71 13.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 N-CA-C 108.317 -0.994 . . . . 73.35 108.317 178.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.497 ' HA ' ' HB3' ' A' ' 20' ' ' GLU . 22.1 ttmm -104.22 103.56 13.34 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 108.573 -0.899 . . . . 72.11 108.573 -178.119 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.494 HD13 HG13 ' A' ' 48' ' ' ILE . 11.8 tt -112.55 124.21 69.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 CA-C-O 121.069 0.462 . . . . 75.45 109.943 179.419 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 11.9 m -98.04 113.5 25.39 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.615 0.766 . . . . 75.34 109.247 178.386 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.596 ' SG ' HG23 ' A' ' 48' ' ' ILE . 18.4 t -153.81 150.6 28.63 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.914 1.286 . . . . 53.24 108.849 179.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.525 ' HB2' HD13 ' A' ' 51' ' ' LEU . 62.5 t30 69.82 12.77 8.02 Favored 'General case' 0 N--CA 1.504 2.261 0 C-N-CA 124.273 1.029 . . . . 70.44 111.295 178.715 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 77.94 4.86 86.39 Favored Glycine 0 C--N 1.349 1.291 0 CA-C-N 116.414 -0.357 . . . . 53.22 112.319 -171.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.4 mmpt? -113.53 165.78 12.15 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.583 1.153 . . . . 73.21 109.526 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 39.8 m -119.36 115.66 24.59 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 109.281 -0.637 . . . . 71.1 109.281 174.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -103.62 106.22 16.67 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 107.131 -1.433 . . . . 73.14 107.131 -179.4 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.497 ' HB3' ' HA ' ' A' ' 11' ' ' LYS . 16.9 pt-20 -143.29 161.6 37.88 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.523 0.678 . . . . 71.2 112.212 -176.032 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 35.6 ttm180 -167.21 148.24 5.66 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-N 113.764 -1.562 . . . . 74.52 108.063 176.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.548 HG22 ' HB3' ' A' ' 7' ' ' GLU . 27.8 m -92.37 112.99 25.13 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 107.337 -1.357 . . . . 52.24 107.337 169.651 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 -97.51 127.26 43.33 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.062 0.945 . . . . 74.04 109.902 -173.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -83.85 106.07 15.24 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 107.502 -1.296 . . . . 73.54 107.502 178.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 81.5 mt -112.98 119.95 39.69 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.292 1.037 . . . . 71.23 108.337 -179.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -109.1 118.81 37.73 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 109.024 -0.732 . . . . 75.54 109.024 -177.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -124.84 150.91 45.92 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.269 0.628 . . . . 50.14 110.098 178.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 44.9 t -95.01 -26.31 4.39 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 C-N-CA 123.881 0.872 . . . . 75.11 109.489 175.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.6 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 90.3 mtt180 -131.72 157.03 44.86 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 108.158 -1.052 . . . . 73.01 108.158 174.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -67.67 -32.96 74.0 Favored 'General case' 0 N--CA 1.488 1.427 0 CA-C-O 121.239 0.542 . . . . 64.14 111.012 -178.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -70.2 -21.35 63.04 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.138 0.975 . . . . 73.42 111.343 -179.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.6 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 27.6 mm-40 -68.93 -23.7 64.19 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 122.875 0.47 . . . . 73.01 110.813 174.8 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.61 HD22 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -73.18 -19.29 61.14 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 123.238 0.615 . . . . 65.21 111.217 -177.386 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -54.86 -59.19 5.06 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.682 0.793 . . . . 74.33 111.573 178.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -57.5 -36.37 71.45 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.847 0.859 . . . . 54.33 112.487 -177.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.61 ' HD2' HD22 ' A' ' 33' ' ' LEU . 62.0 mttm -67.25 -46.09 74.77 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.298 -0.865 . . . . 73.42 109.912 -177.327 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.479 HD13 HD23 ' A' ' 81' ' ' LEU . 95.9 mt -65.63 -40.04 92.12 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.411 0.684 . . . . 63.41 111.874 177.767 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 60.2 mtpt -59.47 -42.44 92.06 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 122.929 0.492 . . . . 62.12 110.697 177.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 34.1 mmtm -67.64 -57.21 6.82 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 123.506 0.504 . . . . 74.2 111.268 176.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 53.0 t -56.07 -44.51 78.9 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.94 0 C-N-CA 123.213 0.605 . . . . 74.11 111.508 -175.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.47 HD21 HD11 ' A' ' 60' ' ' ILE . 83.8 mt -68.99 -59.82 2.79 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.003 0.521 . . . . 70.24 111.311 179.407 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 60.8 t30 -60.69 -38.42 84.92 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 123.415 0.686 . . . . 70.15 112.173 -172.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 -80.17 -32.55 38.77 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.366 0.666 . . . . 63.35 111.921 -177.322 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 4.5 tpt180 -68.74 -33.83 74.57 Favored 'General case' 0 N--CA 1.486 1.358 0 CA-C-O 121.318 0.58 . . . . 74.43 109.506 172.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.528 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 58.2 mtp -86.64 -6.35 58.88 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.295 -0.866 . . . . 72.22 112.058 178.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -63.19 -51.08 72.05 Favored Pre-proline 0 CA--C 1.565 1.549 0 CA-C-O 118.814 -0.612 . . . . 73.51 111.723 178.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -66.72 -22.31 50.23 Favored 'Trans proline' 0 C--N 1.384 2.422 0 C-N-CA 121.423 1.415 . . . . 62.43 112.263 172.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.596 HG23 ' SG ' ' A' ' 14' ' ' CYS . 45.3 mm -71.82 -27.13 26.91 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 123.552 0.741 . . . . 71.42 110.354 179.13 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.528 ' HG3' ' O ' ' A' ' 45' ' ' MET . 90.1 mttt -71.08 -36.58 72.29 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.474 0.71 . . . . 70.32 110.348 174.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.33 -32.73 70.58 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 123.561 0.744 . . . . 63.41 109.335 175.545 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.525 HD13 ' HB2' ' A' ' 15' ' ' ASN . 92.9 mt -70.07 -34.42 73.17 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 109.655 -0.498 . . . . 54.43 109.655 175.176 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 73.83 45.62 26.72 Favored Glycine 0 C--N 1.342 0.871 0 CA-C-N 115.513 -0.767 . . . . 61.51 113.285 176.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 49.9 m -76.0 112.74 12.75 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 108.918 -0.771 . . . . 73.11 108.918 169.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -58.52 -33.06 69.43 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.254 1.021 . . . . 70.04 111.084 -179.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 43.9 ttp180 -145.7 143.79 29.98 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.452 1.101 . . . . 75.24 108.489 177.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.476 ' O ' ' HA ' ' A' ' 105' ' ' GLU . 28.7 m -131.42 147.88 32.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 123.953 0.901 . . . . 55.22 109.488 179.371 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 52.3 ttt85 -102.7 107.22 18.03 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 108.812 -0.81 . . . . 71.45 108.812 175.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 37.9 mt -107.6 107.91 23.93 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 C-N-CA 123.371 0.668 . . . . 63.34 109.641 -177.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 18.2 m -98.75 105.67 17.84 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 108.479 -0.934 . . . . 74.43 108.479 174.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.47 HD11 HD21 ' A' ' 41' ' ' LEU . 71.8 mt -100.3 134.27 40.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 123.129 0.572 . . . . 62.01 109.481 177.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 21.9 mtm180 -128.37 136.53 51.06 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.564 0.746 . . . . 55.33 109.544 174.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.7 p -95.78 137.22 24.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 123.542 0.737 . . . . 61.3 109.203 178.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.419 ' HB3' ' H ' ' A' ' 7' ' ' GLU . 63.8 tttm -83.16 114.8 21.58 Favored 'General case' 0 C--O 1.244 0.798 0 N-CA-C 107.602 -1.258 . . . . 54.24 107.602 174.527 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . 0.597 ' HA ' ' HG2' ' A' ' 73' ' ' GLU . 21.6 m170 -69.71 132.97 46.96 Favored 'General case' 0 C--O 1.234 0.258 0 O-C-N 123.885 0.741 . . . . 73.43 110.132 -172.214 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 19.7 t -57.04 -52.34 65.65 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 123.836 0.854 . . . . 51.24 111.529 -179.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.603 ' H ' ' HB2' ' A' ' 69' ' ' GLU . 21.8 m-20 -144.99 179.69 7.18 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 124.306 1.043 . . . . 61.51 109.576 -178.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.26 -51.28 64.36 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.974 0.91 . . . . 71.22 111.085 176.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.17 -26.27 68.09 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.473 0.709 . . . . 63.52 111.421 177.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.603 ' HB2' ' H ' ' A' ' 66' ' ' ASP . 30.9 mm-40 -73.97 -30.2 62.38 Favored 'General case' 0 C--O 1.204 -1.327 0 CA-C-O 118.136 -0.935 . . . . 71.41 112.516 179.147 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -49.48 -47.89 48.2 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 114.166 1.173 . . . . 74.4 114.166 -168.463 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 40.9 mtmt -69.2 -39.71 78.47 Favored 'General case' 0 N--CA 1.479 0.975 0 CA-C-N 115.477 -0.783 . . . . 53.22 110.585 -177.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -69.54 -33.66 73.1 Favored 'General case' 0 C--O 1.212 -0.914 0 CA-C-N 114.581 -1.191 . . . . 74.23 110.225 175.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.597 ' HG2' ' HA ' ' A' ' 64' ' ' HIS . 10.1 tp10 -73.16 -39.32 65.74 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.953 1.301 . . . . 73.42 110.376 -166.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.23 -53.46 56.9 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 115.304 -0.862 . . . . 63.13 110.841 173.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 59.0 mttp -66.44 -39.47 88.93 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 124.396 1.078 . . . . 70.2 112.447 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -58.32 -54.58 45.45 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 125.387 1.475 . . . . 63.32 109.815 -179.12 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -73.37 -26.5 61.03 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 113.45 -1.705 . . . . 74.54 110.371 -177.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.4 -44.66 90.61 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.433 0.693 . . . . 73.34 111.076 175.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.51 -43.13 99.42 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.351 0.66 . . . . 50.03 111.219 178.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 49.0 mm -66.45 -44.29 90.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 CA-C-N 115.866 -0.606 . . . . 72.51 110.756 178.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.479 HD23 HD13 ' A' ' 37' ' ' LEU . 32.1 mt -64.7 -36.98 86.02 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.368 0.667 . . . . 63.41 110.975 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -55.53 -44.26 76.51 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.215 1.006 . . . . 54.22 110.233 179.238 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.421 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 33.7 mmtp -68.05 -45.09 74.89 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 114.841 -1.072 . . . . 75.52 110.961 177.562 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 77.5 t -66.87 -45.75 86.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 123.312 0.645 . . . . 73.22 111.151 -172.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.467 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 24.1 m-85 -60.75 -38.48 85.34 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.214 0.606 . . . . 72.45 110.718 176.145 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.32 -28.22 67.81 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.105 0.562 . . . . 65.24 111.485 176.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.421 ' HG3' ' O ' ' A' ' 83' ' ' LYS . 45.0 mt-10 -82.07 -14.96 55.06 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.538 0.735 . . . . 75.22 110.645 176.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 97.2 mt -107.34 -2.77 20.31 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.77 0.828 . . . . 73.42 110.846 -178.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 82.01 19.21 65.64 Favored Glycine 0 C--N 1.348 1.245 0 N-CA-C 114.503 0.561 . . . . 71.43 114.503 175.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.467 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 14.6 m-85 -89.39 137.68 32.11 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 109.419 -0.586 . . . . 71.13 109.419 173.084 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -80.51 150.69 29.55 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.57 0.748 . . . . 74.53 110.189 -176.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -67.37 -31.63 72.0 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.903 0.881 . . . . 71.33 112.11 -176.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 16.8 m -58.42 -27.02 63.92 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.123 0.569 . . . . 72.25 112.224 174.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 42.1 m-20 -75.6 -22.34 57.0 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.071 0.549 . . . . 70.42 111.116 178.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.515 ' HA ' HG22 ' A' ' 104' ' ' VAL . 47.9 t -91.16 105.84 16.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 124.335 1.054 . . . . 71.24 109.616 -171.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 19.3 m -129.75 112.84 14.02 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.059 0.544 . . . . 71.41 111.318 -174.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 65.5 m95 -87.34 119.34 27.51 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.683 0.793 . . . . 72.12 111.351 177.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -137.85 115.06 10.97 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.437 1.095 . . . . 71.43 108.64 172.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 64.26 43.7 96.62 Favored Glycine 0 C--N 1.351 1.404 0 O-C-N 124.05 0.844 . . . . 71.34 113.63 175.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 63.07 17.55 10.23 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 124.97 1.308 . . . . 74.52 111.672 179.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 25.4 m -118.56 119.78 35.53 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 107.087 -1.449 . . . . 71.03 107.087 175.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . 0.409 HG11 HD13 ' A' ' 81' ' ' LEU . 7.7 p -99.04 115.65 40.13 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 N-CA-C 109.013 -0.736 . . . . 75.32 109.013 178.188 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 41.7 m -94.52 118.52 31.79 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 107.913 -1.143 . . . . 70.43 107.913 177.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.515 HG22 ' HA ' ' A' ' 95' ' ' VAL . 55.9 t -128.54 114.97 35.73 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 C-N-CA 123.994 0.917 . . . . 74.31 108.609 -178.236 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . 0.476 ' HA ' ' O ' ' A' ' 56' ' ' VAL . 3.4 mp0 -85.1 110.95 19.33 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 108.007 -1.109 . . . . 73.55 108.007 171.219 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -104.11 148.14 16.77 Favored Glycine 0 C--N 1.337 0.629 0 N-CA-C 109.747 -1.341 . . . . 64.25 109.747 179.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 . . . . . 0 C--O 1.241 0.658 0 CA-C-O 121.216 0.531 . . . . 71.23 110.518 -173.61 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.53 ' HE3' ' HA ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.239 0.513 0 CA-C-O 120.956 0.408 . . . . 75.4 110.801 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.515 ' HA ' ' HA ' ' A' ' 26' ' ' TYR . 5.7 ttpm? -88.8 105.35 17.67 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 107.241 -1.392 . . . . 71.15 107.241 162.316 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.8 p -97.1 143.18 12.9 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 N-CA-C 108.901 -0.777 . . . . 74.45 108.901 -178.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.52 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 49.6 mt-10 -106.97 111.71 24.33 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 108.107 -1.072 . . . . 63.41 108.107 176.109 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 95.7 t -101.17 116.27 44.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 C-N-CA 124.773 1.229 . . . . 74.52 108.952 -175.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -96.64 101.34 12.93 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 107.982 -1.118 . . . . 72.3 107.982 -178.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 84.6 t -93.69 108.11 20.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 N-CA-C 108.434 -0.95 . . . . 54.25 108.434 179.127 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.401 ' HG3' ' HB3' ' A' ' 20' ' ' GLU . 39.4 ttmt -108.07 137.81 45.42 Favored 'General case' 0 C--O 1.224 -0.255 0 C-N-CA 124.748 1.219 . . . . 72.12 107.718 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.484 HD13 HG13 ' A' ' 48' ' ' ILE . 11.9 tt -143.98 136.57 23.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 CA-C-N 118.405 0.548 . . . . 73.35 110.966 176.642 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 28.0 m -101.9 120.48 40.47 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 108.66 -0.867 . . . . 71.12 108.66 173.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.614 ' SG ' HG23 ' A' ' 48' ' ' ILE . 0.9 OUTLIER -157.58 137.96 12.8 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.467 1.107 . . . . 75.32 109.201 -178.99 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.418 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 3.1 t-20 75.89 -46.33 0.55 Allowed 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 126.107 1.763 . . . . 74.52 112.482 179.378 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 155.44 2.02 0.12 Allowed Glycine 0 CA--C 1.522 0.52 0 N-CA-C 110.949 -0.86 . . . . 73.03 110.949 -175.167 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 49.3 mtpt -119.13 162.63 18.32 Favored 'General case' 0 C--N 1.355 0.822 0 C-N-CA 123.976 0.91 . . . . 63.52 109.621 -178.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.0 m -117.74 114.91 24.01 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 108.605 -0.887 . . . . 74.22 108.605 176.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -101.34 100.16 10.62 Favored 'General case' 0 C--O 1.24 0.563 0 N-CA-C 106.536 -1.653 . . . . 73.43 106.536 -175.039 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.401 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 11.9 pt-20 -134.48 145.2 48.59 Favored 'General case' 0 C--O 1.243 0.724 0 C-N-CA 123.361 0.665 . . . . 64.43 110.589 -173.337 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.8 ttm180 -167.71 144.71 4.3 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.619 0.768 . . . . 61.43 109.755 -179.144 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 28.1 m -87.6 108.74 19.21 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.645 0.778 . . . . 62.22 109.484 175.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -97.81 128.45 44.46 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.778 0.831 . . . . 75.22 109.48 -178.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.52 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 26.8 mp0 -93.87 109.15 20.86 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 108.414 -0.958 . . . . 74.44 108.414 -176.34 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 78.5 mt -120.04 106.73 12.27 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.533 1.133 . . . . 55.21 109.469 -175.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.515 ' HA ' ' HA ' ' A' ' 5' ' ' LYS . 61.9 t80 -95.23 142.0 28.17 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 122.745 0.418 . . . . 74.02 110.312 175.087 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.484 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -148.46 149.16 31.19 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 123.43 0.692 . . . . 72.11 110.243 174.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.0 t -86.13 -21.89 7.41 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.043 0 C-N-CA 124.613 1.165 . . . . 23.32 109.463 175.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.63 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 48.2 mtp180 -131.47 141.77 49.85 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 108.025 -1.102 . . . . 72.24 108.025 171.493 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -64.45 -19.39 65.51 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 122.565 0.346 . . . . 63.15 111.027 174.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 -66.78 -33.36 75.46 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.284 0.634 . . . . 70.01 111.621 170.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.63 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 8.4 mm-40 -68.83 -25.81 64.85 Favored 'General case' 0 N--CA 1.49 1.544 0 CA-C-N 117.871 0.305 . . . . 65.42 110.47 177.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.575 HD22 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -71.37 -25.39 62.35 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 123.426 0.691 . . . . 73.44 111.146 -177.901 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.451 ' HG2' HG23 ' A' ' 80' ' ' ILE . 57.3 mtpt -56.97 -52.18 66.27 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.786 0.834 . . . . 75.14 112.28 -176.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -61.46 -35.43 77.58 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.095 0.558 . . . . 72.34 111.645 179.495 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.575 ' HD2' HD22 ' A' ' 33' ' ' LEU . 65.4 mttm -65.88 -45.33 82.45 Favored 'General case' 0 C--N 1.352 0.7 0 C-N-CA 123.573 0.749 . . . . 74.45 109.988 -178.078 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 71.9 mt -58.39 -47.7 83.01 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 124.518 1.136 . . . . 75.5 110.843 176.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -58.41 -43.02 88.47 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 123.903 0.752 . . . . 63.21 111.346 178.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -70.85 -41.38 71.54 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.585 0.754 . . . . 60.42 112.52 -178.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.455 HG23 ' O ' ' A' ' 36' ' ' LYS . 94.5 t -64.66 -42.15 94.23 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 C-N-CA 123.234 0.614 . . . . 72.23 110.46 175.591 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.637 HD21 HD11 ' A' ' 60' ' ' ILE . 35.7 mt -64.74 -48.95 72.69 Favored 'General case' 0 C--O 1.212 -0.874 0 CA-C-N 115.481 -0.781 . . . . 64.23 110.135 179.129 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -63.04 -34.65 78.04 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.18 0.592 . . . . 50.44 111.678 177.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -68.86 -40.19 79.47 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.134 0.574 . . . . 63.43 110.079 178.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.41 ' HA ' ' CZ ' ' A' ' 44' ' ' ARG . 0.0 OUTLIER -76.14 -30.14 58.05 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 123.729 0.812 . . . . 74.21 111.337 179.166 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.459 ' SD ' HD12 ' A' ' 12' ' ' ILE . 87.7 mmm -91.1 -15.8 28.86 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 124.272 1.029 . . . . 74.13 112.35 -175.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.588 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 14.4 t70 -68.24 -50.77 28.1 Favored Pre-proline 0 CA--C 1.555 1.172 0 CA-C-O 118.247 -0.882 . . . . 73.22 112.038 -175.732 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.49 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 38.8 Cg_endo -63.08 -23.47 73.54 Favored 'Trans proline' 0 C--N 1.391 2.786 0 C-N-CA 121.812 1.675 . . . . 53.24 111.837 176.339 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.614 HG23 ' SG ' ' A' ' 14' ' ' CYS . 49.1 mm -71.12 -30.34 40.38 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 C-N-CA 124.788 1.235 . . . . 55.14 111.149 -177.244 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.588 ' HE2' ' HA ' ' A' ' 46' ' ' ASP . 45.7 mtmt -73.31 -36.99 66.33 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 122.87 0.468 . . . . 75.13 109.994 176.126 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.5 tmmm? -67.03 -31.48 72.05 Favored 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 123.398 0.679 . . . . 73.33 110.476 173.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 81.8 mt -72.6 -36.45 68.11 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 122.671 0.388 . . . . 64.51 110.021 173.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.57 40.51 18.37 Favored Glycine 0 C--N 1.345 1.083 0 CA-C-N 115.672 -0.695 . . . . 74.04 113.421 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.418 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 94.8 m -77.21 109.77 11.36 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 109.493 -0.558 . . . . 60.44 109.493 174.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -63.53 -51.46 65.37 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.978 0.911 . . . . 61.01 110.697 -174.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 68.5 ttt180 -111.36 133.5 53.63 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 109.313 -0.625 . . . . 74.42 109.313 174.007 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 31.5 m -126.34 146.11 32.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 124.002 0.921 . . . . 73.24 109.455 178.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 24.7 ttm180 -110.0 104.8 13.75 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 108.663 -0.866 . . . . 73.1 108.663 173.064 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.418 HD11 ' SD ' ' A' ' 45' ' ' MET . 38.0 mt -101.34 105.91 18.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 N-CA-C 108.697 -0.853 . . . . 73.23 108.697 -179.248 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 11.7 t -103.85 104.7 14.74 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 108.928 -0.767 . . . . 61.24 108.928 178.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.637 HD11 HD21 ' A' ' 41' ' ' LEU . 73.9 mt -96.51 112.43 28.63 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 124.266 1.026 . . . . 75.32 108.921 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 70.4 ttt180 -101.08 120.08 39.68 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 108.019 -1.104 . . . . 73.43 108.019 174.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 4.1 p -95.21 144.67 9.46 Favored 'Isoleucine or valine' 0 C--O 1.243 0.729 0 N-CA-C 108.433 -0.951 . . . . 74.14 108.433 -178.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.408 ' HB3' ' H ' ' A' ' 7' ' ' GLU . 60.0 tttm -92.05 144.17 25.72 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 109.137 -0.69 . . . . 70.31 109.137 177.338 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -117.32 154.87 30.51 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 124.162 0.985 . . . . 75.11 109.112 -167.725 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 36.7 t -64.54 -56.0 16.88 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 124.311 1.007 . . . . 74.12 111.598 -175.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -149.26 159.63 44.09 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 115.474 -0.784 . . . . 74.51 109.867 -167.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.73 -20.26 65.93 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 114.091 1.145 . . . . 61.43 114.091 -174.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -88.05 -31.05 19.48 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.175 0.59 . . . . 72.13 110.247 170.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 46.0 mm-40 -79.72 -11.25 59.85 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 114.913 -1.04 . . . . 74.55 113.298 -177.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -38.5 -51.45 1.59 Allowed 'General case' 0 N--CA 1.5 2.064 0 C-N-CA 124.381 1.072 . . . . 62.5 112.561 -179.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -80.93 -29.63 35.46 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 114.215 -1.357 . . . . 74.1 111.814 -172.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 56.7 tptt -74.46 -35.82 63.33 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.679 0.792 . . . . 72.41 110.458 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -84.94 -29.11 25.39 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.311 0.644 . . . . 72.04 110.157 -179.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.26 -47.67 75.9 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 123.897 0.748 . . . . 53.3 110.602 173.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp -73.79 -30.28 62.66 Favored 'General case' 0 CA--C 1.551 1.005 0 CA-C-N 116.093 -0.503 . . . . 64.33 111.395 179.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 4.6 ttmp? -57.43 -52.24 66.16 Favored 'General case' 0 N--CA 1.487 1.412 0 CA-C-O 121.438 0.637 . . . . 74.01 109.783 168.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -70.8 -19.2 62.71 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-N 114.742 -1.117 . . . . 74.32 111.812 179.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.439 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -61.61 -43.72 98.33 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 117.942 0.337 . . . . 60.23 110.665 174.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.83 -44.16 77.86 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.222 0.609 . . . . 60.12 111.569 174.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.451 HG23 ' HG2' ' A' ' 34' ' ' LYS . 35.2 mm -61.68 -46.71 95.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 C-N-CA 124.172 0.989 . . . . 74.43 111.476 -178.048 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.567 HD13 HG11 ' A' ' 102' ' ' VAL . 51.0 mt -76.53 -30.86 57.32 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.835 0.854 . . . . 74.42 111.118 -178.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 61.4 t30 -60.06 -39.27 85.43 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.207 0.603 . . . . 72.21 109.965 176.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -67.35 -43.28 81.92 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 115.104 -0.953 . . . . 60.12 111.336 175.316 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.419 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 42.8 t -64.36 -50.39 76.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 123.676 0.79 . . . . 71.31 110.676 -174.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.528 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 20.0 m-85 -66.22 -27.03 67.67 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.611 0.764 . . . . 71.25 111.239 -179.439 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.9 -35.58 78.73 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.324 0.649 . . . . 61.52 111.199 172.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -84.79 -1.99 57.09 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.73 0.812 . . . . 72.2 110.606 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 96.3 mt -107.21 -29.48 9.31 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.124 0.97 . . . . 71.44 110.415 176.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 103.44 9.28 38.9 Favored Glycine 0 C--N 1.351 1.389 0 C-N-CA 123.179 0.419 . . . . 61.34 114.121 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.528 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 27.0 m-85 -83.49 135.58 34.61 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.38 0.672 . . . . 74.22 110.052 174.777 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . 0.416 ' O ' HG23 ' A' ' 95' ' ' VAL . 15.5 m120 -91.71 168.31 11.57 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 123.814 0.846 . . . . 74.25 110.705 -177.172 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -59.43 -30.65 68.64 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 123.982 0.913 . . . . 63.32 111.254 175.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 54.8 p -65.84 -39.56 90.91 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.175 0.99 . . . . 61.52 111.103 177.209 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -72.17 -22.9 61.22 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.558 0.743 . . . . 74.24 111.241 178.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.416 HG23 ' O ' ' A' ' 91' ' ' ASN . 88.7 t -96.36 128.38 47.61 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 C-N-CA 124.193 0.997 . . . . 62.24 110.203 -175.442 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 9.0 t -128.36 141.09 51.53 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.08 0.552 . . . . 62.41 109.885 170.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.439 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 59.9 m95 -111.86 136.76 50.74 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.904 0.882 . . . . 64.44 109.847 178.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -143.11 87.4 1.97 Allowed 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.494 1.118 . . . . 72.14 108.076 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 72.45 -83.65 0.55 Allowed Glycine 0 C--N 1.348 1.24 0 CA-C-N 115.28 -0.873 . . . . 73.24 113.613 176.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 29.4 p-10 -126.66 -6.4 6.3 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.145 0.978 . . . . 72.33 111.745 -175.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 25.8 m -116.18 133.08 56.42 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.641 0.776 . . . . 74.32 109.202 -176.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . 0.567 HG11 HD13 ' A' ' 81' ' ' LEU . 4.8 p -115.39 123.05 70.52 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 C-N-CA 124.057 0.943 . . . . 74.51 108.947 176.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 61.0 m -107.08 114.83 29.14 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 108.633 -0.877 . . . . 44.3 108.633 176.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 49.1 t -109.11 110.73 33.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 C-N-CA 123.797 0.839 . . . . 43.13 108.786 175.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -95.56 111.95 23.77 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 107.971 -1.122 . . . . 52.32 107.971 173.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -118.72 177.73 16.5 Favored Glycine 0 C--O 1.24 0.526 0 O-C-N 123.801 0.688 . . . . 43.12 112.24 -176.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 . . . . . 0 C--O 1.243 0.721 0 C-N-CA 123.804 0.842 . . . . 75.42 108.946 177.418 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.2 tptp . . . . . 0 C--O 1.24 0.602 0 CA-C-O 120.694 0.283 . . . . 74.32 110.588 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -86.18 121.9 29.42 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 108.455 -0.943 . . . . 43.41 108.455 169.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.461 HG23 HG23 ' A' ' 62' ' ' VAL . 0.9 OUTLIER -113.17 137.62 45.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 C-N-CA 124.662 1.185 . . . . 74.11 108.108 177.795 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -104.25 112.11 25.0 Favored 'General case' 0 C--O 1.242 0.678 0 N-CA-C 108.181 -1.044 . . . . 75.31 108.181 171.295 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 62.3 t -96.16 106.08 17.88 Favored 'Isoleucine or valine' 0 C--N 1.345 0.373 0 C-N-CA 125.141 1.376 . . . . 72.43 107.98 -176.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -96.81 99.81 11.37 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 108.063 -1.088 . . . . 72.33 108.063 -172.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.8 t -99.15 112.0 30.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 124.115 0.966 . . . . 70.21 109.726 -174.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.486 ' HB3' ' HB3' ' A' ' 59' ' ' SER . 26.6 ttpp -118.56 103.85 10.11 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 107.874 -1.158 . . . . 72.14 107.874 177.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.441 HD13 HG13 ' A' ' 48' ' ' ILE . 14.6 tt -113.94 129.84 69.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 123.441 0.696 . . . . 74.24 110.319 -173.38 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 84.8 m -97.82 117.8 32.94 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 109.394 -0.595 . . . . 71.53 109.394 174.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.744 ' SG ' HG23 ' A' ' 48' ' ' ILE . 49.1 t -129.48 118.18 21.69 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.332 1.053 . . . . 52.12 109.171 -178.581 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.569 ' HB2' ' SG ' ' A' ' 53' ' ' CYS . 6.4 t-20 74.3 -1.28 3.12 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 125.341 1.456 . . . . 74.45 112.263 170.338 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 123.41 -6.02 9.27 Favored Glycine 0 C--N 1.351 1.368 0 CA-C-O 119.874 -0.404 . . . . 71.05 113.415 -178.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -108.5 147.38 31.79 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.398 0.679 . . . . 64.41 110.242 179.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 40.2 m -112.31 115.45 28.77 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.717 0.807 . . . . 72.1 110.057 -176.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -110.79 112.74 24.82 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.446 1.098 . . . . 74.24 109.066 -175.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -112.93 140.51 47.68 Favored 'General case' 0 N--CA 1.485 1.286 0 CA-C-N 118.329 0.513 . . . . 63.41 110.537 -179.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 17.3 tpt180 -161.23 120.46 2.54 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.357 0.663 . . . . 74.42 110.059 -175.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 61.8 m -89.27 116.32 27.4 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.551 0.74 . . . . 74.33 110.013 174.201 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -98.27 136.82 37.91 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.124 0.97 . . . . 71.14 108.764 176.138 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 25.6 mp0 -101.78 111.71 24.06 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 108.823 -0.806 . . . . 73.32 108.823 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.428 ' HB2' HG13 ' A' ' 6' ' ' VAL . 89.9 mt -112.52 161.09 17.15 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.061 0.944 . . . . 75.52 109.893 -179.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 86.1 t80 -151.95 129.38 11.36 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 108.752 -0.833 . . . . 72.41 108.752 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.546 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -150.89 146.21 26.15 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 122.611 0.364 . . . . 64.03 111.171 -179.311 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 48.6 t -65.66 -52.41 50.89 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 O-C-N 124.506 1.129 . . . . 74.15 109.802 175.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 -113.56 160.99 17.94 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 115.371 -0.832 . . . . 70.34 110.167 -177.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.475 ' HB2' HG13 ' A' ' 80' ' ' ILE . 21.6 p-10 -69.59 -28.42 65.94 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.489 0.715 . . . . 71.04 109.969 173.518 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -55.09 -39.44 69.3 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.398 1.079 . . . . 62.33 111.387 170.001 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.546 ' HB2' ' HB1' ' A' ' 27' ' ' ALA . 19.5 mm-40 -77.48 -20.86 53.71 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.271 -0.877 . . . . 73.01 111.677 -177.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.01 -27.86 64.0 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 122.682 0.393 . . . . 70.14 110.556 178.214 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 20.7 mtpp -54.14 -60.25 3.58 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.225 1.01 . . . . 64.44 112.823 -177.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -53.22 -33.96 55.1 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 124.392 1.077 . . . . 50.32 112.132 178.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 52.4 mttm -77.93 -37.43 47.77 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.643 0.777 . . . . 62.22 110.819 -175.182 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.558 HD13 HD23 ' A' ' 81' ' ' LEU . 93.7 mt -65.19 -40.6 94.44 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.445 0.698 . . . . 72.31 111.202 172.868 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 58.1 mtpt -59.69 -40.83 89.16 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.203 0.601 . . . . 74.45 110.637 174.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt -65.91 -53.05 44.55 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 123.562 0.539 . . . . 55.21 111.42 175.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 20.8 t -53.49 -45.15 58.0 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 C-N-CA 124.14 0.976 . . . . 63.44 112.134 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.573 HD21 HD11 ' A' ' 60' ' ' ILE . 97.2 mt -72.94 -51.28 19.06 Favored 'General case' 0 CA--C 1.54 0.577 0 O-C-N 123.58 0.55 . . . . 70.22 111.3 -178.479 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -67.1 -40.39 86.91 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 122.924 0.49 . . . . 73.22 112.006 -174.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -62.05 -43.27 99.19 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.576 0.35 . . . . 61.32 110.079 174.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.1 tpp180 -62.12 -41.99 98.78 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.531 0.732 . . . . 73.23 111.078 176.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.509 ' SD ' HD11 ' A' ' 58' ' ' ILE . 83.2 mtp -94.41 6.91 47.31 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 112.822 0.675 . . . . 74.2 112.822 -169.74 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -75.84 -48.82 3.62 Favored Pre-proline 0 CA--C 1.56 1.363 0 CA-C-O 118.741 -0.647 . . . . 43.33 110.444 168.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.464 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 31.4 Cg_exo -51.97 -37.76 67.99 Favored 'Trans proline' 0 C--N 1.396 3.057 0 C-N-CA 122.146 1.897 . . . . 72.21 112.72 166.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.744 HG23 ' SG ' ' A' ' 14' ' ' CYS . 50.6 mm -66.64 -30.47 49.82 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.35 0 C-N-CA 124.286 1.035 . . . . 74.14 111.528 -173.015 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -66.91 -45.28 78.43 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 123.399 0.679 . . . . 62.44 110.191 173.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.4 tmmm? -61.75 -34.74 76.39 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 114.695 -1.138 . . . . 65.14 111.193 176.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.539 HD12 HD13 ' A' ' 48' ' ' ILE . 85.3 mt -72.39 -29.03 63.37 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.192 0.597 . . . . 75.05 110.811 176.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 68.93 83.23 0.17 Allowed Glycine 0 C--N 1.353 1.498 0 O-C-N 123.976 0.798 . . . . 43.14 112.188 174.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.569 ' SG ' ' HB2' ' A' ' 15' ' ' ASN . 89.5 m -123.98 134.51 53.46 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.272 0.629 . . . . 44.31 110.701 -174.209 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -63.66 -65.5 0.67 Allowed 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.554 0.741 . . . . 72.11 110.156 177.075 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 31.9 ttt180 -127.99 126.94 42.33 Favored 'General case' 0 C--O 1.241 0.616 0 C-N-CA 124.019 0.928 . . . . 70.52 108.577 -176.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 34.0 m -115.91 140.54 37.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 C-N-CA 123.155 0.582 . . . . 42.23 109.664 179.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 24.4 ttm180 -105.96 106.89 17.61 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 108.417 -0.957 . . . . 72.02 108.417 177.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.509 HD11 ' SD ' ' A' ' 45' ' ' MET . 50.9 mt -93.9 114.0 29.7 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 N-CA-C 107.993 -1.114 . . . . 60.55 107.993 179.498 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.486 ' HB3' ' HB3' ' A' ' 11' ' ' LYS . 37.2 t -102.86 102.27 12.37 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.21 -1.033 . . . . 62.11 108.21 -177.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.573 HD11 HD21 ' A' ' 41' ' ' LEU . 78.9 mt -104.85 115.83 47.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 123.409 0.684 . . . . 73.15 109.555 -177.751 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -109.77 129.4 55.63 Favored 'General case' 0 C--O 1.238 0.471 0 N-CA-C 108.518 -0.919 . . . . 74.31 108.518 171.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.461 HG23 HG23 ' A' ' 6' ' ' VAL . 12.4 p -94.97 148.32 5.13 Favored 'Isoleucine or valine' 0 C--O 1.246 0.899 0 N-CA-C 108.293 -1.002 . . . . 63.11 108.293 177.106 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 24.2 ttmm -80.49 137.5 36.46 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 108.813 -0.81 . . . . 73.14 108.813 172.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 31.8 m170 -85.38 128.97 34.9 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.069 0.948 . . . . 74.42 110.446 -173.532 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 28.0 m -66.23 -65.79 0.63 Allowed 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.713 0.805 . . . . 71.55 111.061 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.458 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 29.6 t70 -162.53 151.98 15.66 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.758 0.823 . . . . 74.01 108.887 -178.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.78 -32.33 63.39 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 124.316 1.047 . . . . 42.3 113.282 -174.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.2 -41.9 89.53 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.054 0.541 . . . . 61.33 110.658 174.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -70.71 -50.03 40.73 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-N 115.157 -0.929 . . . . 74.22 111.592 -177.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.458 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 58.0 mt-10 -43.53 -34.56 1.41 Allowed 'General case' 0 N--CA 1.501 2.081 0 C-N-CA 126.026 1.73 . . . . 75.21 115.431 -163.503 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -65.44 -51.27 61.38 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.773 0.829 . . . . 73.25 110.77 -178.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -81.93 -29.93 32.04 Favored 'General case' 0 CA--C 1.552 1.054 0 CA-C-N 115.103 -0.953 . . . . 72.4 111.053 177.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -68.84 -39.08 80.13 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 124.509 1.124 . . . . 73.43 110.3 -173.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.08 -49.69 69.06 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 115.517 -0.765 . . . . 72.31 111.098 177.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -59.97 -40.57 89.51 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.424 1.09 . . . . 72.43 111.503 177.248 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 68.6 tttt -64.6 -50.59 66.6 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.26 1.424 . . . . 74.04 110.543 -179.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -75.28 -23.69 57.44 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 115.812 -0.631 . . . . 72.05 110.266 -177.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.61 -33.41 72.62 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.584 0.753 . . . . 51.34 110.784 174.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.8 -40.93 83.86 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.422 0.689 . . . . 63.11 110.829 173.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.475 HG13 ' HB2' ' A' ' 30' ' ' ASP . 46.2 mm -67.86 -41.82 85.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.023 0.929 . . . . 71.33 110.794 178.614 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.558 HD23 HD13 ' A' ' 37' ' ' LEU . 42.3 mt -63.96 -47.74 79.25 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.54 0.736 . . . . 64.23 109.533 176.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -55.84 -42.95 76.55 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 124.669 1.187 . . . . 53.3 111.337 -177.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.449 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 43.4 mmtm -67.2 -41.59 85.56 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 115.562 -0.745 . . . . 73.32 111.33 179.291 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.444 HG21 ' HB2' ' A' ' 37' ' ' LEU . 54.4 t -64.68 -40.72 90.02 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.119 0 C-N-CA 123.378 0.671 . . . . 73.4 110.301 -178.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.534 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 19.6 m-85 -64.95 -39.99 94.34 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.265 -0.88 . . . . 75.33 110.53 177.51 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -68.11 -24.33 65.02 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.199 0.6 . . . . 65.52 111.95 176.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.449 ' HG3' ' O ' ' A' ' 83' ' ' LYS . 45.9 mt-10 -80.95 -20.94 40.88 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.651 0.78 . . . . 73.42 111.018 178.08 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.1 mt -106.68 -22.71 12.66 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 122.968 0.507 . . . . 63.42 110.923 -173.571 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 103.54 39.97 2.47 Favored Glycine 0 C--N 1.351 1.403 0 C-N-CA 123.153 0.406 . . . . 62.1 114.054 177.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.534 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 10.1 m-85 -112.76 134.6 54.2 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 107.432 -1.322 . . . . 74.21 107.432 169.625 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 -83.61 158.37 21.93 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.447 0.699 . . . . 62.32 110.092 -175.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.79 -39.66 78.04 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 124.491 1.117 . . . . 73.4 111.539 177.509 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 22.6 t -60.57 -35.64 76.56 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 124.452 1.101 . . . . 73.54 111.761 178.237 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -65.3 -26.41 68.06 Favored 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 124.222 1.009 . . . . 74.25 111.977 178.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.508 HG22 HG13 ' A' ' 104' ' ' VAL . 47.1 t -90.91 117.88 35.04 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 124.219 1.007 . . . . 62.12 109.174 -177.51 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 20.7 m -134.65 106.78 7.13 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.598 0.759 . . . . 52.04 109.958 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 69.3 m95 -68.97 109.95 4.2 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 122.731 0.413 . . . . 70.24 110.167 176.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -107.73 96.92 6.73 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 107.993 -1.114 . . . . 74.0 107.993 177.532 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 68.37 -120.32 11.51 Favored Glycine 0 C--N 1.343 0.927 0 O-C-N 123.675 0.609 . . . . 52.12 112.415 -178.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -79.67 -32.55 41.5 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 124.663 1.185 . . . . 73.42 110.335 -178.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 20.2 m -105.84 148.8 27.14 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.946 0.899 . . . . 71.45 110.129 -169.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.9 p -104.06 136.49 37.03 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 CA-C-O 121.274 0.559 . . . . 62.45 110.012 177.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 27.6 m -103.67 100.02 9.83 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.467 1.507 . . . . 70.53 108.198 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.508 HG13 HG22 ' A' ' 95' ' ' VAL . 42.0 t -108.71 109.6 28.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 N-CA-C 108.23 -1.026 . . . . 62.43 108.23 -179.612 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -106.49 109.58 21.54 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 109.855 -0.424 . . . . 73.41 109.855 -176.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -115.12 137.41 13.91 Favored Glycine 0 C--N 1.333 0.373 0 N-CA-C 110.552 -1.019 . . . . 70.54 110.552 179.163 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 . . . . . 0 C--O 1.242 0.674 0 N-CA-C 108.823 -0.806 . . . . 74.21 108.823 173.028 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt . . . . . 0 C--O 1.239 0.523 0 N-CA-C 110.788 -0.078 . . . . 75.31 110.788 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 25.3 ttpt -88.49 98.61 11.73 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 107.062 -1.459 . . . . 51.34 107.062 163.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.546 HG23 HG23 ' A' ' 62' ' ' VAL . 0.2 OUTLIER -99.23 126.62 52.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 107.54 -1.282 . . . . 73.44 107.54 -179.745 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -102.25 113.8 27.4 Favored 'General case' 0 C--O 1.24 0.554 0 N-CA-C 108.29 -1.004 . . . . 72.34 108.29 179.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 64.0 t -100.67 109.18 24.68 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 C-N-CA 124.933 1.293 . . . . 74.01 108.658 -172.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.433 ' O ' ' HA ' ' A' ' 60' ' ' ILE . 41.7 mt-30 -96.45 98.17 10.03 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 107.7 -1.222 . . . . 44.2 107.7 -176.113 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 48.6 t -94.07 104.63 15.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 N-CA-C 108.525 -0.917 . . . . 70.5 108.525 -175.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.419 ' HE3' HG21 ' A' ' 18' ' ' THR . 1.7 tmtp? -111.98 102.82 11.03 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 107.573 -1.269 . . . . 62.24 107.573 -176.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.409 ' HA ' ' O ' ' A' ' 57' ' ' ARG . 8.7 tt -119.47 124.34 72.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 122.902 0.481 . . . . 75.23 110.451 -172.047 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 39.0 m -91.5 121.71 33.44 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.269 0.628 . . . . 51.51 109.493 178.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.662 ' SG ' HG23 ' A' ' 48' ' ' ILE . 1.3 t -158.43 143.13 16.13 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.709 1.204 . . . . 53.52 109.878 -177.543 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.401 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 63.3 t30 62.44 25.32 15.1 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 124.182 0.993 . . . . 71.02 111.526 172.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 85.86 -8.19 73.95 Favored Glycine 0 C--N 1.345 1.054 0 CA-C-N 115.766 -0.652 . . . . 73.24 113.498 179.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -108.66 169.51 8.61 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.677 0.791 . . . . 75.14 110.738 -179.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.419 HG21 ' HE3' ' A' ' 11' ' ' LYS . 87.0 m -115.03 123.96 50.4 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 114.905 -1.043 . . . . 62.14 108.771 171.298 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -110.28 100.77 9.59 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 107.718 -1.216 . . . . 50.33 107.718 178.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.7 pp20? -106.27 146.39 30.42 Favored 'General case' 0 C--O 1.242 0.704 0 N-CA-C 108.982 -0.747 . . . . 72.1 108.982 177.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.1 tpt180 -157.21 124.64 5.27 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 123.305 0.378 . . . . 53.14 110.204 174.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 44.0 m -89.17 109.57 20.42 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 108.962 -0.755 . . . . 75.45 108.962 173.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -98.01 135.79 39.21 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 108.814 -0.81 . . . . 54.42 108.814 178.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -97.12 108.69 21.47 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 107.732 -1.21 . . . . 74.04 107.732 175.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 94.7 mt -115.24 137.83 51.6 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 108.233 -1.025 . . . . 52.34 108.233 -178.291 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -132.18 132.55 43.28 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 109.334 -0.617 . . . . 73.21 109.334 -175.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -156.27 149.86 24.76 Favored 'General case' 0 C--O 1.239 0.509 0 C-N-CA 123.323 0.649 . . . . 61.43 109.626 173.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 51.7 t -63.41 -37.69 80.2 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 C-N-CA 124.215 1.006 . . . . 71.23 109.869 174.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 53.4 mtt180 -130.12 145.31 51.69 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.442 0.697 . . . . 74.32 110.848 175.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 35.2 p-10 -69.53 -23.26 63.56 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.063 0.945 . . . . 73.0 111.333 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -59.26 -37.75 78.4 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.224 0.61 . . . . 73.33 110.731 170.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -81.94 -22.24 36.81 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.486 0.715 . . . . 75.44 111.348 179.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.576 HD22 ' HD2' ' A' ' 36' ' ' LYS . 0.7 OUTLIER -70.4 -22.55 62.73 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.411 1.084 . . . . 75.44 110.265 178.189 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.568 ' HG2' HG23 ' A' ' 80' ' ' ILE . 50.1 mtpt -52.79 -53.59 46.13 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 124.004 0.922 . . . . 64.41 113.168 -178.495 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -61.1 -30.14 70.18 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 123.41 0.444 . . . . 63.24 111.717 -177.017 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.576 ' HD2' HD22 ' A' ' 33' ' ' LEU . 58.0 mttm -67.58 -45.35 75.78 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 123.503 0.502 . . . . 51.32 110.355 174.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.438 HD13 HD23 ' A' ' 81' ' ' LEU . 95.8 mt -58.63 -44.77 90.12 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.735 0.814 . . . . 74.12 111.439 177.124 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.525 ' HG2' HG13 ' A' ' 84' ' ' VAL . 51.2 mtpt -61.25 -47.45 86.0 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 123.764 0.665 . . . . 75.41 111.044 -178.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -62.42 -52.46 63.48 Favored 'General case' 0 N--CA 1.476 0.83 0 O-C-N 123.607 0.567 . . . . 64.44 110.982 178.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 22.4 t -58.0 -42.18 82.08 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 C-N-CA 124.894 1.278 . . . . 72.0 112.52 -178.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.454 HD21 HD11 ' A' ' 60' ' ' ILE . 39.4 mt -70.35 -37.75 74.7 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.341 0.657 . . . . 61.32 110.965 179.688 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -68.06 -35.76 78.73 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 119.426 -0.321 . . . . 55.34 111.473 175.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -72.93 -45.29 58.93 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.373 0.669 . . . . 73.34 110.818 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.7 tpm_? -60.25 -41.39 93.11 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.86 0.864 . . . . 73.24 110.235 176.022 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.436 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 64.4 mtp -92.67 2.81 56.52 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 115.64 -0.709 . . . . 61.41 112.821 -178.222 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -65.47 -49.57 62.11 Favored Pre-proline 0 CA--C 1.553 1.07 0 CA-C-O 118.603 -0.713 . . . . 71.53 111.404 178.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.49 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 37.9 Cg_endo -63.69 -27.42 68.66 Favored 'Trans proline' 0 C--N 1.389 2.699 0 C-N-CA 121.391 1.394 . . . . 55.22 111.756 172.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.662 HG23 ' SG ' ' A' ' 14' ' ' CYS . 45.0 mm -74.19 -34.06 36.7 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.02 0 C-N-CA 124.149 0.979 . . . . 72.43 110.729 -173.534 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.436 ' HG3' ' O ' ' A' ' 45' ' ' MET . 93.0 mttt -73.9 -31.36 63.07 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.276 0.63 . . . . 73.5 110.086 176.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.8 tmmm? -76.14 -29.06 57.66 Favored 'General case' 0 CA--C 1.548 0.903 0 CA-C-N 115.108 -0.951 . . . . 73.31 109.654 175.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 92.1 mt -71.89 -32.28 67.26 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 109.08 -0.711 . . . . 54.22 109.08 173.805 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.38 40.32 33.57 Favored Glycine 0 C--N 1.349 1.253 0 CA-C-N 115.834 -0.621 . . . . 72.42 112.369 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.401 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 68.5 m -71.44 97.11 1.58 Allowed 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 109.415 -0.587 . . . . 73.34 109.415 174.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -50.9 -39.7 55.03 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 125.792 1.637 . . . . 73.41 112.539 -169.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 9.5 ttp180 -134.21 130.76 37.68 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 107.796 -1.187 . . . . 53.21 107.796 179.154 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 23.0 m -124.86 145.19 32.55 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 C-N-CA 122.897 0.479 . . . . 71.44 110.669 -178.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.512 ' HG3' HG23 ' A' ' 103' ' ' THR . 21.1 ttt180 -104.39 108.55 20.02 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 108.237 -1.024 . . . . 74.43 108.237 170.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 37.7 mt -101.62 104.25 16.08 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 N-CA-C 108.253 -1.017 . . . . 74.22 108.253 176.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 70.3 m -101.91 103.48 14.15 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 107.839 -1.171 . . . . 75.12 107.839 177.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.454 HD11 HD21 ' A' ' 41' ' ' LEU . 61.5 mt -98.93 130.25 48.09 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 123.258 0.623 . . . . 70.23 109.83 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 27.8 ttm-85 -115.92 120.04 37.89 Favored 'General case' 0 C--O 1.239 0.506 0 N-CA-C 107.726 -1.212 . . . . 70.01 107.726 174.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.546 HG23 HG23 ' A' ' 6' ' ' VAL . 7.6 p -94.73 139.09 19.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 N-CA-C 108.636 -0.875 . . . . 61.52 108.636 -178.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -81.08 121.56 26.24 Favored 'General case' 0 C--O 1.24 0.596 0 N-CA-C 108.904 -0.776 . . . . 72.13 108.904 -177.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -95.19 149.99 20.7 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.626 0.77 . . . . 71.02 110.35 -176.363 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 23.5 m -77.32 -44.41 29.66 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.2 1.0 . . . . 71.23 111.455 -178.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -156.39 158.0 36.59 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.189 0.596 . . . . 72.43 110.473 -174.08 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.52 -44.15 89.44 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 124.599 1.16 . . . . 74.33 112.984 -176.353 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -75.6 -22.26 57.07 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 122.9 0.48 . . . . 72.13 110.892 178.085 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -84.6 -17.38 38.92 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 118.894 -0.574 . . . . 74.24 112.034 178.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -57.35 -44.01 83.94 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.096 0.558 . . . . 63.43 111.785 -179.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.75 -33.98 76.28 Favored 'General case' 0 N--CA 1.479 1.018 0 O-C-N 124.001 0.813 . . . . 73.23 111.17 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -70.55 -59.42 2.85 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 109.524 -0.547 . . . . 51.31 109.524 176.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -63.4 -30.21 71.37 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.055 1.342 . . . . 64.12 112.784 -173.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.34 -55.63 15.02 Favored 'General case' 0 C--O 1.213 -0.841 0 N-CA-C 109.313 -0.625 . . . . 73.32 109.313 179.041 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 5.5 tmtm? -62.24 -43.8 98.0 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 125.241 1.416 . . . . 64.24 110.711 179.265 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 60.3 tttm -64.1 -55.44 21.97 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.427 1.491 . . . . 73.45 111.637 -175.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -75.04 -19.12 60.18 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 115.207 -0.906 . . . . 42.32 110.603 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.15 -43.18 99.03 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 122.887 0.475 . . . . 73.44 110.89 172.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.463 ' O ' ' HG2' ' A' ' 83' ' ' LYS . . . -60.1 -41.92 93.58 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 124.0 0.812 . . . . 60.2 110.482 176.22 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.568 HG23 ' HG2' ' A' ' 34' ' ' LYS . 42.8 mm -63.09 -50.64 78.58 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 124.385 1.074 . . . . 64.32 111.604 178.549 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.438 HD23 HD13 ' A' ' 37' ' ' LEU . 34.1 mt -64.35 -43.36 94.8 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.279 0.632 . . . . 72.32 110.315 -179.198 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 60.8 t30 -59.5 -40.08 85.91 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 124.505 1.122 . . . . 73.5 110.854 -177.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.463 ' HG2' ' O ' ' A' ' 79' ' ' ALA . 74.7 mmtt -69.26 -41.86 76.36 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 115.588 -0.733 . . . . 73.14 111.213 176.237 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.55 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 37.4 t -62.11 -50.64 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 123.343 0.657 . . . . 72.24 109.884 -178.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.471 ' CE2' HG21 ' A' ' 104' ' ' VAL . 28.3 m-85 -61.28 -36.19 79.37 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.099 0.96 . . . . 72.41 111.544 178.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.83 -31.91 73.01 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.426 0.691 . . . . 73.42 111.449 175.242 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -85.39 -12.86 51.1 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.139 0.976 . . . . 65.21 111.117 178.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 54.6 mt -98.69 0.24 44.23 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 122.783 0.433 . . . . 75.55 110.11 -178.535 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 96.13 -1.62 62.97 Favored Glycine 0 C--N 1.35 1.355 0 O-C-N 123.443 0.464 . . . . 35.42 113.374 177.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -82.25 140.34 33.71 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 109.603 -0.517 . . . . 72.15 109.603 178.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -70.36 147.33 49.71 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.062 0.545 . . . . 72.31 110.093 178.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -50.67 -55.99 13.97 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 125.288 1.435 . . . . 73.41 111.515 178.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 11.6 t -59.37 -19.92 50.67 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 124.287 1.035 . . . . 72.14 113.543 -174.035 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -74.09 -19.07 60.71 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.104 0.561 . . . . 72.14 112.139 -179.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.502 ' HA ' HG22 ' A' ' 104' ' ' VAL . 49.0 t -74.29 101.2 1.69 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 N-CA-C 107.058 -1.46 . . . . 75.01 107.058 175.62 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 8.1 m -111.43 94.16 4.83 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 109.496 -0.557 . . . . 65.24 109.496 -172.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 65.7 m95 -72.04 107.43 4.74 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 109.003 -0.74 . . . . 73.23 109.003 174.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -101.63 75.57 1.59 Allowed 'General case' 0 C--O 1.238 0.478 0 C-N-CA 124.556 1.143 . . . . 74.42 108.402 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 64.9 -88.14 0.08 OUTLIER Glycine 0 C--N 1.346 1.092 0 CA-C-N 114.988 -1.005 . . . . 72.01 112.789 -178.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -82.97 -61.3 1.9 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.461 1.105 . . . . 34.11 109.779 -178.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 11.5 m -102.5 144.26 31.17 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 114.947 -1.024 . . . . 55.1 110.302 -167.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 6.3 p -103.44 120.05 52.87 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 C-N-CA 123.032 0.533 . . . . 74.41 110.255 -178.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.512 HG23 ' HG3' ' A' ' 57' ' ' ARG . 52.5 m -99.72 110.61 23.0 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.453 1.101 . . . . 73.33 108.812 177.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.502 HG22 ' HA ' ' A' ' 95' ' ' VAL . 46.2 t -112.41 112.66 41.43 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 124.266 1.026 . . . . 64.41 108.381 -176.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -92.38 114.34 26.87 Favored 'General case' 0 C--O 1.24 0.599 0 N-CA-C 109.206 -0.664 . . . . 73.24 109.206 -179.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -107.79 137.96 14.32 Favored Glycine 0 C--N 1.342 0.872 0 CA-C-N 115.972 -0.558 . . . . 64.42 112.981 -176.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 23.6 tm0? . . . . . 0 N--CA 1.471 0.588 0 N-CA-C 107.98 -1.118 . . . . 73.23 107.98 171.364 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.4 tmtm? . . . . . 0 C--O 1.243 0.716 0 N-CA-C 107.18 -1.415 . . . . 74.2 107.18 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -71.96 101.39 2.68 Favored 'General case' 0 C--N 1.351 0.657 0 CA-C-O 121.192 0.52 . . . . 52.1 109.612 178.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.3 p -100.35 150.23 5.64 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 124.129 0.972 . . . . 75.24 109.805 -178.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -100.5 113.61 26.53 Favored 'General case' 0 C--O 1.239 0.536 0 N-CA-C 108.463 -0.94 . . . . 71.34 108.463 172.101 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.413 HG21 HD12 ' A' ' 25' ' ' LEU . 88.8 t -101.39 107.49 21.54 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 124.833 1.253 . . . . 43.1 108.688 -177.21 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -94.93 101.08 12.83 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 107.862 -1.162 . . . . 75.21 107.862 -177.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 92.2 t -96.14 111.07 25.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 N-CA-C 108.907 -0.775 . . . . 51.52 108.907 -177.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.3 ttmm -107.49 102.92 12.15 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.265 1.026 . . . . 44.13 108.329 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.418 HD11 HG21 ' A' ' 48' ' ' ILE . 15.2 tt -111.11 121.52 63.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 CA-C-O 121.3 0.571 . . . . 70.31 110.515 -177.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 30.2 m -95.16 119.78 34.25 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.031 0.933 . . . . 73.21 109.364 178.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.675 ' SG ' HG23 ' A' ' 48' ' ' ILE . 21.7 t -150.72 134.98 16.97 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.926 1.29 . . . . 64.44 108.835 -175.405 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.572 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 4.0 t30 65.56 29.87 10.85 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 125.014 1.326 . . . . 73.23 110.473 177.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.19 0.03 75.63 Favored Glycine 0 C--N 1.353 1.52 0 CA-C-N 115.487 -0.779 . . . . 74.24 113.879 -178.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -112.71 164.54 13.24 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.918 0.887 . . . . 74.4 110.645 -177.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 82.3 m -115.84 119.86 37.37 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.569 0.748 . . . . 62.45 110.487 176.581 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -109.93 120.75 43.45 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 107.115 -1.439 . . . . 73.33 107.115 176.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -143.36 156.46 44.69 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 118.433 0.56 . . . . 74.31 111.994 -177.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 39.3 ttp180 -166.49 134.9 2.85 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-N 114.9 -1.045 . . . . 73.22 108.721 -174.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 57.4 m -91.62 118.6 30.77 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.729 0.812 . . . . 73.11 109.813 178.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 67.7 m-85 -100.41 137.57 38.65 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.203 1.001 . . . . 73.01 109.041 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -100.18 107.89 19.87 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 106.776 -1.565 . . . . 73.12 106.776 173.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.413 HD12 HG21 ' A' ' 8' ' ' VAL . 67.3 mt -111.23 98.28 7.39 Favored 'General case' 0 C--O 1.239 0.513 0 C-N-CA 123.514 0.726 . . . . 65.51 109.304 -175.225 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 68.5 t80 -92.36 140.59 29.44 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 115.568 -0.742 . . . . 73.11 109.464 172.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.553 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -141.5 171.62 13.81 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.883 0.873 . . . . 71.32 109.498 178.078 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 48.1 t -101.81 -28.65 3.14 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 C-N-CA 123.255 0.622 . . . . 73.04 109.455 173.349 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.587 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 95.2 mtt180 -130.86 174.24 10.17 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.941 0.897 . . . . 74.11 109.745 176.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.454 ' HB3' ' HE3' ' A' ' 76' ' ' LYS . 14.0 p-10 -72.46 -39.18 67.95 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.549 0.74 . . . . 74.34 109.91 173.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -64.11 -26.72 68.66 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.089 0.956 . . . . 72.44 111.455 -178.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.587 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 38.2 mm-40 -67.84 -32.74 73.48 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.642 0.777 . . . . 71.43 111.293 178.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.404 ' HA ' ' HD2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -67.67 -20.08 65.26 Favored 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 123.759 0.824 . . . . 64.01 110.689 -177.391 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.434 ' HE2' ' HB3' ' A' ' 34' ' ' LYS . 36.2 mtpt -56.83 -61.22 2.59 Favored 'General case' 0 C--N 1.362 1.15 0 C-N-CA 123.2 0.6 . . . . 64.13 112.344 179.577 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -57.46 -31.84 66.34 Favored 'General case' 0 N--CA 1.481 1.122 0 O-C-N 124.0 0.812 . . . . 55.41 111.657 -176.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.404 ' HD2' ' HA ' ' A' ' 33' ' ' LEU . 65.9 mttm -67.13 -47.31 71.47 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.907 0.883 . . . . 75.54 110.29 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.533 HD13 HD23 ' A' ' 81' ' ' LEU . 97.2 mt -63.9 -48.17 77.68 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.72 0.808 . . . . 70.43 111.916 177.242 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -60.25 -41.14 92.56 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.605 0.762 . . . . 73.21 111.514 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.426 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 30.2 mmmt -66.93 -51.89 49.7 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 122.611 0.365 . . . . 64.24 111.195 175.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 20.6 t -56.02 -44.11 77.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 C-N-CA 123.381 0.672 . . . . 70.12 111.578 -179.078 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 82.4 mt -69.69 -52.62 24.06 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.051 0.541 . . . . 75.02 110.993 -179.009 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -63.97 -42.74 97.15 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 113.196 0.813 . . . . 71.3 113.196 -177.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 23.2 mm-40 -67.44 -46.14 73.97 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 122.223 0.209 . . . . 72.43 110.59 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 36.1 tpt85 -70.08 -35.15 73.98 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 122.647 0.379 . . . . 65.25 111.518 -176.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.42 ' SD ' HD11 ' A' ' 58' ' ' ILE . 60.4 mtp -86.93 -7.79 57.85 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 113.11 0.782 . . . . 71.2 113.11 -176.342 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.4 ' HA ' ' HD3' ' A' ' 49' ' ' LYS . 24.2 t70 -61.49 -48.13 91.43 Favored Pre-proline 0 CA--C 1.569 1.683 0 CA-C-O 118.843 -0.599 . . . . 60.13 111.608 177.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -68.92 -19.17 40.55 Favored 'Trans proline' 0 C--N 1.391 2.811 0 C-N-CA 122.182 1.922 . . . . 71.35 113.554 170.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.675 HG23 ' SG ' ' A' ' 14' ' ' CYS . 46.8 mm -74.68 -34.29 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 C-N-CA 123.624 0.77 . . . . 71.13 110.466 177.135 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.4 ' HD3' ' HA ' ' A' ' 46' ' ' ASP . 5.2 mtpm? -72.85 -32.71 65.65 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.924 0.889 . . . . 71.44 109.626 173.359 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.34 -27.72 68.79 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.549 1.14 . . . . 73.13 110.718 172.641 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.521 HD12 ' SG ' ' A' ' 14' ' ' CYS . 68.3 mt -76.18 -35.09 59.29 Favored 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 109.712 -0.477 . . . . 75.01 109.712 171.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 79.11 35.95 29.07 Favored Glycine 0 C--N 1.345 1.069 0 O-C-N 123.822 0.701 . . . . 22.54 112.374 177.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.572 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 80.8 m -69.99 99.3 1.41 Allowed 'General case' 0 C--N 1.345 0.411 0 N-CA-C 109.285 -0.635 . . . . 61.2 109.285 176.614 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 44.0 mtmt -55.16 -32.84 62.44 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.954 1.301 . . . . 64.12 112.203 -169.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -125.28 136.63 53.71 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 108.01 -1.107 . . . . 74.24 108.01 168.011 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.426 ' O ' ' HA ' ' A' ' 105' ' ' GLU . 17.1 m -121.16 134.89 63.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 123.603 0.761 . . . . 44.24 109.058 174.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -100.55 107.53 19.23 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 108.716 -0.846 . . . . 74.31 108.716 172.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.42 HD11 ' SD ' ' A' ' 45' ' ' MET . 35.7 mt -104.18 103.42 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 N-CA-C 108.904 -0.776 . . . . 71.5 108.904 177.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 51.4 m -99.91 102.73 14.21 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 108.3 -1.0 . . . . 72.42 108.3 176.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 73.8 mt -97.24 109.54 23.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 C-N-CA 124.021 0.928 . . . . 75.51 108.73 179.242 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -92.07 134.7 34.59 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 107.952 -1.129 . . . . 73.15 107.952 171.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.8 p -94.02 146.96 5.94 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 N-CA-C 106.813 -1.551 . . . . 55.54 106.813 174.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.5 tmtm? -80.43 125.29 29.74 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 107.934 -1.135 . . . . 63.51 107.934 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 14.7 m170 -92.21 106.09 18.17 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 114.874 -1.057 . . . . 54.21 108.312 -178.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 13.6 p -63.85 -43.7 95.35 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.084 0.954 . . . . 73.53 111.35 -178.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -163.83 157.26 18.65 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.551 1.141 . . . . 74.2 108.766 -179.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.43 -26.77 68.08 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.553 0.741 . . . . 74.24 112.844 -174.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -86.38 -45.84 10.82 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.406 0.682 . . . . 64.34 110.44 176.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -68.66 -29.36 67.82 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.838 0.855 . . . . 74.24 112.095 -173.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -67.06 -27.27 67.24 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.412 0.685 . . . . 74.41 111.071 -177.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 71.0 mmtt -67.61 -33.09 74.29 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.82 0.448 . . . . 73.41 109.91 -177.14 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -74.16 -58.08 3.53 Favored 'General case' 0 C--N 1.347 0.469 0 CA-C-N 115.674 -0.694 . . . . 54.34 109.74 172.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 48.9 mm-40 -67.06 -31.42 71.91 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 113.735 1.013 . . . . 63.22 113.735 -167.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -78.85 -42.49 27.39 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 118.082 0.401 . . . . 33.13 110.949 -177.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 53.8 tptt -68.74 -38.63 80.28 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.61 0.764 . . . . 74.52 111.128 177.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.454 ' HE3' ' HB3' ' A' ' 30' ' ' ASP . 76.6 tttt -59.18 -50.04 75.56 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 125.483 1.513 . . . . 55.13 110.387 172.51 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -70.12 -29.08 65.93 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 114.934 -1.03 . . . . 74.03 110.48 -177.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.87 -43.71 87.54 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.925 0.89 . . . . 41.14 110.521 178.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.82 -41.95 99.53 Favored 'General case' 0 C--N 1.354 0.798 0 O-C-N 123.987 0.805 . . . . 31.43 110.903 176.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.402 HG22 HD12 ' A' ' 37' ' ' LEU . 50.0 mm -62.78 -41.83 93.95 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 C-N-CA 123.66 0.784 . . . . 45.13 110.894 175.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.533 HD23 HD13 ' A' ' 37' ' ' LEU . 47.1 mt -64.76 -37.92 89.23 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.764 0.826 . . . . 75.14 110.921 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -57.25 -45.14 84.25 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.771 0.828 . . . . 72.31 110.49 178.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 9.7 mmpt? -66.97 -41.26 87.13 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 114.892 -1.049 . . . . 64.44 110.495 -178.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.494 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 54.6 t -65.69 -56.71 13.82 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 C-N-CA 124.071 0.949 . . . . 63.21 110.571 -177.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.518 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 22.0 m-85 -60.13 -38.1 82.05 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 124.098 0.959 . . . . 64.45 111.569 -177.345 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.74 -30.04 71.18 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.577 0.751 . . . . 71.14 111.835 177.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -87.59 -9.03 55.5 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.491 0.716 . . . . 62.21 111.949 177.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 59.8 mt -105.0 -15.32 15.14 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 122.724 0.409 . . . . 62.32 110.543 -178.695 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 95.11 13.83 51.07 Favored Glycine 0 C--N 1.348 1.213 0 CA-C-N 116.257 -0.429 . . . . 54.11 113.484 178.535 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.518 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 14.3 m-85 -87.5 124.32 33.34 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 108.518 -0.919 . . . . 61.32 108.518 173.699 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 38.6 t-20 -81.87 146.84 29.63 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.708 0.803 . . . . 74.22 110.008 -171.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -53.15 -36.15 60.53 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 125.257 1.423 . . . . 75.2 111.425 173.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 17.2 m -57.15 -21.23 31.24 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 124.706 1.202 . . . . 75.43 113.378 178.572 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -105.89 -10.48 16.63 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.425 1.09 . . . . 70.54 111.896 -173.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.404 HG13 HG22 ' A' ' 104' ' ' VAL . 60.9 t -87.43 103.43 13.37 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 C-N-CA 123.628 0.771 . . . . 74.5 109.696 -175.196 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 30.8 m -108.89 115.49 30.18 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.015 0.926 . . . . 64.14 110.798 -172.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 55.5 m95 -97.81 144.1 27.76 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.007 0.523 . . . . 73.32 111.314 177.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -132.41 66.54 1.55 Allowed 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 108.172 -1.047 . . . . 73.32 108.172 170.033 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 42.06 22.7 0.12 Allowed Glycine 0 N--CA 1.488 2.135 0 N-CA-C 118.023 1.969 . . . . 61.42 118.023 174.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -175.04 -52.73 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.418 0 CA-C-N 118.148 0.974 . . . . 64.35 110.615 -168.149 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 52.7 m -117.58 151.8 36.42 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.393 1.077 . . . . 73.15 109.483 -177.402 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 6.5 p -126.05 113.47 34.31 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.198 0 C-N-CA 123.275 0.63 . . . . 74.04 111.074 176.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 53.6 m -92.8 101.21 13.59 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.693 1.197 . . . . 75.35 109.082 175.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.479 HG21 ' CE2' ' A' ' 85' ' ' PHE . 55.8 t -104.9 112.33 38.09 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 C-N-CA 124.623 1.169 . . . . 74.44 108.419 177.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . 0.426 ' HA ' ' O ' ' A' ' 56' ' ' VAL . 47.4 mt-10 -96.12 156.67 16.24 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.048 -0.723 . . . . 75.22 109.048 175.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -154.05 142.37 9.06 Favored Glycine 0 C--O 1.241 0.541 0 C-N-CA 121.387 -0.435 . . . . 72.24 112.332 176.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 23.0 tp60 . . . . . 0 C--N 1.351 0.644 0 N-CA-C 106.897 -1.52 . . . . 64.33 106.897 171.525 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.807 0 CA-C-O 121.172 0.51 . . . . 74.42 110.674 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -97.06 101.95 13.63 Favored 'General case' 0 C--O 1.239 0.513 0 N-CA-C 106.659 -1.608 . . . . 75.11 106.659 167.168 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.2 p -100.23 134.42 39.93 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 C-N-CA 124.148 0.979 . . . . 63.21 108.642 -178.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.443 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 34.6 mt-10 -106.29 113.51 27.08 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 108.058 -1.09 . . . . 74.52 108.058 175.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 77.6 t -97.25 107.74 20.46 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 114.827 -1.079 . . . . 65.34 108.331 -176.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -94.52 99.75 11.85 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 107.26 -1.385 . . . . 74.12 107.26 -177.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 97.2 t -94.56 103.31 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 N-CA-C 108.113 -1.069 . . . . 74.12 108.113 -177.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.442 ' HG3' ' HB3' ' A' ' 20' ' ' GLU . 34.7 ttmt -115.0 101.21 8.79 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 107.732 -1.21 . . . . 75.24 107.732 -176.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.445 HD13 HG13 ' A' ' 48' ' ' ILE . 11.3 tt -116.24 125.95 73.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 C-N-CA 123.376 0.67 . . . . 74.53 110.373 -169.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 55.5 m -92.07 122.47 34.61 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 109.944 -0.391 . . . . 72.42 109.944 176.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.523 ' SG ' HG23 ' A' ' 48' ' ' ILE . 14.6 t -155.86 147.99 23.45 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.462 1.505 . . . . 52.44 108.644 -178.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.448 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 11.6 t30 67.17 18.51 10.39 Favored 'General case' 0 N--CA 1.499 1.994 0 CA-C-O 121.791 0.805 . . . . 54.03 110.682 174.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.5 7.11 88.73 Favored Glycine 0 C--N 1.358 1.772 0 CA-C-N 115.495 -0.775 . . . . 73.14 113.586 -176.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.9 mtpm? -124.98 169.2 12.34 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.114 0.965 . . . . 72.24 110.397 -178.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.4 m -120.05 115.0 22.84 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 109.923 -0.399 . . . . 72.34 109.923 -178.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.409 ' HB3' ' NH2' ' A' ' 44' ' ' ARG . 61.9 m-85 -104.45 102.97 12.6 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.717 1.207 . . . . 75.33 108.996 -175.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.442 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -105.57 161.25 14.53 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 122.84 0.456 . . . . 75.44 111.282 -179.261 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 20.2 ttt180 -169.15 130.11 1.13 Allowed 'General case' 0 N--CA 1.477 0.888 0 O-C-N 123.893 0.746 . . . . 72.04 109.778 174.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 26.0 m -93.16 111.82 23.57 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.006 0.923 . . . . 74.22 109.692 178.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.428 ' O ' ' HA ' ' A' ' 7' ' ' GLU . 87.5 m-85 -98.69 122.49 41.98 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.646 0.778 . . . . 74.14 110.363 -177.394 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 24.9 mp0 -88.69 111.07 21.52 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 107.972 -1.122 . . . . 72.24 107.972 174.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.532 HD11 HG21 ' A' ' 40' ' ' VAL . 80.9 mt -124.77 119.26 28.39 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.215 1.006 . . . . 75.04 108.459 -177.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 87.2 t80 -113.74 138.87 49.64 Favored 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 109.751 -0.462 . . . . 53.35 109.751 179.139 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -156.7 149.79 24.04 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.125 0.57 . . . . 73.24 110.187 175.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 26.7 t -68.48 -26.94 34.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 124.627 1.171 . . . . 64.13 110.417 175.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.543 ' HB3' ' HG2' ' A' ' 31' ' ' GLU . 74.4 mtt180 -135.35 137.71 42.65 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.111 0.964 . . . . 71.33 110.017 178.254 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -71.82 -17.78 62.13 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 123.269 0.628 . . . . 63.2 111.717 176.385 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.543 ' HG2' ' HB3' ' A' ' 29' ' ' ARG . 13.5 pt-20 -70.74 -27.68 64.14 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 122.621 0.368 . . . . 73.23 110.876 172.116 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.474 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 31.5 mm-40 -83.47 -23.04 32.39 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.22 0.608 . . . . 74.2 110.476 177.323 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.01 -21.29 65.95 Favored 'General case' 0 CA--C 1.56 1.364 0 C-N-CA 124.168 0.987 . . . . 71.34 110.106 178.031 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -48.29 -56.56 7.73 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 124.289 1.036 . . . . 74.12 112.505 178.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.419 ' HA ' ' HD3' ' A' ' 38' ' ' LYS . 1.9 pp20? -60.33 -31.87 70.71 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.215 0.606 . . . . 74.33 112.08 -176.711 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -70.59 -40.6 73.14 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.378 0.671 . . . . 73.34 110.59 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.47 HD13 HD23 ' A' ' 81' ' ' LEU . 77.6 mt -63.33 -33.65 75.99 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.717 0.807 . . . . 71.02 111.067 174.625 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.531 ' HA ' HD11 ' A' ' 88' ' ' LEU . 57.3 mtpt -65.3 -41.85 93.67 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.383 0.673 . . . . 63.41 110.93 175.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.405 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 42.7 mmtm -61.5 -51.51 68.35 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 109.392 -0.596 . . . . 74.4 109.392 175.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.532 HG21 HD11 ' A' ' 25' ' ' LEU . 38.7 t -54.05 -50.86 51.47 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 C-N-CA 124.781 1.232 . . . . 71.43 111.863 -178.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 80.1 mt -67.41 -51.53 50.65 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.165 0.586 . . . . 53.33 111.534 -177.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -66.1 -38.9 89.37 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.088 0.555 . . . . 71.44 112.296 -174.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -70.72 -42.54 70.46 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.022 0.529 . . . . 72.31 110.736 176.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.409 ' NH2' ' HB3' ' A' ' 19' ' ' TYR . 18.6 tpt180 -69.93 -34.49 73.53 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 122.658 0.383 . . . . 72.13 111.743 -178.23 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 62.0 mtp -91.88 -8.24 46.98 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.532 0.567 . . . . 73.03 112.532 -177.141 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -59.05 -49.29 94.04 Favored Pre-proline 0 CA--C 1.569 1.674 0 CA-C-O 118.9 -0.572 . . . . 73.34 111.673 174.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -67.54 -25.53 40.99 Favored 'Trans proline' 0 C--N 1.394 2.967 0 C-N-CA 122.035 1.824 . . . . 61.01 112.571 174.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.523 HG23 ' SG ' ' A' ' 14' ' ' CYS . 50.9 mm -72.64 -33.89 45.96 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.114 0 C-N-CA 124.169 0.988 . . . . 70.22 110.918 -177.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -71.09 -31.98 68.5 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.753 0.821 . . . . 75.02 110.073 176.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.7 tmmm? -71.7 -33.11 68.51 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 115.112 -0.949 . . . . 71.5 110.699 172.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 91.2 mt -69.43 -30.68 68.66 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 109.345 -0.613 . . . . 73.55 109.345 177.009 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 93.28 19.19 36.52 Favored Glycine 0 C--N 1.345 1.067 0 CA-C-N 115.446 -0.797 . . . . 75.4 113.787 172.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.448 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 71.6 m -71.35 102.82 2.7 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.837 0.319 . . . . 73.14 111.055 -177.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -55.67 -56.62 18.31 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.87 1.268 . . . . 72.34 110.016 176.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 14.1 tpp85 -103.23 125.54 49.95 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 114.781 -1.1 . . . . 73.34 109.366 176.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 26.8 m -122.09 142.97 36.31 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.03 0.932 . . . . 74.11 109.212 172.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.3 ttm105 -111.17 106.11 15.02 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 108.006 -1.109 . . . . 63.32 108.006 172.174 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 24.5 mt -101.57 112.46 34.7 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 N-CA-C 108.203 -1.036 . . . . 73.22 108.203 -179.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 46.5 m -100.73 104.61 15.89 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 107.859 -1.163 . . . . 75.13 107.859 176.302 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 75.8 mt -100.38 115.31 41.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 N-CA-C 109.081 -0.711 . . . . 74.0 109.081 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -101.66 123.97 46.54 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 108.518 -0.919 . . . . 75.42 108.518 172.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 7.8 p -93.19 130.5 42.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 N-CA-C 107.683 -1.229 . . . . 73.55 107.683 178.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.443 ' HB3' ' H ' ' A' ' 7' ' ' GLU . 12.2 tmtt? -81.76 118.79 23.15 Favored 'General case' 0 C--O 1.243 0.713 0 N-CA-C 107.11 -1.441 . . . . 55.11 107.11 179.429 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 23.1 m170 -72.5 131.65 42.82 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 115.328 -0.851 . . . . 73.2 108.989 -177.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 40.6 t -59.81 -45.05 93.57 Favored 'General case' 0 CA--C 1.55 0.963 0 O-C-N 123.948 0.78 . . . . 52.14 110.933 -179.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -154.97 163.83 39.75 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 123.523 0.729 . . . . 73.11 110.672 -178.488 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -56.66 -47.69 79.22 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.397 1.479 . . . . 43.1 112.817 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.43 -31.31 68.44 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 122.642 0.377 . . . . 74.52 111.015 177.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -76.79 -15.98 59.59 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 115.36 -0.837 . . . . 64.21 112.747 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -54.0 -54.84 33.51 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.901 0.48 . . . . 63.11 112.197 -174.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -66.85 -44.72 80.28 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.442 0.697 . . . . 53.05 111.196 -174.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 24.4 ttmm -63.62 -59.54 4.48 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 115.47 -0.786 . . . . 73.3 110.529 -178.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -74.14 -20.66 60.16 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 113.301 0.852 . . . . 71.04 113.301 -172.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.16 -43.34 64.74 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-N 119.386 0.994 . . . . 50.52 109.559 175.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -65.44 -37.91 88.28 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.115 0.966 . . . . 73.02 111.681 176.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -71.11 -44.24 66.05 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.048 0.539 . . . . 64.43 110.65 177.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -76.88 -18.73 58.15 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.253 0.621 . . . . 75.44 109.784 -176.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.12 -45.96 92.53 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.346 0.659 . . . . 75.43 109.904 169.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -73.03 -32.9 65.39 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 124.047 0.842 . . . . 54.03 111.391 178.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.459 ' O ' HG23 ' A' ' 84' ' ' VAL . 46.3 mm -62.81 -54.24 36.37 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 C-N-CA 123.095 0.558 . . . . 74.02 109.825 174.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.47 HD23 HD13 ' A' ' 37' ' ' LEU . 32.2 mt -60.41 -44.99 95.17 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.8 0.84 . . . . 52.1 110.339 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 57.5 t30 -64.27 -33.7 76.41 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.602 0.761 . . . . 73.43 110.721 -175.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.473 ' O ' ' HG2' ' A' ' 87' ' ' GLU . 27.7 mmtp -73.04 -35.16 66.69 Favored 'General case' 0 C--O 1.213 -0.843 0 CA-C-O 119.007 -0.52 . . . . 71.23 111.485 174.15 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 80' ' ' ILE . 69.0 t -66.81 -36.44 77.22 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 CA-C-O 121.388 0.614 . . . . 73.42 110.604 177.286 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.562 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 24.2 m-85 -62.38 -43.24 99.28 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 114.9 -1.045 . . . . 65.22 109.623 173.33 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -69.45 -28.53 66.19 Favored 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 122.851 0.46 . . . . 74.34 111.461 175.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.473 ' HG2' ' O ' ' A' ' 83' ' ' LYS . 58.0 mm-40 -65.11 -34.75 79.14 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 124.084 0.954 . . . . 73.11 110.84 177.65 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.531 HD11 ' HA ' ' A' ' 38' ' ' LYS . 70.9 mt -107.27 -6.6 17.14 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 122.994 0.518 . . . . 74.11 112.204 -170.188 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 93.28 54.9 1.65 Allowed Glycine 0 C--N 1.346 1.09 0 CA-C-O 121.331 0.406 . . . . 52.42 113.267 176.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.562 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 72.9 m-85 -118.16 145.96 44.55 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 106.816 -1.55 . . . . 73.24 106.816 169.236 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -76.83 158.44 30.82 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 122.949 0.5 . . . . 63.23 110.273 178.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -64.82 -35.94 82.74 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.333 0.653 . . . . 71.03 110.359 176.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 18.1 m -51.11 -35.38 35.02 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 124.938 1.295 . . . . 72.12 112.975 174.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . 0.433 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 3.2 m-20 -58.96 -37.88 77.79 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 124.057 0.943 . . . . 75.53 110.973 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 17.6 t -83.73 110.24 18.23 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 C-N-CA 124.183 0.993 . . . . 54.35 109.502 -169.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 51.8 m -139.26 113.98 9.24 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 122.867 0.467 . . . . 42.33 109.972 174.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.443 ' HA ' ' HA ' ' A' ' 102' ' ' VAL . 60.7 m95 -79.04 121.77 25.38 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.197 0.599 . . . . 72.33 110.597 176.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -101.07 87.9 3.38 Favored 'General case' 0 C--O 1.242 0.678 0 C-N-CA 124.79 1.236 . . . . 75.3 107.71 168.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.87 -103.1 0.78 Allowed Glycine 0 C--N 1.343 0.956 0 CA-C-N 115.82 -0.627 . . . . 64.42 112.196 -174.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -106.4 -8.51 17.13 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.405 0.682 . . . . 70.24 111.645 -176.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 37.3 m -109.71 127.21 54.44 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 108.881 -0.785 . . . . 51.42 108.881 178.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . 0.443 ' HA ' ' HA ' ' A' ' 97' ' ' TRP . 8.1 p -95.32 118.4 41.43 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 N-CA-C 108.841 -0.8 . . . . 71.42 108.841 176.458 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 39.4 m -92.72 100.41 12.91 Favored 'General case' 0 C--O 1.242 0.67 0 N-CA-C 107.576 -1.268 . . . . 64.31 107.576 176.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.451 HG21 ' CZ ' ' A' ' 85' ' ' PHE . 60.8 t -103.69 110.3 29.66 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 N-CA-C 108.301 -1.0 . . . . 72.35 108.301 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -101.71 111.46 23.71 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 108.526 -0.916 . . . . 71.24 108.526 176.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -116.57 155.16 16.37 Favored Glycine 0 C--N 1.342 0.876 0 CA-C-N 115.421 -0.809 . . . . 70.42 112.594 -172.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 . . . . . 0 C--O 1.243 0.75 0 C-N-CA 123.475 0.71 . . . . 60.32 109.217 170.413 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 57.2 mttm . . . . . 0 C--O 1.245 0.858 0 CA-C-O 120.891 0.376 . . . . 71.51 110.61 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -80.35 102.67 9.71 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 105.432 -2.062 . . . . 65.21 105.432 160.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.1 p -102.42 134.29 43.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 124.373 1.069 . . . . 53.04 108.44 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.569 ' HB2' ' HG3' ' A' ' 63' ' ' LYS . 46.8 mt-10 -107.96 115.2 29.69 Favored 'General case' 0 C--O 1.243 0.728 0 N-CA-C 107.876 -1.157 . . . . 71.42 107.876 175.9 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 99.1 t -95.72 109.27 22.33 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 CA-C-N 114.025 -1.443 . . . . 64.12 108.333 -174.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.46 ' HG2' HG23 ' A' ' 22' ' ' THR . 36.5 mt-30 -94.21 100.97 12.95 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 107.933 -1.136 . . . . 74.15 107.933 -176.151 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 98.5 t -95.77 104.2 15.56 Favored 'Isoleucine or valine' 0 C--O 1.243 0.753 0 N-CA-C 108.779 -0.823 . . . . 51.23 108.779 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.491 ' HG3' ' HB3' ' A' ' 20' ' ' GLU . 39.0 ttpt -108.64 102.54 11.59 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 108.042 -1.095 . . . . 73.43 108.042 -179.261 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.5 HD13 HG13 ' A' ' 48' ' ' ILE . 15.8 tt -111.48 120.19 61.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 C-N-CA 123.364 0.666 . . . . 75.52 110.29 -176.142 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 7.0 m -92.28 108.46 19.97 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 108.605 -0.887 . . . . 62.43 108.605 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.669 ' SG ' HG23 ' A' ' 48' ' ' ILE . 52.5 t -128.7 119.34 24.46 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.947 0.899 . . . . 75.54 108.986 -175.157 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.496 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 22.1 t-20 77.3 -8.61 1.65 Allowed 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 126.327 1.851 . . . . 74.34 112.602 173.619 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 124.17 -4.43 8.96 Favored Glycine 0 C--N 1.341 0.857 0 CA-C-O 119.861 -0.41 . . . . 44.04 112.588 -175.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -106.25 144.97 32.19 Favored 'General case' 0 C--O 1.241 0.642 0 C-N-CA 123.084 0.554 . . . . 74.14 109.672 179.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 47.2 m -94.32 108.32 20.22 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.809 0.844 . . . . 75.42 108.731 177.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 70.6 m-85 -101.65 101.35 11.86 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 107.843 -1.169 . . . . 75.11 107.843 177.191 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.491 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 0.2 OUTLIER -123.23 141.84 51.56 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 122.846 0.458 . . . . 75.51 111.049 -178.146 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 41.1 ttm180 -154.94 135.8 13.69 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.374 -0.83 . . . . 72.21 108.94 177.055 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.46 HG23 ' HG2' ' A' ' 9' ' ' GLN . 29.8 m -94.6 117.13 29.65 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.377 1.071 . . . . 75.35 108.31 177.668 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -99.17 120.28 39.24 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.111 0.964 . . . . 71.21 110.034 -176.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -83.33 109.24 17.11 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 108.204 -1.036 . . . . 73.3 108.204 178.104 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 96.6 mt -119.49 148.36 43.36 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.02 0.928 . . . . 75.34 109.101 179.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 54.0 t80 -136.39 139.86 42.79 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 108.42 -0.955 . . . . 72.3 108.42 174.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.58 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -162.72 151.81 15.12 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 123.683 0.793 . . . . 73.34 109.377 174.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 43.5 t -76.0 -71.14 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 N-CA-C 108.633 -0.877 . . . . 72.53 108.633 175.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.488 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 57.1 mtp85 -82.18 155.36 25.0 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.352 0.596 . . . . 73.54 110.977 -179.52 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -68.63 -28.65 67.09 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 114.952 -1.022 . . . . 70.14 110.955 175.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 60.8 mm-40 -58.61 -36.07 73.47 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.529 0.732 . . . . 73.53 111.644 171.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.58 ' HB2' ' HB1' ' A' ' 27' ' ' ALA . 9.2 mm-40 -67.58 -34.09 76.34 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 123.717 0.807 . . . . 74.32 110.822 -179.443 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.424 HD23 ' HB3' ' A' ' 27' ' ' ALA . 0.2 OUTLIER -73.07 -25.26 60.84 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.554 0.742 . . . . 70.55 110.871 -177.633 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -53.94 -59.73 4.25 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.766 0.826 . . . . 65.31 112.252 -178.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -57.65 -33.46 68.32 Favored 'General case' 0 N--CA 1.479 0.987 0 O-C-N 124.088 0.868 . . . . 63.44 111.894 -178.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.407 ' O ' HG23 ' A' ' 40' ' ' VAL . 64.6 mttm -68.66 -44.9 73.12 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 123.418 0.687 . . . . 74.53 109.912 -179.467 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 89.6 mt -65.08 -36.84 85.61 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.767 0.827 . . . . 64.32 111.482 178.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.541 ' HA ' HD11 ' A' ' 88' ' ' LEU . 59.2 mtpt -63.58 -43.22 97.61 Favored 'General case' 0 C--N 1.357 0.897 0 C-N-CA 122.778 0.431 . . . . 71.35 110.138 177.18 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -66.92 -47.91 70.27 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 123.467 0.479 . . . . 72.11 111.623 176.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.412 ' O ' ' HB2' ' A' ' 44' ' ' ARG . 54.8 t -57.86 -41.87 80.88 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.227 0 C-N-CA 123.57 0.748 . . . . 64.01 110.747 -178.552 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.574 HD21 HD11 ' A' ' 60' ' ' ILE . 74.6 mt -72.21 -51.12 22.53 Favored 'General case' 0 C--O 1.217 -0.633 0 CA-C-O 118.755 -0.64 . . . . 75.0 111.425 178.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -55.69 -50.21 70.88 Favored 'General case' 0 N--CA 1.496 1.851 0 C-N-CA 122.901 0.48 . . . . 64.51 112.027 -179.027 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 56.3 mm-40 -63.01 -34.77 78.27 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 115.966 -0.561 . . . . 63.41 110.827 178.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.412 ' HB2' ' O ' ' A' ' 40' ' ' VAL . 20.5 tpt180 -65.7 -45.52 82.48 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.296 0.638 . . . . 75.12 110.954 176.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.471 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 94.6 mmm -80.57 -21.83 41.33 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.698 0.799 . . . . 63.42 112.379 -170.13 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -57.38 -55.73 41.38 Favored Pre-proline 0 CA--C 1.565 1.531 0 O-C-N 123.721 0.638 . . . . 63.34 111.521 -178.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.418 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 60.8 Cg_endo -69.27 -24.71 31.61 Favored 'Trans proline' 0 C--N 1.389 2.689 0 C-N-CA 121.623 1.549 . . . . 62.12 112.334 177.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.669 HG23 ' SG ' ' A' ' 14' ' ' CYS . 44.7 mm -69.99 -34.42 59.7 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.015 0 C-N-CA 123.938 0.895 . . . . 61.43 111.506 -177.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 58.4 mtpt -67.14 -35.6 80.07 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 109.998 -0.371 . . . . 55.23 109.998 173.591 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.32 -35.65 79.85 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 123.772 0.829 . . . . 73.21 109.376 176.088 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.452 HD12 HD13 ' A' ' 48' ' ' ILE . 91.7 mt -70.79 -23.29 62.35 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 122.86 0.464 . . . . 72.25 110.008 175.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 71.88 39.63 59.0 Favored Glycine 0 C--N 1.343 0.97 0 CA-C-N 115.667 -0.697 . . . . 75.1 113.968 168.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.496 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 72.8 m -79.03 111.76 15.55 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 122.498 0.319 . . . . 64.05 111.03 -178.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -46.74 -37.22 8.16 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 126.177 1.791 . . . . 71.31 112.864 178.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.472 ' HD2' ' N ' ' A' ' 56' ' ' VAL . 0.0 OUTLIER -146.2 136.86 24.16 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 107.469 -1.308 . . . . 75.31 107.469 175.096 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.472 ' N ' ' HD2' ' A' ' 55' ' ' ARG . 31.0 m -124.66 142.14 42.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 124.472 1.109 . . . . 71.25 109.879 177.075 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 -111.01 105.5 14.28 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 109.056 -0.72 . . . . 72.13 109.056 176.357 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.44 HD11 ' SD ' ' A' ' 45' ' ' MET . 52.0 mt -94.79 109.59 22.51 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 125.312 1.445 . . . . 71.14 108.184 176.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 27.4 m -107.19 105.48 15.48 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 108.229 -1.026 . . . . 73.0 108.229 177.069 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.574 HD11 HD21 ' A' ' 41' ' ' LEU . 79.8 mt -97.6 122.83 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 123.564 0.746 . . . . 75.15 109.341 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 79.6 mtt-85 -110.68 138.01 47.62 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.515 0.726 . . . . 73.11 109.604 174.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.5 p -99.39 139.64 20.62 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 N-CA-C 108.21 -1.033 . . . . 73.55 108.21 170.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.569 ' HG3' ' HB2' ' A' ' 7' ' ' GLU . 10.6 mmpt? -81.97 127.48 33.09 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 122.641 0.376 . . . . 75.35 110.438 178.81 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 20.2 p80 -147.16 154.16 40.74 Favored 'General case' 0 C--O 1.24 0.564 0 C-N-CA 123.896 0.878 . . . . 55.24 110.598 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 71.8 p -164.91 32.66 0.06 Allowed 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.981 0.912 . . . . 62.24 109.056 174.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -135.85 82.11 1.93 Allowed 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 107.509 -1.293 . . . . 53.42 107.509 -175.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.61 -6.23 5.04 Favored 'General case' 0 N--CA 1.483 1.181 0 N-CA-C 113.911 1.078 . . . . 44.53 113.911 -166.08 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -78.48 -66.99 0.78 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.231 0.612 . . . . 74.51 110.205 170.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.414 ' O ' ' HG2' ' A' ' 73' ' ' GLU . 44.5 mm-40 -84.35 -27.65 27.58 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 113.384 0.883 . . . . 75.35 113.384 -168.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -59.73 -29.39 68.11 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 112.943 0.72 . . . . 71.31 112.943 -172.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -76.36 -30.23 57.51 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.029 0.932 . . . . 73.33 110.496 -178.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -72.94 -41.72 64.2 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.417 1.087 . . . . 61.03 109.884 172.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.414 ' HG2' ' O ' ' A' ' 69' ' ' GLU . 10.7 mm-40 -79.92 -23.0 42.06 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 115.781 -0.645 . . . . 72.12 111.946 -173.345 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -76.48 -40.3 50.71 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 122.824 0.449 . . . . 44.14 109.947 174.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.3 ttmm -57.26 -41.71 80.19 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 124.238 1.015 . . . . 74.24 110.587 170.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -66.75 -45.02 79.88 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 114.423 -1.262 . . . . 50.52 110.712 178.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -72.7 -22.35 60.91 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.411 1.084 . . . . 74.12 110.089 -176.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.423 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -63.87 -46.51 84.6 Favored 'General case' 0 C--N 1.354 0.761 0 C-N-CA 123.812 0.845 . . . . 33.25 110.472 173.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.38 -34.96 73.18 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 115.372 -0.831 . . . . 63.01 111.533 178.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.402 ' O ' HG23 ' A' ' 84' ' ' VAL . 31.9 mm -62.13 -54.76 30.1 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 123.636 0.775 . . . . 72.22 111.224 177.096 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 16.2 mt -67.78 -26.97 66.37 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 122.564 0.345 . . . . 75.23 111.535 178.076 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -61.63 -37.54 84.34 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.045 0.538 . . . . 63.05 110.074 174.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.1 mmmp? -69.07 -47.37 65.45 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 115.9 -0.591 . . . . 53.01 110.931 172.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.43 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 71.8 t -61.01 -55.96 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 123.745 0.818 . . . . 70.01 111.083 -172.314 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.458 ' CZ ' HG21 ' A' ' 104' ' ' VAL . 35.0 m-85 -56.6 -44.26 80.93 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 124.218 0.949 . . . . 74.35 111.607 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.41 -32.06 73.39 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.19 0.596 . . . . 75.32 111.633 -179.268 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -86.15 -12.34 50.19 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.858 0.863 . . . . 43.33 111.77 -179.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.541 HD11 ' HA ' ' A' ' 38' ' ' LYS . 41.7 mt -106.64 8.97 31.42 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.126 0.57 . . . . 70.54 111.253 -179.213 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 86.54 14.8 65.05 Favored Glycine 0 C--N 1.347 1.172 0 N-CA-C 114.221 0.448 . . . . 55.13 114.221 174.082 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.434 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 63.4 m-85 -94.94 134.66 37.35 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.285 0.634 . . . . 72.45 110.304 174.636 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -88.47 162.03 16.69 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.001 0.92 . . . . 73.4 108.957 178.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -60.94 -28.29 68.85 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.635 0.774 . . . . 64.0 111.9 177.137 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 35.9 t -59.56 -31.36 69.35 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.087 0.955 . . . . 74.03 111.466 177.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . 0.574 HD22 ' HA2' ' A' ' 106' ' ' GLY . 18.7 m120 -76.04 -32.89 59.55 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 122.902 0.481 . . . . 71.05 111.019 178.196 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 44.5 t -106.42 116.21 49.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 123.515 0.726 . . . . 60.32 111.287 -165.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 10.6 t -126.07 122.93 37.21 Favored 'General case' 0 CA--C 1.556 1.199 0 C-N-CA 123.06 0.544 . . . . 74.31 110.065 173.388 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.423 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 37.8 m95 -91.12 146.05 24.17 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.567 0.747 . . . . 64.35 112.086 -177.795 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -152.31 73.93 1.06 Allowed 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 115.303 -0.862 . . . . 51.53 109.129 172.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 61.47 -93.41 0.08 OUTLIER Glycine 0 C--N 1.352 1.444 0 CA-C-N 114.443 -1.253 . . . . 32.34 114.656 173.425 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -69.23 -43.99 72.93 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.831 1.253 . . . . 75.52 111.251 -176.587 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 16.8 m -121.37 139.73 53.05 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.354 -0.839 . . . . 71.43 110.053 -171.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 6.7 p -107.04 126.67 63.09 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 N-CA-C 108.593 -0.891 . . . . 60.55 108.593 166.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 33.5 m -96.23 104.03 15.96 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 107.947 -1.131 . . . . 72.11 107.947 177.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.458 HG21 ' CZ ' ' A' ' 85' ' ' PHE . 58.9 t -105.38 110.6 31.61 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.516 0 N-CA-C 107.623 -1.251 . . . . 75.04 107.623 178.327 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . 0.409 ' HB3' ' HD3' ' A' ' 55' ' ' ARG . 46.3 mt-10 -109.96 110.03 20.83 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 107.728 -1.212 . . . . 73.34 107.728 173.433 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . 0.574 ' HA2' HD22 ' A' ' 94' ' ' ASN . . . -118.78 135.22 11.32 Favored Glycine 0 C--N 1.342 0.909 0 N-CA-C 111.437 -0.665 . . . . 71.52 111.437 -179.286 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 4.3 pm0 . . . . . 0 C--O 1.24 0.58 0 N-CA-C 108.047 -1.094 . . . . 65.33 108.047 172.167 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.611 0 N-CA-C 109.847 -0.427 . . . . 74.35 109.847 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.486 ' HA ' ' HA ' ' A' ' 26' ' ' TYR . 5.8 ttpm? -86.71 113.1 22.28 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 108.931 -0.766 . . . . 71.55 108.931 173.398 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.462 HG21 HG23 ' A' ' 62' ' ' VAL . 1.6 p -100.35 138.09 25.75 Favored 'Isoleucine or valine' 0 C--O 1.241 0.636 0 N-CA-C 107.544 -1.28 . . . . 65.54 107.544 170.165 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.514 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 40.2 mt-10 -100.16 113.12 25.54 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 107.445 -1.317 . . . . 60.01 107.445 176.024 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.414 HG13 HG23 ' A' ' 60' ' ' ILE . 90.0 t -95.38 107.25 19.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 N-CA-C 108.033 -1.099 . . . . 74.12 108.033 -176.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -95.08 100.1 11.98 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 108.294 -1.002 . . . . 74.22 108.294 -175.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 64.1 t -95.09 107.98 20.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 N-CA-C 108.968 -0.753 . . . . 60.43 108.968 -177.28 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.0 ttmm -109.82 103.65 12.49 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 108.356 -0.979 . . . . 71.0 108.356 -179.48 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.496 HD13 HG13 ' A' ' 48' ' ' ILE . 15.0 tt -112.29 123.35 67.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 CA-C-O 121.22 0.534 . . . . 74.41 110.618 -176.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 17.4 m -100.16 103.3 14.77 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 108.726 -0.842 . . . . 75.42 108.726 -179.033 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 35.1 t -113.73 129.17 56.61 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.784 0.833 . . . . 73.24 110.004 -178.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 72.08 -72.64 0.11 Allowed 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 125.584 1.553 . . . . 61.14 110.934 176.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -163.93 16.54 0.11 Allowed Glycine 0 C--N 1.34 0.793 0 CA-C-O 119.924 -0.375 . . . . 61.42 112.21 176.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -127.92 156.05 43.24 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.741 0.816 . . . . 73.32 110.638 -179.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 62.2 m -104.23 121.72 43.88 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.166 0.986 . . . . 62.12 109.814 179.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 39.6 m-85 -116.11 105.28 12.43 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 108.084 -1.08 . . . . 70.02 108.084 178.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -135.76 154.61 51.18 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 112.291 0.478 . . . . 70.22 112.291 -173.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 75.4 ttt180 -161.52 140.81 10.06 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 114.942 -1.026 . . . . 61.1 109.65 177.116 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 88.4 m -90.86 114.52 26.97 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 123.818 0.847 . . . . 73.35 109.208 174.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -98.17 129.77 44.94 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.549 0.74 . . . . 74.53 109.871 -178.162 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -89.95 108.31 19.64 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 108.104 -1.073 . . . . 71.04 108.104 178.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 82.9 mt -122.96 100.95 7.15 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.326 0.65 . . . . 62.51 109.83 -173.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.486 ' HA ' ' HA ' ' A' ' 5' ' ' LYS . 80.0 t80 -84.18 131.95 34.71 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 109.637 -0.505 . . . . 75.22 109.637 172.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.567 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -132.63 149.89 52.24 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.399 0.68 . . . . 74.14 109.445 175.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 60.6 t -87.76 -36.66 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-O 122.035 0.921 . . . . 75.34 109.442 176.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.42 ' O ' ' HB1' ' A' ' 27' ' ' ALA . 84.0 mtt180 -121.31 155.93 33.65 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 107.217 -1.401 . . . . 72.23 107.217 170.121 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -56.51 -30.28 62.84 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.265 0.626 . . . . 74.54 110.602 166.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -65.3 -28.95 69.68 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.646 1.178 . . . . 65.43 112.086 176.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.567 ' HB2' ' HB1' ' A' ' 27' ' ' ALA . 19.9 mm-40 -67.98 -32.78 73.44 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 110.511 -0.181 . . . . 65.31 110.511 176.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.722 HD22 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -71.34 -16.81 62.45 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.585 0.754 . . . . 72.42 111.334 -177.08 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -53.51 -64.89 0.68 Allowed 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.554 0.741 . . . . 65.32 111.949 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -59.67 -30.16 68.56 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 124.218 0.949 . . . . 62.13 112.383 -178.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.722 ' HD2' HD22 ' A' ' 33' ' ' LEU . 50.4 mttm -66.1 -47.09 75.35 Favored 'General case' 0 C--N 1.355 0.814 0 C-N-CA 123.099 0.56 . . . . 75.23 110.06 178.31 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.581 HD13 HD23 ' A' ' 81' ' ' LEU . 85.1 mt -59.54 -43.74 93.43 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 124.128 0.893 . . . . 72.45 110.993 177.456 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.599 ' HA ' HD11 ' A' ' 88' ' ' LEU . 54.3 mtpt -58.3 -50.95 71.8 Favored 'General case' 0 C--N 1.358 0.939 0 O-C-N 123.999 0.812 . . . . 73.31 111.1 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -66.18 -47.0 75.38 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 123.537 0.523 . . . . 64.44 111.328 -178.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 40.3 t -54.68 -43.73 67.18 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 C-N-CA 123.73 0.812 . . . . 64.31 111.542 179.269 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.65 HD21 HD11 ' A' ' 60' ' ' ILE . 46.7 mt -66.15 -48.51 70.54 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.206 0.603 . . . . 73.43 111.246 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -58.61 -49.21 78.3 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.229 0.611 . . . . 74.25 111.439 179.389 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -66.8 -40.02 87.94 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.407 1.083 . . . . 71.31 111.565 -176.203 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -66.09 -41.14 91.05 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 123.452 0.47 . . . . 75.41 110.714 176.325 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.473 ' SD ' ' OH ' ' A' ' 90' ' ' TYR . 48.1 mtp -92.49 -7.98 45.88 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 113.905 1.076 . . . . 62.43 113.905 -172.072 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -67.24 -44.8 49.34 Favored Pre-proline 0 CA--C 1.564 1.494 0 CA-C-O 118.995 -0.526 . . . . 73.02 111.581 -179.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.409 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 59.5 Cg_endo -71.2 -22.93 25.07 Favored 'Trans proline' 0 C--N 1.386 2.536 0 C-N-CA 121.692 1.595 . . . . 60.13 113.139 169.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.521 HD13 HD12 ' A' ' 51' ' ' LEU . 43.5 mm -66.64 -32.67 59.09 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 C-N-CA 123.494 0.717 . . . . 74.23 110.487 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.435 ' HG3' ' O ' ' A' ' 45' ' ' MET . 90.2 mttt -55.97 -50.45 70.76 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-O 121.512 0.672 . . . . 65.11 109.268 172.882 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -65.55 -29.34 69.94 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 114.044 -1.434 . . . . 64.51 111.48 -177.383 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.521 HD12 HD13 ' A' ' 48' ' ' ILE . 87.8 mt -71.76 -29.5 64.57 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 122.588 0.355 . . . . 72.24 110.759 175.605 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 72.13 84.25 0.23 Allowed Glycine 0 C--N 1.35 1.336 0 O-C-N 123.763 0.664 . . . . 53.22 113.082 170.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 1.2 p -131.64 134.08 45.6 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.322 0.649 . . . . 61.43 111.234 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -72.3 -37.07 69.07 Favored 'General case' 0 C--N 1.356 0.869 0 C-N-CA 124.302 1.041 . . . . 71.14 110.586 -178.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 41.8 ttm180 -127.42 131.96 50.17 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 109.627 -0.509 . . . . 72.25 109.627 175.642 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 31.5 m -120.37 137.66 53.44 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 124.961 1.304 . . . . 73.54 108.385 171.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.422 ' O ' ' HA ' ' A' ' 12' ' ' ILE . 24.9 ttm180 -108.26 106.61 16.85 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 108.304 -0.999 . . . . 75.35 108.304 173.191 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.432 HD11 ' SD ' ' A' ' 45' ' ' MET . 30.9 mt -96.72 105.38 17.03 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 N-CA-C 108.187 -1.042 . . . . 71.03 108.187 178.062 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 27.7 t -105.13 103.21 12.71 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 107.844 -1.169 . . . . 72.33 107.844 -179.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.65 HD11 HD21 ' A' ' 41' ' ' LEU . 66.6 mt -101.2 121.67 52.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 123.625 0.77 . . . . 75.55 109.829 -176.809 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -102.14 134.72 44.93 Favored 'General case' 0 C--O 1.241 0.611 0 N-CA-C 109.35 -0.611 . . . . 55.25 109.35 175.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.462 HG23 HG21 ' A' ' 6' ' ' VAL . 7.3 p -95.93 116.44 37.72 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.047 0 N-CA-C 106.975 -1.491 . . . . 74.32 106.975 173.147 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.514 ' HB3' ' H ' ' A' ' 7' ' ' GLU . 24.2 tptm -90.57 110.36 21.5 Favored 'General case' 0 C--O 1.239 0.529 0 O-C-N 121.366 -0.834 . . . . 75.22 108.903 -176.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 18.7 p80 -110.56 111.5 22.77 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.356 1.063 . . . . 63.1 108.558 178.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 27.7 t -70.9 -30.72 67.16 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 122.979 0.512 . . . . 70.14 110.425 177.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -85.64 155.44 21.12 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.009 0.924 . . . . 62.12 110.276 177.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.05 -8.65 11.19 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.143 0.977 . . . . 23.22 112.375 -176.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -86.22 -68.67 0.72 Allowed 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.068 0.547 . . . . 64.15 111.652 -175.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -76.1 -17.63 59.52 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.385 1.074 . . . . 75.21 112.685 -174.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -58.12 -26.07 62.18 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 114.14 1.163 . . . . 72.53 114.14 -170.785 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.5 pttp -66.56 -38.42 87.05 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 123.409 0.684 . . . . 74.51 110.943 174.246 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -70.5 -44.8 66.89 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.794 0.838 . . . . 51.32 109.322 173.031 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.504 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 24.3 mm-40 -68.52 -17.89 64.26 Favored 'General case' 0 C--N 1.353 0.746 0 O-C-N 124.389 1.055 . . . . 71.12 111.97 -176.018 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.14 -54.77 18.15 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 122.766 0.426 . . . . 64.32 110.538 174.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 50.3 mtpt -63.77 -41.14 98.03 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 124.265 0.978 . . . . 74.32 111.178 177.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.504 ' HB3' ' HA ' ' A' ' 73' ' ' GLU . 50.2 tttm -65.93 -42.16 90.43 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.257 1.423 . . . . 73.22 111.232 -178.03 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -79.1 -21.85 46.06 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.485 0.714 . . . . 74.51 110.815 176.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.2 -42.73 99.37 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 122.664 0.386 . . . . 60.03 110.418 176.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.64 -35.39 77.79 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.359 0.664 . . . . 64.14 111.259 176.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 49.3 mm -64.57 -46.31 92.95 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.801 0 C-N-CA 124.212 1.005 . . . . 74.42 110.297 174.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.581 HD23 HD13 ' A' ' 37' ' ' LEU . 48.1 mt -64.67 -48.1 76.0 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.683 0.793 . . . . 72.14 111.52 -178.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 61.9 m-80 -62.35 -34.14 76.08 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 123.669 0.606 . . . . 72.43 111.446 -173.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.8 mmmm -72.64 -37.28 68.05 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 123.261 0.351 . . . . 75.24 111.785 176.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.496 HG13 ' HG2' ' A' ' 38' ' ' LYS . 40.4 t -66.61 -52.54 44.69 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.121 0 C-N-CA 123.474 0.71 . . . . 73.31 110.168 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.572 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 29.9 m-85 -56.25 -42.98 78.25 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 124.36 1.038 . . . . 74.32 111.229 176.746 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -59.87 -34.0 72.56 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.788 0.835 . . . . 52.31 112.4 179.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -86.37 -15.44 40.44 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.353 0.661 . . . . 55.42 112.429 -176.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.599 HD11 ' HA ' ' A' ' 38' ' ' LYS . 78.2 mt -106.57 -9.51 16.56 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 112.474 0.546 . . . . 72.43 112.474 -171.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 118.51 14.4 6.36 Favored Glycine 0 N--CA 1.478 1.44 0 N-CA-C 113.918 0.327 . . . . 62.31 113.918 174.388 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.572 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 12.6 m-85 -109.2 150.08 28.43 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 108.745 -0.835 . . . . 74.21 108.745 174.651 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -86.12 166.89 15.43 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 109.697 -0.483 . . . . 75.25 109.697 171.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -88.48 32.38 0.78 Allowed 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 121.541 0.686 . . . . 31.31 110.062 174.359 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 79.2 p -110.46 -28.36 8.57 Favored 'General case' 0 C--N 1.343 0.325 0 C-N-CA 125.065 1.346 . . . . 43.22 108.112 176.018 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -76.97 -9.54 58.76 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.122 -0.944 . . . . 73.51 110.957 178.342 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 23.3 t -89.34 99.26 9.05 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.796 0 N-CA-C 108.751 -0.833 . . . . 73.33 108.751 -175.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 59.5 m -126.22 106.14 9.33 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.609 0.763 . . . . 60.35 109.636 -176.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 56.1 m95 -77.04 111.88 13.08 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.318 0.647 . . . . 73.12 110.461 177.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -108.44 95.17 5.48 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 105.437 -2.06 . . . . 73.12 105.437 170.053 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 64.95 -121.87 22.76 Favored Glycine 0 C--N 1.345 1.035 0 O-C-N 123.741 0.65 . . . . 61.24 112.106 -172.3 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -90.89 0.33 57.52 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.763 0.825 . . . . 52.32 111.444 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 63.5 m -119.48 118.95 32.46 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.543 0.737 . . . . 45.2 110.362 -169.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . 0.476 HG11 HD13 ' A' ' 81' ' ' LEU . 7.2 p -91.9 128.02 43.82 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.184 0 N-CA-C 109.052 -0.722 . . . . 64.04 109.052 173.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 40.5 m -105.08 112.24 25.29 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.567 0.747 . . . . 64.44 109.129 178.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 78.7 t -114.91 113.01 42.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 125.262 1.425 . . . . 75.34 108.112 179.54 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.4 145.65 46.98 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 109.217 -0.66 . . . . 72.44 109.217 -179.614 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 161.77 -147.91 14.78 Favored Glycine 0 C--N 1.332 0.35 0 N-CA-C 110.917 -0.873 . . . . 31.21 110.917 -173.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 5.0 pm0 . . . . . 0 N--CA 1.471 0.584 0 CA-C-N 117.226 0.513 . . . . 62.13 110.103 177.76 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 63.4 mttm . . . . . 0 N--CA 1.469 0.522 0 CA-C-O 120.953 0.406 . . . . 51.35 111.397 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.437 ' HE3' ' HB3' ' A' ' 5' ' ' LYS . 1.0 OUTLIER -101.13 105.25 16.38 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 106.635 -1.617 . . . . 75.1 106.635 169.664 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.3 p -98.79 144.77 11.22 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 N-CA-C 109.083 -0.71 . . . . 72.41 109.083 176.341 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.485 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 41.0 mt-10 -100.46 110.6 22.79 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 107.49 -1.3 . . . . 73.52 107.49 170.03 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.454 HG21 HD12 ' A' ' 25' ' ' LEU . 77.2 t -99.54 106.68 19.41 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 125.072 1.349 . . . . 63.45 108.282 -179.372 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.444 ' NE2' ' HB3' ' A' ' 61' ' ' ARG . 39.6 mt-30 -98.73 100.28 11.48 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 107.824 -1.176 . . . . 72.32 107.824 -176.404 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.443 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 95.8 t -93.69 103.08 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 N-CA-C 108.605 -0.887 . . . . 74.42 108.605 -176.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.432 ' HA ' ' HB3' ' A' ' 20' ' ' GLU . 22.5 ttmm -109.61 102.85 11.65 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 108.021 -1.103 . . . . 74.11 108.021 -178.111 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.528 HD13 HG13 ' A' ' 48' ' ' ILE . 13.7 tt -112.82 141.83 27.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 109.46 -0.57 . . . . 71.52 109.46 -179.332 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 45.0 m -121.22 133.05 55.15 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.591 0.756 . . . . 75.24 110.031 -178.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.522 ' SG ' ' ND2' ' A' ' 15' ' ' ASN . 19.6 t -160.31 133.88 6.95 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.599 1.16 . . . . 40.21 110.015 176.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.522 ' ND2' ' SG ' ' A' ' 14' ' ' CYS . 63.6 m-80 63.92 23.45 13.34 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 124.705 1.202 . . . . 75.33 112.17 -178.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 74.72 16.21 80.37 Favored Glycine 0 C--N 1.35 1.333 0 CA-C-N 116.307 -0.406 . . . . 70.42 113.013 -174.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.3 mmpt? -118.71 122.26 42.06 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.977 0.911 . . . . 74.01 109.859 178.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 89.9 m -98.46 121.5 40.47 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 123.15 0.58 . . . . 75.24 110.122 178.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.1 m-85 -106.17 111.11 23.59 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 107.364 -1.347 . . . . 63.14 107.364 176.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.443 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 0.8 OUTLIER -140.51 155.47 46.63 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 112.393 0.516 . . . . 54.21 112.393 -173.575 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 40.8 ttm180 -168.32 145.06 3.93 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.003 0.921 . . . . 74.2 109.549 175.108 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 53.5 m -85.47 112.29 20.76 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.669 0.787 . . . . 71.34 109.05 172.047 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -98.88 138.85 35.41 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.761 0.824 . . . . 72.54 109.111 178.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 26.2 mp0 -104.89 109.43 21.4 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 107.616 -1.253 . . . . 75.13 107.616 -178.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.454 HD12 HG21 ' A' ' 8' ' ' VAL . 81.6 mt -117.02 102.6 9.47 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.865 0.866 . . . . 64.12 109.322 -175.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.427 ' O ' ' HE3' ' A' ' 36' ' ' LYS . 72.5 t80 -94.67 126.27 39.86 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.308 0.643 . . . . 73.22 109.612 176.741 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.502 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -139.95 153.21 46.85 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.808 0.843 . . . . 72.4 109.5 175.171 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 47.2 t -74.86 -58.68 4.26 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 N-CA-C 108.664 -0.865 . . . . 72.13 108.664 174.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.505 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 79.2 mtt180 -101.42 168.21 9.66 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 115.571 -0.74 . . . . 54.53 111.223 -178.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.8 -46.15 76.11 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.448 1.499 . . . . 75.11 110.038 -178.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -60.22 -30.15 69.2 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 113.774 -1.557 . . . . 75.22 111.766 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.505 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 37.4 mm-40 -71.34 -24.58 62.13 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.49 0.716 . . . . 65.21 111.645 -178.738 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.68 -28.31 61.68 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 122.917 0.487 . . . . 74.24 110.034 178.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.433 ' HE2' ' HB3' ' A' ' 34' ' ' LYS . 39.5 mtpt -52.59 -56.85 12.43 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 123.351 0.66 . . . . 74.42 112.477 -176.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.461 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 2.8 pp20? -59.65 -32.62 70.63 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 123.993 0.808 . . . . 73.33 112.153 -175.511 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.427 ' HE3' ' O ' ' A' ' 26' ' ' TYR . 55.3 mttm -67.85 -46.49 71.62 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.296 0.639 . . . . 74.04 110.206 177.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 72.5 mt -58.38 -42.42 87.0 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.168 0.987 . . . . 73.51 110.844 177.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -62.41 -40.98 98.29 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.095 0.958 . . . . 61.15 111.266 178.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 74.3 mmtt -63.46 -51.68 64.65 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 123.434 0.459 . . . . 73.34 110.837 175.707 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 92.3 t -60.36 -37.95 76.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 124.171 0.988 . . . . 73.23 111.629 -177.473 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.472 HD21 HD11 ' A' ' 60' ' ' ILE . 65.2 mt -68.46 -51.15 46.75 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 122.901 0.48 . . . . 55.24 110.257 178.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -61.76 -30.51 70.83 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.169 0.588 . . . . 71.41 111.725 178.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -67.56 -53.13 30.98 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.243 0.617 . . . . 72.43 110.721 175.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.417 ' NE ' ' HA ' ' A' ' 44' ' ' ARG . 0.0 OUTLIER -74.97 -26.92 59.93 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 123.324 0.39 . . . . 64.22 111.763 -173.073 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.578 ' HB3' ' HE3' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -82.04 -27.92 32.75 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.594 0.758 . . . . 64.1 112.014 -179.405 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -56.99 -52.48 73.77 Favored Pre-proline 0 CA--C 1.562 1.438 0 N-CA-C 113.025 0.75 . . . . 63.45 113.025 -173.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.426 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 41.9 Cg_endo -64.24 -30.99 64.31 Favored 'Trans proline' 0 C--N 1.385 2.453 0 C-N-CA 121.775 1.65 . . . . 44.44 111.793 176.191 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.528 HG13 HD13 ' A' ' 12' ' ' ILE . 44.8 mm -74.9 -33.34 29.77 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.046 0 C-N-CA 123.999 0.919 . . . . 65.42 111.003 -174.408 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.578 ' HE3' ' HB3' ' A' ' 45' ' ' MET . 98.9 mttt -70.17 -34.36 72.89 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.39 0.676 . . . . 73.51 109.743 175.429 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -72.87 -29.22 63.01 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.884 0.874 . . . . 73.34 110.901 175.371 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 73.6 mt -71.81 -29.74 64.76 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 109.317 -0.623 . . . . 72.02 109.317 173.642 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 71.52 54.11 9.14 Favored Glycine 0 C--N 1.351 1.4 0 O-C-N 123.791 0.682 . . . . 73.44 111.982 176.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.492 ' SG ' HG23 ' A' ' 48' ' ' ILE . 12.7 m -73.35 122.0 21.34 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 122.98 0.512 . . . . 72.52 110.391 -179.321 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -67.4 -25.1 65.78 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.763 0.825 . . . . 75.13 110.807 177.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 16.8 tpp180 -140.38 129.15 23.11 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.132 0.973 . . . . 72.14 108.931 175.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 19.7 m -118.22 143.53 28.78 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 123.298 0.639 . . . . 70.02 109.601 170.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.491 ' HG3' ' HG2' ' A' ' 105' ' ' GLU . 52.0 ttt-85 -131.52 106.43 8.21 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 108.814 -0.81 . . . . 71.25 108.814 172.381 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.418 ' HB ' ' HB ' ' A' ' 104' ' ' VAL . 39.3 mt -99.6 129.42 50.18 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 C-N-CA 124.922 1.289 . . . . 62.45 107.539 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.2 m -120.68 103.3 9.02 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 107.464 -1.309 . . . . 70.32 107.464 179.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.472 HD11 HD21 ' A' ' 41' ' ' LEU . 73.2 mt -98.77 104.95 16.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 N-CA-C 108.884 -0.784 . . . . 72.33 108.884 -177.409 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.444 ' HB3' ' NE2' ' A' ' 9' ' ' GLN . 0.0 OUTLIER -96.23 109.99 22.36 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 108.4 -0.963 . . . . 73.11 108.4 -176.339 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 21.9 t -95.03 127.0 47.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 C-N-CA 124.468 1.107 . . . . 61.42 110.089 -174.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.485 ' HB3' ' H ' ' A' ' 7' ' ' GLU . 3.9 tppp? -87.6 102.52 14.69 Favored 'General case' 0 C--O 1.24 0.565 0 N-CA-C 108.717 -0.845 . . . . 72.43 108.717 177.627 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 36.7 m80 -71.61 140.92 49.96 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 123.402 0.439 . . . . 75.31 110.114 178.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 17.2 m -62.39 -46.57 88.01 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.698 1.199 . . . . 71.02 112.532 -166.339 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -141.71 153.24 44.51 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 122.723 0.409 . . . . 62.05 110.992 -172.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -74.57 -15.44 60.84 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 124.196 0.999 . . . . 74.44 112.803 -175.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -86.14 -44.93 11.82 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 122.763 0.425 . . . . 64.32 109.887 171.43 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -66.28 -35.14 79.63 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-N 115.575 -0.738 . . . . 75.22 112.551 -177.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -43.59 -38.43 2.99 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 115.038 1.496 . . . . 54.14 115.038 -167.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -67.11 -41.97 85.31 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.412 0.685 . . . . 71.41 111.039 -177.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 18.2 tppt? -77.53 -35.74 53.04 Favored 'General case' 0 C--O 1.241 0.642 0 C-N-CA 123.72 0.808 . . . . 75.22 109.837 174.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.676 ' HG3' ' HD2' ' A' ' 76' ' ' LYS . 34.9 tt0 -74.29 -15.19 60.97 Favored 'General case' 0 C--N 1.351 0.673 0 CA-C-N 115.533 -0.758 . . . . 73.33 111.345 -175.124 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.77 -62.2 1.64 Allowed 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 108.685 -0.857 . . . . 63.03 108.685 171.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 57.8 tttm -65.1 -24.56 67.47 Favored 'General case' 0 N--CA 1.481 1.1 0 O-C-N 123.514 0.508 . . . . 72.43 111.715 -179.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.676 ' HD2' ' HG3' ' A' ' 73' ' ' GLU . 3.4 ttmp? -59.54 -60.45 3.83 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.93 0.892 . . . . 65.55 110.685 172.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -77.31 -21.73 53.05 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 115.549 -0.75 . . . . 73.04 109.961 -174.565 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.42 ' HA ' ' CE2' ' A' ' 97' ' ' TRP . . . -64.11 -43.47 95.24 Favored 'General case' 0 C--N 1.345 0.406 0 C-N-CA 123.488 0.715 . . . . 62.02 110.142 172.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.88 -48.26 79.75 Favored 'General case' 0 C--N 1.349 0.561 0 O-C-N 124.142 0.901 . . . . 42.22 110.752 175.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.419 ' O ' HG23 ' A' ' 84' ' ' VAL . 38.1 mm -62.54 -50.59 79.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 O-C-N 123.944 0.778 . . . . 71.43 111.41 -175.204 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 10.7 mt -67.03 -39.11 86.92 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-O 119.253 -0.403 . . . . 74.11 111.035 -179.312 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -61.09 -36.87 80.81 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 122.967 0.507 . . . . 73.01 110.65 -179.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.494 ' O ' ' HG2' ' A' ' 87' ' ' GLU . 33.2 mmtp -71.31 -37.33 71.81 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 115.482 -0.781 . . . . 44.25 111.04 175.907 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 80' ' ' ILE . 53.8 t -64.64 -38.57 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 123.539 0.736 . . . . 61.32 110.402 178.576 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.565 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 22.0 m-85 -64.34 -36.02 82.78 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 114.955 -1.021 . . . . 73.42 110.431 174.907 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -73.77 -23.5 59.72 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 123.683 0.793 . . . . 75.32 111.652 175.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 83' ' ' LYS . 37.6 mm-40 -74.71 -29.72 61.29 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.024 0.53 . . . . 64.4 111.718 176.35 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 82.1 mt -108.35 -18.87 13.64 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.174 0.59 . . . . 74.23 111.781 -168.44 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 107.18 11.44 25.81 Favored Glycine 0 C--N 1.347 1.174 0 N-CA-C 114.6 0.6 . . . . 50.54 114.6 174.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.565 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 87.7 m-85 -72.1 120.21 17.39 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 108.807 -0.812 . . . . 74.43 108.807 171.682 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . 0.411 ' O ' HG23 ' A' ' 95' ' ' VAL . 35.2 m-80 -77.6 165.07 24.75 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.671 0.788 . . . . 61.4 110.329 -173.532 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -53.06 -44.42 67.46 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.771 0.828 . . . . 51.1 111.701 173.023 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 34.5 t -66.56 -8.51 27.4 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.231 1.012 . . . . 62.44 112.215 179.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . 0.435 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 12.8 m120 -104.26 -11.03 17.44 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.409 0.684 . . . . 73.41 111.176 178.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 91' ' ' ASN . 57.6 t -109.87 113.46 44.28 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 C-N-CA 123.483 0.713 . . . . 64.34 109.925 -175.236 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 7.9 m -123.13 97.58 5.49 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.303 0.641 . . . . 71.25 110.159 175.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.42 ' CE2' ' HA ' ' A' ' 78' ' ' ALA . 5.1 m95 -74.17 150.08 40.59 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 122.892 0.477 . . . . 75.22 110.967 178.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -159.4 81.76 0.75 Allowed 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.361 0.664 . . . . 73.22 110.29 -178.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 70.08 -101.06 0.83 Allowed Glycine 0 CA--C 1.533 1.194 0 CA-C-N 115.237 -0.892 . . . . 72.25 113.581 174.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -90.77 -20.97 21.78 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.678 0.791 . . . . 62.5 111.093 177.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 17.0 m -114.64 128.81 56.52 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.198 0.599 . . . . 73.02 110.74 -169.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . 0.411 HG12 ' HB ' ' A' ' 60' ' ' ILE . 10.3 p -99.91 130.87 48.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 N-CA-C 108.048 -1.093 . . . . 73.4 108.048 166.476 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 15.1 m -108.1 102.54 11.69 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.495 -0.928 . . . . 73.51 108.495 179.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.435 ' HA ' ' O ' ' A' ' 94' ' ' ASN . 41.0 t -92.91 109.01 21.06 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 N-CA-C 108.008 -1.108 . . . . 71.44 108.008 -179.184 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . 0.491 ' HG2' ' HG3' ' A' ' 57' ' ' ARG . 42.1 mt-10 -121.55 112.43 18.47 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 107.21 -1.404 . . . . 72.34 107.21 -176.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -164.75 -167.23 24.99 Favored Glycine 0 C--O 1.246 0.88 0 C-N-CA 120.93 -0.652 . . . . 54.52 113.254 -173.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 27.4 pt20 . . . . . 0 C--O 1.24 0.575 0 C-N-CA 124.499 1.12 . . . . 74.12 109.833 -178.545 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.546 ' HA ' ' HE2' ' A' ' 4' ' ' LYS . 8.1 mmpt? . . . . . 0 N--CA 1.474 0.758 0 CA-C-O 121.111 0.481 . . . . 73.41 111.503 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -88.35 98.43 11.6 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 108.163 -1.051 . . . . 53.21 108.163 178.075 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.448 HG23 HG23 ' A' ' 62' ' ' VAL . 0.2 OUTLIER -98.42 137.4 26.04 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 CA-C-N 114.104 -1.407 . . . . 74.12 107.516 177.69 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -107.29 114.06 27.85 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 108.412 -0.958 . . . . 75.52 108.412 176.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.447 HG13 HG23 ' A' ' 60' ' ' ILE . 93.5 t -98.98 107.73 21.04 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 C-N-CA 125.628 1.571 . . . . 70.32 108.987 -171.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.53 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 63.6 mt-30 -95.27 100.89 12.61 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 108.277 -1.008 . . . . 72.4 108.277 -174.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.529 HG13 HG23 ' A' ' 58' ' ' ILE . 88.4 t -93.02 104.66 15.95 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 C-N-CA 123.579 0.751 . . . . 62.24 109.382 -175.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.4 ttmm -102.91 102.27 12.34 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 107.714 -1.217 . . . . 55.32 107.714 178.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.519 HD11 HG21 ' A' ' 48' ' ' ILE . 12.4 tt -115.9 118.5 58.99 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 CA-C-O 121.157 0.503 . . . . 65.23 110.889 -174.606 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 19.8 m -97.09 102.97 14.86 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 108.879 -0.785 . . . . 75.45 108.879 178.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.616 ' SG ' HG23 ' A' ' 48' ' ' ILE . 42.2 t -120.0 125.75 49.13 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.876 1.27 . . . . 75.31 109.46 178.81 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.533 HD21 ' HB3' ' A' ' 51' ' ' LEU . 88.1 m-20 61.43 25.56 15.48 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 125.051 1.341 . . . . 71.41 112.115 -177.008 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.98 10.96 85.7 Favored Glycine 0 C--N 1.348 1.195 0 CA-C-N 115.718 -0.674 . . . . 72.45 113.467 -177.777 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -108.23 133.33 52.61 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.245 1.018 . . . . 64.44 108.982 176.041 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 49.6 m -106.24 118.03 35.58 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.072 0.549 . . . . 54.52 110.032 -173.503 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -111.56 101.96 10.33 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 107.243 -1.391 . . . . 75.25 107.243 179.279 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.416 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 14.1 pt-20 -116.95 134.51 54.66 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 122.038 -0.414 . . . . 74.32 110.46 179.249 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.8 ttt180 -155.35 141.05 18.02 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.657 -0.701 . . . . 74.13 110.075 -178.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 42.9 m -92.28 118.55 31.0 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 124.555 1.142 . . . . 63.01 110.151 178.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 89.6 m-85 -103.91 131.98 50.61 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.937 0.895 . . . . 64.43 110.332 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -91.49 110.13 21.44 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 108.814 -0.81 . . . . 71.14 108.814 -179.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 80.6 mt -118.98 112.89 20.16 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.674 0.79 . . . . 72.11 109.843 -179.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 88.0 t80 -110.2 138.79 46.1 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.619 0.767 . . . . 73.2 109.133 172.248 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.514 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -135.96 172.08 13.53 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.726 0.81 . . . . 70.51 110.075 177.644 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 24.0 t -98.01 -44.14 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 N-CA-C 108.749 -0.834 . . . . 72.13 108.749 168.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.592 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 92.9 mtt180 -116.71 158.3 24.05 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 115.464 -0.789 . . . . 72.02 110.501 178.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.437 ' HB2' HD11 ' A' ' 80' ' ' ILE . 15.9 p-10 -68.6 -29.14 67.59 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.909 0.883 . . . . 53.32 110.772 178.357 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.552 ' HA ' ' HD3' ' A' ' 34' ' ' LYS . 60.5 mm-40 -60.37 -40.87 92.35 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.488 0.715 . . . . 75.12 110.925 170.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.592 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 34.6 mm-40 -65.81 -28.16 68.79 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 116.082 -0.508 . . . . 75.11 110.601 178.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.43 -33.16 60.89 Favored 'General case' 0 CA--C 1.56 1.341 0 C-N-CA 122.917 0.487 . . . . 65.03 110.272 -179.108 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.552 ' HD3' ' HA ' ' A' ' 31' ' ' GLU . 53.3 mtpt -54.08 -55.47 27.18 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.924 0.89 . . . . 52.53 111.867 179.614 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.504 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 11.6 pt-20 -60.85 -35.98 77.98 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 115.293 -0.867 . . . . 73.3 111.384 -179.418 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.41 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 64.7 mttm -66.64 -41.05 88.91 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.259 0.624 . . . . 72.41 111.127 -178.314 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.542 HD13 HD23 ' A' ' 81' ' ' LEU . 94.3 mt -62.81 -40.93 98.91 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 123.746 0.654 . . . . 61.33 110.767 174.55 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -62.12 -41.71 98.5 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 122.765 0.426 . . . . 40.05 111.02 175.304 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.504 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 72.8 mmtt -63.94 -55.45 22.46 Favored 'General case' 0 N--CA 1.478 0.961 0 O-C-N 123.415 0.447 . . . . 75.3 110.275 178.607 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 51.7 t -54.56 -46.66 72.12 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.391 0 C-N-CA 124.541 1.136 . . . . 63.12 111.524 -178.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.431 ' O ' ' HG2' ' A' ' 45' ' ' MET . 67.1 mt -68.34 -41.0 81.36 Favored 'General case' 0 C--O 1.207 -1.14 0 CA-C-O 118.751 -0.643 . . . . 74.35 110.926 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -61.91 -43.02 99.7 Favored 'General case' 0 N--CA 1.492 1.662 0 CA-C-N 118.531 0.605 . . . . 35.44 111.857 176.171 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.493 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 21.6 mm-40 -61.32 -46.32 90.75 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 109.526 -0.546 . . . . 60.35 109.526 177.586 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -67.66 -41.1 84.3 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 114.989 -1.005 . . . . 74.14 111.481 -176.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.634 ' SD ' HD11 ' A' ' 58' ' ' ILE . 92.1 mmm -79.02 -21.36 47.07 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.025 0.53 . . . . 74.23 111.183 -175.715 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.501 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 13.9 t70 -57.67 -52.4 74.65 Favored Pre-proline 0 CA--C 1.565 1.556 0 N-CA-C 112.929 0.715 . . . . 73.41 112.929 -171.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.433 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 73.3 Cg_endo -71.75 -22.97 23.16 Favored 'Trans proline' 0 C--N 1.39 2.712 0 C-N-CA 121.805 1.67 . . . . 72.34 112.204 175.089 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.616 HG23 ' SG ' ' A' ' 14' ' ' CYS . 46.9 mm -74.21 -31.67 29.87 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 C-N-CA 124.58 1.152 . . . . 74.21 110.784 -175.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.501 ' HE2' ' HA ' ' A' ' 46' ' ' ASP . 49.2 mtmt -73.77 -34.58 64.75 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.216 0.606 . . . . 75.13 110.021 175.003 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -65.83 -27.21 68.08 Favored 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 124.343 1.057 . . . . 53.22 109.575 174.024 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.533 ' HB3' HD21 ' A' ' 15' ' ' ASN . 83.7 mt -75.27 -39.5 59.69 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 109.617 -0.512 . . . . 54.33 109.617 173.183 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 77.63 36.49 33.23 Favored Glycine 0 C--N 1.346 1.135 0 CA-C-N 115.237 -0.892 . . . . 65.12 114.076 174.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 2.0 p -71.65 119.69 16.17 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 109.55 -0.537 . . . . 75.45 109.55 171.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.404 ' HD2' ' H ' ' A' ' 54' ' ' LYS . 8.9 mptt -70.36 -25.02 63.08 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 124.105 0.962 . . . . 74.5 110.804 -170.437 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 33.0 ttp-105 -129.07 125.74 37.9 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.173 0.989 . . . . 74.21 108.354 178.148 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 15.3 m -122.17 137.08 56.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 123.419 0.687 . . . . 60.22 109.44 177.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.486 ' O ' ' HA ' ' A' ' 12' ' ' ILE . 18.3 ttm180 -111.19 104.1 12.58 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 108.532 -0.914 . . . . 53.52 108.532 172.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.634 HD11 ' SD ' ' A' ' 45' ' ' MET . 59.4 mt -98.45 105.2 16.96 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 N-CA-C 108.029 -1.1 . . . . 71.25 108.029 174.259 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 27.1 m -101.85 104.34 15.07 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 107.713 -1.217 . . . . 61.22 107.713 179.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.447 HG23 HG13 ' A' ' 8' ' ' VAL . 50.7 mt -95.14 116.03 35.53 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 C-N-CA 123.641 0.776 . . . . 72.34 109.369 -177.13 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.53 ' HB2' ' HB2' ' A' ' 9' ' ' GLN . 33.1 mtm180 -100.87 113.94 27.34 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 107.395 -1.335 . . . . 71.43 107.395 174.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.448 HG23 HG23 ' A' ' 6' ' ' VAL . 3.2 p -92.43 126.92 44.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 N-CA-C 108.129 -1.063 . . . . 75.44 108.129 -178.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.8 ttpp -81.94 109.36 16.22 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 109.021 -0.733 . . . . 73.1 109.021 -177.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . 0.484 ' ND1' ' HB2' ' A' ' 70' ' ' GLU . 31.6 m170 -86.0 108.52 18.26 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 124.073 0.949 . . . . 63.32 109.055 -178.629 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 13.4 m -74.98 -25.87 59.16 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.181 0.992 . . . . 63.44 112.798 -169.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -146.15 128.01 15.39 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.041 0.536 . . . . 63.05 109.695 -175.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.29 -27.51 68.67 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 113.813 1.042 . . . . 65.35 113.813 -172.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -84.86 -36.58 21.46 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 122.658 0.383 . . . . 52.23 110.822 -179.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -77.51 -28.08 51.97 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 116.093 -0.503 . . . . 63.23 112.061 -178.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.624 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 0.1 OUTLIER -70.27 -13.11 62.02 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 113.865 1.061 . . . . 64.51 113.865 -169.301 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 49.0 mtmt -67.68 -51.75 46.01 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-O 121.735 0.779 . . . . 75.23 109.162 171.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -74.9 -31.36 61.54 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.414 1.486 . . . . 75.2 110.857 -179.011 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.624 ' HB3' ' HA ' ' A' ' 70' ' ' GLU . 0.1 OUTLIER -73.65 -49.23 27.01 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.77 0.828 . . . . 73.21 110.435 -177.678 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.417 ' HB2' ' CE1' ' A' ' 64' ' ' HIS . . . -64.61 -34.24 77.8 Favored 'General case' 0 N--CA 1.483 1.223 0 O-C-N 123.591 0.557 . . . . 73.11 111.571 177.525 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 54.8 tptt -58.79 -50.9 72.21 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 124.37 1.044 . . . . 73.24 109.346 174.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.503 ' O ' HG12 ' A' ' 80' ' ' ILE . 39.3 ttmt -68.28 -39.68 82.05 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 114.377 -1.283 . . . . 70.23 110.838 -178.68 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -75.02 -22.39 58.51 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.314 1.045 . . . . 74.43 110.071 -171.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -67.13 -43.3 82.73 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.483 0.713 . . . . 52.54 110.616 172.423 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.15 -37.35 85.46 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 115.667 -0.697 . . . . 74.33 110.763 175.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.503 HG12 ' O ' ' A' ' 76' ' ' LYS . 43.4 mm -62.7 -47.86 90.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 123.893 0.877 . . . . 72.4 110.188 177.481 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.542 HD23 HD13 ' A' ' 37' ' ' LEU . 39.8 mt -67.71 -33.78 75.58 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.692 0.797 . . . . 74.01 111.618 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -60.88 -40.84 94.51 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.01 0.524 . . . . 74.42 110.155 -178.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 49.0 mmtm -64.95 -45.02 87.48 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.672 -0.694 . . . . 65.24 110.957 176.229 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.511 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 77.4 t -64.81 -59.75 3.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 C-N-CA 123.342 0.657 . . . . 74.44 110.302 -172.459 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.541 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 30.4 m-85 -57.79 -42.67 84.64 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.116 0.967 . . . . 64.35 112.342 -177.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.02 -34.61 77.94 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.21 0.604 . . . . 55.01 111.323 179.36 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -89.1 1.14 56.04 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.05 0.94 . . . . 70.14 111.672 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 37.8 mt -106.11 -26.08 11.76 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.226 0.611 . . . . 74.34 110.73 175.043 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 124.49 -9.99 8.16 Favored Glycine 0 C--N 1.345 1.072 0 CA-C-O 119.913 -0.382 . . . . 62.3 112.989 -179.253 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.541 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 70.9 m-85 -79.12 127.8 32.47 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 122.774 0.43 . . . . 71.24 110.011 177.062 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . 0.444 HD22 ' N ' ' A' ' 91' ' ' ASN . 0.8 OUTLIER -84.36 171.02 13.02 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.796 0.838 . . . . 72.44 109.877 -179.502 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -56.77 -42.54 79.56 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.031 0.932 . . . . 74.35 111.642 178.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 30.9 t -56.23 -31.64 63.71 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.277 1.031 . . . . 54.34 112.949 178.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . 0.458 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 14.1 m120 -65.24 -32.21 73.76 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 122.662 0.385 . . . . 71.33 111.653 179.492 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 58.9 t -88.86 127.35 41.7 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 C-N-CA 124.02 0.928 . . . . 70.22 110.427 -172.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 63.5 m -143.72 122.38 12.56 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.468 0.707 . . . . 74.45 110.665 172.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 75.2 m95 -87.89 124.47 33.71 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 123.522 0.729 . . . . 72.35 111.349 177.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -120.81 91.89 3.64 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 107.955 -1.128 . . . . 71.51 107.955 169.195 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 70.69 -125.81 13.89 Favored Glycine 0 C--N 1.346 1.086 0 CA-C-N 115.79 -0.641 . . . . 64.4 112.095 -177.72 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -81.96 -6.73 59.36 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.76 0.824 . . . . 72.02 111.389 178.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 76.6 m -103.07 149.73 24.3 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.816 0.846 . . . . 73.51 109.564 -179.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.8 p -130.38 116.73 37.07 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.942 0 C-N-CA 123.975 0.91 . . . . 64.21 108.604 169.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 57.0 m -93.71 117.3 29.92 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 108.219 -1.03 . . . . 72.42 108.219 176.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.458 ' HA ' ' O ' ' A' ' 94' ' ' ASN . 89.9 t -114.57 110.97 33.99 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 C-N-CA 124.258 1.023 . . . . 71.12 108.261 177.615 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -123.59 116.16 22.68 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 109.118 -0.697 . . . . 72.13 109.118 178.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -141.15 173.74 23.14 Favored Glycine 0 C--N 1.342 0.873 0 O-C-N 123.477 0.485 . . . . 42.44 112.425 -177.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 . . . . . 0 N--CA 1.469 0.504 0 C-N-CA 122.592 0.357 . . . . 71.22 110.101 177.872 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp . . . . . 0 N--CA 1.475 0.819 0 CA-C-O 120.517 0.198 . . . . 62.31 110.741 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.404 ' HA ' ' HA ' ' A' ' 26' ' ' TYR . 0.9 OUTLIER -90.42 103.32 16.02 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 107.598 -1.26 . . . . 71.44 107.598 167.06 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.5 p -99.68 142.09 15.81 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 123.987 0.915 . . . . 72.14 109.238 177.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.561 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 34.1 mt-10 -109.67 113.85 26.96 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 108.034 -1.099 . . . . 74.33 108.034 176.043 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 90.1 t -99.25 110.6 26.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 C-N-CA 124.516 1.126 . . . . 52.11 109.998 -171.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.531 ' O ' ' HA ' ' A' ' 60' ' ' ILE . 77.8 mt-30 -82.43 99.74 9.61 Favored 'General case' 0 C--N 1.347 0.474 0 N-CA-C 107.67 -1.233 . . . . 72.04 107.67 178.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 64.0 t -93.38 114.48 30.18 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 N-CA-C 107.237 -1.394 . . . . 52.2 107.237 173.787 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.7 ttpm? -122.35 103.89 9.04 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 107.818 -1.178 . . . . 74.42 107.818 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 14.1 tt -122.33 125.69 73.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 122.759 0.424 . . . . 73.31 110.542 -174.333 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 51.4 m -102.2 116.54 32.87 Favored 'General case' 0 C--O 1.241 0.657 0 C-N-CA 123.83 0.852 . . . . 75.15 109.569 176.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 54.1 t -138.89 135.15 34.17 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 124.16 0.984 . . . . 74.43 109.5 175.654 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.488 ' HB2' ' HB3' ' A' ' 51' ' ' LEU . 67.0 t30 70.22 30.29 3.46 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 124.836 1.254 . . . . 72.23 110.959 175.079 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 83.65 -7.27 69.98 Favored Glycine 0 C--N 1.353 1.487 0 CA-C-N 115.588 -0.733 . . . . 71.02 113.231 -178.053 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 44.9 mtpt -105.4 131.08 53.28 Favored 'General case' 0 C--N 1.348 0.516 0 C-N-CA 123.954 0.902 . . . . 72.52 110.252 -173.085 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 85.8 m -95.34 131.45 41.42 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 108.696 -0.853 . . . . 71.23 108.696 174.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -115.93 144.58 43.86 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 107.046 -1.465 . . . . 75.31 107.046 171.739 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -148.81 130.89 15.36 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 123.105 0.562 . . . . 75.51 109.798 175.358 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 69.9 ttt180 -154.33 134.85 13.46 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 108.471 -0.936 . . . . 72.41 108.471 178.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.411 HG22 ' HB3' ' A' ' 7' ' ' GLU . 16.6 m -101.47 116.82 33.64 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 123.66 0.784 . . . . 74.12 109.808 179.109 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 -97.65 128.71 44.55 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.22 1.008 . . . . 72.41 110.477 -173.362 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.498 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 25.2 mp0 -90.12 108.35 19.68 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 108.029 -1.1 . . . . 73.42 108.029 -178.136 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.471 HD11 HG21 ' A' ' 40' ' ' VAL . 89.8 mt -121.92 110.11 15.45 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.623 1.169 . . . . 74.43 108.921 -174.104 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.433 ' O ' ' HE3' ' A' ' 36' ' ' LYS . 82.3 t80 -92.53 134.58 34.84 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 122.732 0.413 . . . . 72.32 109.977 173.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.554 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -146.65 148.66 32.29 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.415 0.686 . . . . 75.11 110.65 177.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 88.5 t -76.38 -56.83 7.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 123.884 0.873 . . . . 75.3 109.56 175.346 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.554 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 94.5 mtt180 -102.32 164.97 11.38 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 115.534 -0.757 . . . . 72.41 110.012 175.618 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -69.72 -27.07 64.67 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 123.147 0.579 . . . . 53.01 110.636 170.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -62.34 -35.2 78.37 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.242 1.017 . . . . 53.22 111.147 176.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.554 ' HB2' ' HB1' ' A' ' 27' ' ' ALA . 13.5 mm-40 -70.51 -29.92 66.56 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.358 -0.837 . . . . 71.13 110.135 -178.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.75 HD22 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -75.69 -22.01 57.05 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.107 0.563 . . . . 72.45 110.741 -178.032 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.513 ' HG2' HG23 ' A' ' 80' ' ' ILE . 53.8 mtpt -57.19 -55.83 29.64 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 122.979 0.512 . . . . 64.13 111.13 179.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.503 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 2.4 pp20? -61.96 -30.11 70.7 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 115.648 -0.705 . . . . 74.12 112.14 179.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.75 ' HD2' HD22 ' A' ' 33' ' ' LEU . 64.3 mttm -70.39 -40.35 74.0 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.197 0.599 . . . . 75.33 110.857 179.454 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.564 HD13 HD23 ' A' ' 81' ' ' LEU . 95.7 mt -62.11 -39.69 93.37 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 123.73 0.643 . . . . 53.33 110.803 174.157 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -64.26 -37.68 88.36 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 122.997 0.519 . . . . 62.24 111.479 175.238 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.503 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 45.0 mmtm -62.88 -55.66 24.18 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 110.054 -0.35 . . . . 73.05 110.054 174.69 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.471 HG21 HD11 ' A' ' 25' ' ' LEU . 55.2 t -54.66 -49.22 69.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 124.808 1.243 . . . . 75.03 111.711 -178.542 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 40.5 mt -66.32 -45.59 79.78 Favored 'General case' 0 C--O 1.215 -0.712 0 C-N-CA 123.293 0.637 . . . . 73.11 111.601 -176.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -65.91 -42.16 90.54 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 112.247 0.462 . . . . 72.43 112.247 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.7 mm-40 -63.13 -50.82 68.94 Favored 'General case' 0 N--CA 1.486 1.344 0 CA-C-O 121.28 0.562 . . . . 52.44 110.634 177.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 15.4 tpt180 -63.7 -41.84 98.06 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.512 1.125 . . . . 73.3 111.37 -177.796 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.501 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 58.0 mtp -92.23 8.21 39.18 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.682 0.623 . . . . 74.41 112.682 -174.733 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -73.42 -51.2 5.76 Favored Pre-proline 0 CA--C 1.559 1.295 0 CA-C-O 118.447 -0.787 . . . . 75.44 111.565 174.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -69.4 -16.6 39.19 Favored 'Trans proline' 0 C--N 1.389 2.674 0 C-N-CA 121.452 1.435 . . . . 75.11 111.894 174.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 48.7 mm -72.58 -32.69 42.35 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.132 0 C-N-CA 124.42 1.088 . . . . 73.11 110.309 176.087 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.501 ' HG3' ' O ' ' A' ' 45' ' ' MET . 55.1 mttp -62.3 -41.33 98.41 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 109.387 -0.597 . . . . 73.14 109.387 171.304 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.7 tmmm? -65.58 -32.55 74.2 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.175 0.99 . . . . 43.51 110.993 178.254 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.488 ' HB3' ' HB2' ' A' ' 15' ' ' ASN . 83.6 mt -70.47 -30.73 67.61 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 110.106 -0.331 . . . . 74.12 110.106 175.352 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 71.81 56.75 6.31 Favored Glycine 0 C--N 1.348 1.24 0 O-C-N 124.014 0.821 . . . . 52.1 113.448 170.055 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.435 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 89.4 m -88.72 125.54 34.91 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 122.674 0.39 . . . . 62.02 111.303 177.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 53.5 tptt -59.91 -39.38 85.23 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.475 1.11 . . . . 72.2 110.256 170.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 25.3 ttm180 -139.85 136.44 33.98 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 109.303 -0.629 . . . . 75.0 109.303 174.306 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 15.5 m -114.3 144.2 22.39 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 C-N-CA 124.087 0.955 . . . . 63.2 109.241 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.533 ' NH1' ' HG2' ' A' ' 105' ' ' GLU . 23.3 tpp180 -100.25 103.64 15.09 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 107.52 -1.289 . . . . 74.23 107.52 175.04 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 59.6 mt -100.06 133.26 43.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 N-CA-C 107.718 -1.215 . . . . 74.23 107.718 177.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 36.5 t -137.5 102.72 4.85 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 107.529 -1.285 . . . . 72.13 107.529 -176.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.531 ' HA ' ' O ' ' A' ' 9' ' ' GLN . 45.0 mt -115.86 114.28 45.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 C-N-CA 123.214 0.606 . . . . 72.32 111.061 -172.299 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 80.0 ttt180 -105.74 140.44 38.79 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 109.079 -0.712 . . . . 65.12 109.079 176.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.1 p -94.86 141.41 15.07 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 N-CA-C 109.227 -0.657 . . . . 60.25 109.227 178.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.561 ' HB3' ' H ' ' A' ' 7' ' ' GLU . 5.3 tppp? -90.09 123.57 34.07 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 107.045 -1.465 . . . . 74.55 107.045 165.781 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 16.4 p80 -92.02 146.01 24.08 Favored 'General case' 0 C--O 1.238 0.498 0 O-C-N 123.722 0.639 . . . . 64.11 110.963 -179.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 27.7 m -84.49 -50.03 8.11 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 115.346 -0.843 . . . . 74.24 110.955 -176.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -93.06 -175.75 3.96 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.308 0.643 . . . . 73.51 111.266 179.28 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -114.56 -35.19 4.97 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.07 0.948 . . . . 54.02 111.086 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -89.0 -55.53 3.65 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.134 0.573 . . . . 72.32 111.146 174.15 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.0 mp0 -64.49 -17.88 64.27 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 125.072 1.349 . . . . 72.43 112.436 -171.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.569 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 0.6 OUTLIER -69.41 -22.34 63.69 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.272 1.029 . . . . 75.12 113.744 -174.701 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -69.01 -30.84 69.31 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.582 0.753 . . . . 72.14 109.513 177.432 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -83.14 -40.32 19.9 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.27 1.028 . . . . 62.14 110.102 172.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.569 ' HB3' ' HA ' ' A' ' 70' ' ' GLU . 44.2 tt0 -65.77 -30.26 70.88 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.955 0.902 . . . . 74.13 111.853 -176.164 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.56 -45.3 75.99 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.041 0.536 . . . . 75.34 110.314 176.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.91 -30.27 67.64 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 123.907 0.754 . . . . 72.1 111.958 176.386 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.419 ' O ' HG12 ' A' ' 80' ' ' ILE . 34.9 ttmt -65.88 -47.14 75.88 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.693 0.797 . . . . 72.12 109.383 174.624 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -73.66 -21.91 60.13 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 114.633 -1.167 . . . . 73.44 109.914 -179.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -66.55 -42.93 86.39 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 123.928 0.891 . . . . 72.31 110.639 173.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.18 -38.43 91.02 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 123.798 0.686 . . . . 72.4 110.382 175.454 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.513 HG23 ' HG2' ' A' ' 34' ' ' LYS . 36.7 mm -65.5 -44.14 94.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 124.272 1.029 . . . . 71.4 111.055 177.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.564 HD23 HD13 ' A' ' 37' ' ' LEU . 35.9 mt -64.54 -45.0 89.04 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.181 0.592 . . . . 74.4 110.088 177.399 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -59.88 -42.29 93.42 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.681 0.792 . . . . 74.23 110.694 -176.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -61.02 -49.57 76.88 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 124.081 0.863 . . . . 71.04 111.073 176.419 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 55.9 t -61.69 -51.01 77.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 123.539 0.736 . . . . 75.41 110.916 -175.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.458 ' HZ ' HD12 ' A' ' 60' ' ' ILE . 35.4 m-85 -59.04 -44.04 91.73 Favored 'General case' 0 N--CA 1.477 0.882 0 O-C-N 124.021 0.825 . . . . 73.5 111.217 179.171 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.53 -32.56 74.26 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.049 0.54 . . . . 75.34 111.681 179.162 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -85.04 -6.46 59.32 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.748 0.819 . . . . 73.52 111.755 -179.313 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 86.1 mt -104.03 -15.54 15.56 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.388 0.675 . . . . 72.45 110.517 176.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 106.98 20.9 8.44 Favored Glycine 0 C--N 1.345 1.052 0 CA-C-N 116.111 -0.495 . . . . 30.43 113.676 175.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.452 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 95.8 m-85 -88.37 129.05 35.5 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 109.277 -0.638 . . . . 62.15 109.277 169.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -77.23 161.29 28.26 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.435 1.094 . . . . 74.14 109.653 -178.048 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -59.06 -38.95 80.62 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 124.18 0.992 . . . . 72.03 111.458 175.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 8.1 t -77.87 9.36 3.62 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 124.089 0.956 . . . . 72.14 112.503 176.531 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -101.94 -23.33 14.15 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.275 0.63 . . . . 64.21 110.701 168.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 59.6 t -108.78 121.37 61.74 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 C-N-CA 124.038 0.935 . . . . 70.21 110.433 -172.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.9 m -146.06 128.85 16.29 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.996 0.918 . . . . 74.25 109.552 171.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.418 ' HA ' ' HA ' ' A' ' 102' ' ' VAL . 33.7 m95 -73.09 152.73 41.1 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-O 121.468 0.651 . . . . 73.43 111.804 177.214 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -139.45 78.31 1.66 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.953 1.301 . . . . 71.45 107.555 176.241 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 63.92 -98.98 0.27 Allowed Glycine 0 C--N 1.345 1.074 0 CA-C-N 114.974 -1.012 . . . . 32.44 113.602 179.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -84.24 -25.72 29.22 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.648 0.779 . . . . 72.33 112.006 -177.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 28.7 m -125.33 138.04 54.06 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.504 0.722 . . . . 73.02 110.282 -168.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . 0.418 ' HA ' ' HA ' ' A' ' 97' ' ' TRP . 12.2 p -91.59 137.04 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.009 0 N-CA-C 109.489 -0.56 . . . . 52.35 109.489 176.676 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 27.1 m -102.18 106.45 17.29 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.616 1.166 . . . . 74.31 108.266 177.227 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 70.2 t -118.08 112.23 37.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 N-CA-C 108.323 -0.992 . . . . 62.04 108.323 -179.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . 0.533 ' HG2' ' NH1' ' A' ' 57' ' ' ARG . 0.1 OUTLIER -140.92 140.11 34.43 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 122.695 0.398 . . . . 75.24 110.087 178.82 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 160.88 -150.07 19.66 Favored Glycine 0 C--O 1.241 0.59 0 N-CA-C 111.098 -0.801 . . . . 71.14 111.098 -172.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 . . . . . 0 CA--C 1.552 1.042 0 C-N-CA 123.587 0.755 . . . . 63.13 112.262 -175.659 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 33.6 tptt . . . . . 0 N--CA 1.472 0.67 0 CA-C-O 120.549 0.214 . . . . 64.32 111.378 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.439 ' HB2' ' HD1' ' A' ' 26' ' ' TYR . 34.8 ttpt -127.27 107.32 9.89 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 109.072 -0.714 . . . . 51.42 109.072 174.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.1 p -100.69 143.97 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 N-CA-C 108.993 -0.743 . . . . 53.12 108.993 173.363 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.409 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 42.3 mt-10 -113.63 115.09 27.35 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 109.332 -0.618 . . . . 71.42 109.332 177.738 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 73.1 t -105.59 115.71 47.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 124.944 1.298 . . . . 73.32 110.062 -168.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.412 ' O ' ' HA ' ' A' ' 60' ' ' ILE . 38.7 mt-30 -97.08 99.59 11.09 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 108.576 -0.898 . . . . 62.33 108.576 -177.043 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.424 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 67.1 t -95.48 109.08 21.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 N-CA-C 109.092 -0.707 . . . . 61.41 109.092 -177.594 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.518 ' HE2' ' HB2' ' A' ' 59' ' ' SER . 35.6 ttpt -110.15 105.28 14.3 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 108.436 -0.95 . . . . 74.14 108.436 177.732 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.412 HD11 HG21 ' A' ' 48' ' ' ILE . 10.9 tt -118.15 123.71 72.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 122.983 0.513 . . . . 70.14 111.015 -174.61 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 41.8 m -95.99 110.82 22.98 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 123.259 0.624 . . . . 63.45 109.425 176.216 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.644 ' SG ' HG23 ' A' ' 48' ' ' ILE . 8.9 t -145.78 132.63 20.1 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.504 1.122 . . . . 75.41 110.185 179.655 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 62.78 35.22 13.96 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 124.479 1.111 . . . . 73.54 110.499 174.024 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.88 12.12 78.6 Favored Glycine 0 C--N 1.351 1.37 0 CA-C-N 115.255 -0.884 . . . . 60.14 114.234 177.089 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.51 ' HE2' ' HA ' ' A' ' 17' ' ' LYS . 8.0 mmpt? -125.23 142.23 51.62 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.567 0.747 . . . . 64.11 109.847 175.096 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 88.3 m -110.89 118.53 36.37 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 109.007 -0.738 . . . . 61.44 109.007 178.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.415 ' HB3' ' NH1' ' A' ' 44' ' ' ARG . 13.5 m-85 -108.06 109.76 21.28 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.525 1.13 . . . . 73.42 108.026 -172.681 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.478 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 1.7 pp20? -127.52 142.02 51.5 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 122.455 0.302 . . . . 64.15 111.46 -178.8 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 58.2 ttt180 -168.32 143.17 3.48 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.868 0.867 . . . . 70.24 109.553 178.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 23.9 m -89.79 118.16 29.18 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.347 1.059 . . . . 63.03 109.391 173.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -101.87 135.49 43.33 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.813 0.845 . . . . 65.21 109.729 -179.043 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -91.68 107.63 19.35 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 107.514 -1.291 . . . . 74.33 107.514 179.233 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.508 HD21 HG21 ' A' ' 40' ' ' VAL . 70.6 mt -111.14 99.4 8.25 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 109.076 -0.713 . . . . 73.34 109.076 -178.789 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.439 ' HD1' ' HB2' ' A' ' 5' ' ' LYS . 52.7 t80 -93.28 144.3 25.44 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.652 0.781 . . . . 54.22 109.571 177.343 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.571 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -158.26 160.62 37.28 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.186 0.995 . . . . 70.31 109.316 -179.012 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 56.4 t -75.85 -65.78 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 N-CA-C 108.308 -0.997 . . . . 72.14 108.308 170.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.527 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 97.8 mtt180 -96.03 162.18 13.66 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-O 121.064 0.459 . . . . 74.13 110.556 175.258 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 18.6 p-10 -69.96 -26.74 64.25 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.114 0.966 . . . . 60.04 111.222 174.229 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -69.1 -25.22 64.3 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 122.915 0.486 . . . . 71.41 111.438 175.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.571 ' HB2' ' HB1' ' A' ' 27' ' ' ALA . 11.5 mm-40 -70.77 -30.84 67.43 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.226 0.611 . . . . 75.54 109.997 177.319 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.465 HD22 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -66.19 -23.84 66.52 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 124.388 1.075 . . . . 75.04 110.97 -178.887 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -54.95 -58.66 6.7 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.661 0.784 . . . . 65.31 111.906 -178.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.8 pp20? -65.69 -25.94 67.55 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 122.52 0.328 . . . . 71.53 111.783 -178.122 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.465 ' HD2' HD22 ' A' ' 33' ' ' LEU . 59.5 mttm -69.42 -41.91 75.73 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.331 0.652 . . . . 71.43 110.637 177.175 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.521 HD13 HD23 ' A' ' 81' ' ' LEU . 84.8 mt -61.79 -44.07 97.6 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 123.909 0.755 . . . . 74.12 110.578 173.443 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -56.79 -42.14 78.95 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 122.931 0.493 . . . . 72.43 110.822 176.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -62.78 -61.78 2.17 Favored 'General case' 0 C--O 1.218 -0.593 0 O-C-N 123.98 0.8 . . . . 74.22 110.743 177.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.508 HG21 HD21 ' A' ' 25' ' ' LEU . 99.1 t -60.04 -37.84 74.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 123.363 0.665 . . . . 64.44 111.763 -173.416 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.457 HD21 HD11 ' A' ' 60' ' ' ILE . 48.9 mt -71.63 -47.71 52.7 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.326 0.65 . . . . 73.55 111.362 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -70.01 -32.24 70.31 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 122.906 0.482 . . . . 74.34 110.923 -177.18 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -82.38 -34.58 28.32 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.112 0.965 . . . . 74.32 110.686 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.415 ' NH1' ' HB3' ' A' ' 19' ' ' TYR . 5.4 tpm_? -60.09 -44.52 94.75 Favored 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 108.956 -0.757 . . . . 71.15 108.956 169.276 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.494 ' HA ' ' HB ' ' A' ' 48' ' ' ILE . 68.7 mtp -88.67 1.04 55.8 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-N 114.465 -1.243 . . . . 75.34 112.531 -178.469 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -65.54 -50.5 56.51 Favored Pre-proline 0 N--CA 1.483 1.199 0 CA-C-N 119.191 0.905 . . . . 71.21 111.15 178.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.53 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 57.5 Cg_endo -68.28 -23.15 39.02 Favored 'Trans proline' 0 C--N 1.388 2.613 0 C-N-CA 121.634 1.556 . . . . 54.52 111.707 172.198 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.644 HG23 ' SG ' ' A' ' 14' ' ' CYS . 47.5 mm -75.5 -34.92 30.87 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.034 0 C-N-CA 124.379 1.072 . . . . 70.13 110.509 -177.03 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' A' ' 45' ' ' MET . 35.7 mtmm -82.8 -12.17 57.69 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.494 0.717 . . . . 71.44 109.951 177.59 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -80.57 -33.06 36.41 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.24 1.016 . . . . 73.35 109.586 164.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 95.7 mt -73.26 -28.45 62.14 Favored 'General case' 0 N--CA 1.484 1.245 0 N-CA-C 109.759 -0.46 . . . . 52.43 109.759 178.566 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 67.65 32.58 78.67 Favored Glycine 0 C--N 1.354 1.529 0 CA-C-N 115.645 -0.707 . . . . 71.34 113.514 173.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.421 ' SG ' HG23 ' A' ' 48' ' ' ILE . 1.6 p -67.8 110.32 3.75 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 109.471 -0.566 . . . . 74.31 109.471 176.137 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 6.9 mtpm? -62.38 -20.42 64.4 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.527 1.131 . . . . 72.21 112.788 -171.758 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 43.4 ttp180 -136.4 131.08 33.7 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 108.585 -0.894 . . . . 74.22 108.585 173.033 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 35.6 m -124.49 136.88 59.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 109.11 -0.7 . . . . 71.41 109.11 173.222 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 54.9 ttt180 -106.69 105.38 15.38 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 108.184 -1.043 . . . . 73.31 108.184 177.057 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.41 HG22 HG13 ' A' ' 60' ' ' ILE . 32.8 mt -107.43 104.15 16.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 123.259 0.623 . . . . 40.11 109.435 -175.791 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.518 ' HB2' ' HE2' ' A' ' 11' ' ' LYS . 20.3 m -97.78 104.6 16.64 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 108.347 -0.983 . . . . 64.22 108.347 175.545 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.493 ' HB ' HG13 ' A' ' 102' ' ' VAL . 85.8 mt -97.71 110.24 25.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 123.831 0.852 . . . . 52.33 109.719 -179.782 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 27.7 mtm105 -98.38 107.72 20.25 Favored 'General case' 0 C--O 1.237 0.442 0 N-CA-C 107.05 -1.463 . . . . 74.13 107.05 175.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.1 p -94.61 137.18 23.76 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 N-CA-C 109.125 -0.695 . . . . 72.13 109.125 -171.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.409 ' HB3' ' H ' ' A' ' 7' ' ' GLU . 34.5 ttmt -82.37 118.74 23.4 Favored 'General case' 0 C--N 1.35 0.624 0 N-CA-C 109.527 -0.546 . . . . 71.22 109.527 -176.216 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 50.9 m80 -83.74 150.49 25.78 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 124.634 1.174 . . . . 73.45 108.922 177.497 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 29.7 t -65.68 -52.66 49.79 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 123.525 0.516 . . . . 74.32 112.05 -172.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.608 ' H ' ' HB2' ' A' ' 69' ' ' GLU . 15.2 m-20 -140.84 -175.9 4.47 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 124.242 1.017 . . . . 71.33 108.949 -174.11 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.8 -54.13 15.03 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.646 0.778 . . . . 73.32 111.687 -178.044 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.21 -23.36 62.0 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 122.926 0.49 . . . . 51.11 110.406 175.086 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.608 ' HB2' ' H ' ' A' ' 66' ' ' ASP . 24.9 mm-40 -76.56 -11.02 59.8 Favored 'General case' 0 C--O 1.211 -0.922 0 CA-C-O 118.755 -0.641 . . . . 71.5 112.51 174.49 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -57.17 -51.63 68.54 Favored 'General case' 0 N--CA 1.488 1.46 0 CA-C-N 119.241 0.928 . . . . 74.14 110.971 173.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -71.89 -30.74 65.71 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.087 0.555 . . . . 73.44 111.244 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 4.5 tppp? -67.32 -60.61 2.45 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.324 0.65 . . . . 64.23 109.581 178.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -67.0 -15.2 63.58 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.573 1.149 . . . . 73.31 112.164 178.557 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.36 -62.45 1.67 Allowed 'General case' 0 C--N 1.351 0.671 0 CA-C-N 118.882 0.764 . . . . 74.02 109.856 172.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -69.04 -40.11 78.78 Favored 'General case' 0 CA--C 1.55 0.963 0 O-C-N 124.171 0.919 . . . . 63.43 111.68 -179.318 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 48.3 tttm -67.29 -50.8 58.88 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.907 0.883 . . . . 73.13 111.95 -176.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -75.45 -20.27 58.94 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 110.127 -0.323 . . . . 74.35 110.127 177.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.92 -37.93 74.98 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 122.588 0.355 . . . . 62.34 111.168 171.44 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.489 ' O ' ' HG2' ' A' ' 83' ' ' LYS . . . -63.77 -45.87 87.84 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.227 0.611 . . . . 53.01 110.665 175.762 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.468 ' O ' HG23 ' A' ' 84' ' ' VAL . 49.4 mm -61.35 -45.61 98.26 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 C-N-CA 123.914 0.885 . . . . 61.11 110.325 -178.748 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.547 HD13 HG11 ' A' ' 102' ' ' VAL . 35.8 mt -69.58 -41.82 75.32 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.66 0.784 . . . . 75.25 111.39 178.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -56.31 -43.22 78.74 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 124.331 1.052 . . . . 61.41 110.624 -176.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.489 ' HG2' ' O ' ' A' ' 79' ' ' ALA . 33.6 mmtp -68.14 -42.23 80.47 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 114.67 -1.15 . . . . 73.31 110.758 179.734 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 80' ' ' ILE . 51.1 t -64.34 -47.95 87.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 C-N-CA 123.544 0.738 . . . . 73.12 110.468 -176.097 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.55 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 25.6 m-85 -61.13 -41.36 96.58 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.28 -0.873 . . . . 74.04 110.437 177.224 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.66 -25.39 66.54 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.494 0.718 . . . . 70.43 111.825 176.397 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -86.11 -9.69 56.22 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 124.018 0.927 . . . . 75.35 111.2 176.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 94.5 mt -106.1 -25.17 12.15 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.221 0.608 . . . . 63.43 111.023 -178.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 116.34 17.09 6.29 Favored Glycine 0 N--CA 1.475 1.29 0 C-N-CA 122.945 0.307 . . . . 53.13 113.696 177.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.55 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 10.3 m-85 -104.14 125.72 50.68 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 107.986 -1.116 . . . . 74.21 107.986 173.159 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -123.71 97.89 5.58 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 122.929 0.491 . . . . 62.21 110.833 -170.308 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 64.19 -72.09 0.06 Allowed 'General case' 0 N--CA 1.494 1.765 0 C-N-CA 125.254 1.422 . . . . 55.33 114.176 164.51 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 14.6 m -57.08 -30.45 64.32 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 125.068 1.347 . . . . 64.32 112.502 -178.051 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . 0.412 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 10.7 m120 -66.1 -39.73 90.2 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.483 0.713 . . . . 75.22 111.008 176.476 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.416 ' HA ' HG22 ' A' ' 104' ' ' VAL . 47.6 t -93.02 106.99 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 124.999 1.32 . . . . 75.03 110.276 -167.619 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 44.5 m -123.93 126.66 46.73 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 122.996 0.518 . . . . 65.54 110.22 178.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 55.1 m95 -89.84 147.16 23.94 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 122.968 0.507 . . . . 74.15 110.491 174.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -156.86 98.15 1.75 Allowed 'General case' 0 CA--C 1.554 1.109 0 C-N-CA 124.658 1.183 . . . . 65.03 109.166 -177.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 77.54 -99.78 1.5 Allowed Glycine 0 C--N 1.35 1.324 0 CA-C-N 115.36 -0.836 . . . . 64.15 112.979 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -110.86 -7.3 14.6 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 124.409 1.084 . . . . 71.31 110.153 177.052 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 22.0 m -103.45 153.68 20.25 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.188 1.395 . . . . 74.42 110.659 -168.417 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . 0.547 HG11 HD13 ' A' ' 81' ' ' LEU . 2.7 p -128.9 104.62 11.63 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.877 0 C-N-CA 124.323 1.049 . . . . 75.52 108.627 167.238 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 24.3 m -91.97 104.92 17.28 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.646 0.778 . . . . 73.34 108.937 -178.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.416 HG22 ' HA ' ' A' ' 95' ' ' VAL . 53.1 t -102.01 121.99 53.68 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 C-N-CA 124.825 1.25 . . . . 74.15 109.485 179.573 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -89.03 126.27 35.36 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 108.77 -0.826 . . . . 63.52 108.77 172.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -106.27 154.83 16.81 Favored Glycine 0 N--CA 1.468 0.789 0 N-CA-C 111.131 -0.788 . . . . 65.45 111.131 173.612 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 . . . . . 0 N--CA 1.477 0.925 0 C-N-CA 123.431 0.692 . . . . 75.42 109.584 178.262 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.737 0 N-CA-C 108.698 -0.853 . . . . 71.15 108.698 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.41 ' HD2' ' HB3' ' A' ' 24' ' ' GLN . 38.4 ttpt -89.78 111.88 23.02 Favored 'General case' 0 C--O 1.241 0.655 0 N-CA-C 109.406 -0.59 . . . . 75.14 109.406 179.321 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.68 HG21 HG13 ' A' ' 62' ' ' VAL . 3.9 p -98.34 142.87 13.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 N-CA-C 107.927 -1.138 . . . . 74.21 107.927 174.149 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.42 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 44.6 mt-10 -105.52 109.95 22.1 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 107.427 -1.323 . . . . 73.14 107.427 176.265 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 73.2 t -99.16 113.26 33.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 114.355 -1.293 . . . . 70.43 108.705 -173.708 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.454 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 46.8 mt-30 -104.35 99.92 9.63 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 108.57 -0.9 . . . . 52.1 108.57 -176.159 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.441 HG22 HG12 ' A' ' 60' ' ' ILE . 74.9 t -95.18 108.48 20.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 N-CA-C 108.591 -0.892 . . . . 63.25 108.591 -178.227 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.44 ' HE2' ' HB2' ' A' ' 59' ' ' SER . 36.2 ttpt -109.9 107.27 17.15 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.278 -0.874 . . . . 74.4 108.984 -174.17 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.445 HD13 HG13 ' A' ' 48' ' ' ILE . 14.8 tt -123.55 116.52 48.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 123.086 0.554 . . . . 75.01 110.126 -177.136 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 93.1 m -94.15 124.28 38.07 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 109.568 -0.53 . . . . 72.0 109.568 178.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.436 ' SG ' HG23 ' A' ' 48' ' ' ILE . 47.6 t -150.6 151.56 32.75 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.626 1.17 . . . . 52.12 109.138 -178.171 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 36.1 t30 69.97 -78.23 0.05 OUTLIER 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 124.89 1.276 . . . . 74.55 109.798 -176.674 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -165.19 11.69 0.08 OUTLIER Glycine 0 N--CA 1.462 0.431 0 CA-C-N 115.487 -0.779 . . . . 51.11 111.293 174.176 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -123.19 156.79 34.39 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.231 1.012 . . . . 74.2 110.45 -173.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 93.6 m -103.22 111.9 24.5 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.318 1.047 . . . . 62.23 109.023 175.101 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 52.8 m-85 -100.46 101.14 12.01 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 108.078 -1.082 . . . . 71.25 108.078 -177.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -134.32 156.16 48.96 Favored 'General case' 0 C--O 1.239 0.519 0 C-N-CA 123.276 0.63 . . . . 74.31 110.695 -177.267 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.3 ttm180 -159.76 146.8 16.53 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.401 -0.818 . . . . 73.5 108.866 175.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 31.8 m -89.09 105.75 17.99 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 108.265 -1.013 . . . . 64.14 108.265 171.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 81.9 m-85 -95.9 119.77 34.97 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.8 0.84 . . . . 64.01 108.859 -177.003 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.42 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 26.6 mp0 -88.2 108.08 19.11 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 107.987 -1.116 . . . . 75.1 107.987 -179.676 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.455 HD22 ' HB3' ' A' ' 36' ' ' LYS . 78.6 mt -115.17 99.63 7.56 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.745 0.818 . . . . 74.34 109.189 -175.058 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.407 ' O ' ' HE3' ' A' ' 36' ' ' LYS . 87.8 t80 -94.11 133.61 37.42 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 108.932 -0.766 . . . . 75.14 108.932 172.614 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.522 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -130.47 171.81 12.58 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.479 0.711 . . . . 73.44 109.663 175.785 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 26.4 t -95.66 -32.27 4.37 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 N-CA-C 109.319 -0.623 . . . . 74.41 109.319 172.477 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.486 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 35.1 mtt180 -132.39 169.57 16.34 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.903 0.881 . . . . 64.43 109.465 179.369 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -66.59 -41.3 88.7 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.871 0.868 . . . . 74.34 110.976 175.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -65.49 -22.01 66.69 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.514 1.126 . . . . 75.51 111.885 -178.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.522 ' HB2' ' HB1' ' A' ' 27' ' ' ALA . 28.5 mm-40 -78.8 -26.5 44.33 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.377 0.671 . . . . 63.24 111.039 -179.543 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.507 HD22 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -71.4 -23.43 61.87 Favored 'General case' 0 CA--C 1.557 1.24 0 C-N-CA 123.821 0.848 . . . . 55.42 110.434 -176.344 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.535 ' HG2' HG23 ' A' ' 80' ' ' ILE . 7.8 mtmp? -57.42 -54.19 49.68 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.303 0.641 . . . . 73.35 111.713 -175.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.569 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 1.9 pp20? -60.6 -31.52 70.68 Favored 'General case' 0 C--N 1.354 0.8 0 CA-C-N 115.814 -0.63 . . . . 74.13 111.115 -176.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.507 ' HD2' HD22 ' A' ' 33' ' ' LEU . 58.4 mttm -67.31 -43.58 81.29 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.797 0.839 . . . . 55.14 110.417 178.87 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.428 HD13 HD23 ' A' ' 81' ' ' LEU . 75.5 mt -61.05 -39.43 89.8 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.902 0.881 . . . . 73.45 110.687 175.625 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.402 ' HD3' ' HA ' ' A' ' 35' ' ' GLU . 57.3 mtpt -63.87 -42.61 97.47 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.466 0.707 . . . . 74.22 111.042 175.794 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.569 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 31.7 mmtp -61.03 -48.12 83.26 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 109.698 -0.482 . . . . 65.15 109.698 177.492 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 52.9 t -57.13 -50.4 76.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 124.847 1.259 . . . . 54.33 112.032 178.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 70.3 mt -70.75 -49.24 48.93 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.256 0.622 . . . . 53.23 111.12 -173.383 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.402 ' O ' ' HB2' ' A' ' 46' ' ' ASP . 92.3 m-20 -60.92 -39.05 87.94 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 122.887 0.475 . . . . 74.13 111.162 177.221 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -63.54 -55.01 27.28 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.662 0.785 . . . . 73.43 110.951 179.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.4 tpm_? -71.0 -33.19 70.15 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 115.573 -0.74 . . . . 72.52 110.92 -173.242 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 59.6 mtp -89.02 -6.65 57.02 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 112.773 0.657 . . . . 71.32 112.773 -178.19 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.402 ' HB2' ' O ' ' A' ' 42' ' ' ASN . 29.5 t70 -61.61 -50.31 82.89 Favored Pre-proline 0 CA--C 1.569 1.683 0 CA-C-O 118.739 -0.648 . . . . 74.42 111.855 178.633 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -71.95 -21.32 24.55 Favored 'Trans proline' 0 C--N 1.391 2.767 0 C-N-CA 121.87 1.713 . . . . 62.45 112.631 174.245 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.445 HG13 HD13 ' A' ' 12' ' ' ILE . 49.3 mm -68.99 -31.46 50.54 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.262 0 C-N-CA 123.549 0.74 . . . . 65.01 109.91 -178.278 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 60.1 mttm -63.32 -39.93 95.91 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.243 -0.889 . . . . 75.24 110.412 174.131 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.48 -28.99 62.23 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 123.429 0.691 . . . . 75.43 109.798 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 94.6 mt -69.85 -33.13 71.86 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 109.703 -0.481 . . . . 63.2 109.703 176.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 69.94 47.98 43.55 Favored Glycine 0 C--N 1.344 0.999 0 CA-C-N 115.097 -0.956 . . . . 51.34 113.246 173.242 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 99.3 m -75.98 120.98 22.05 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 109.9 -0.408 . . . . 72.04 109.9 174.05 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 6.6 ptpp? -60.07 -23.19 63.57 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.435 1.094 . . . . 65.51 112.082 177.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 14.3 ttp180 -159.66 139.54 11.61 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.778 0.831 . . . . 53.02 109.182 175.048 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 17.3 m -129.32 150.57 34.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 124.229 1.012 . . . . 64.15 109.944 177.286 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 26.6 ttt180 -101.84 115.48 30.63 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 108.353 -0.98 . . . . 73.33 108.353 170.209 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 21.1 mt -108.58 102.31 13.8 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 N-CA-C 108.424 -0.954 . . . . 75.13 108.424 177.431 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.44 ' HB2' ' HE2' ' A' ' 11' ' ' LYS . 57.2 m -102.67 104.97 15.35 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 108.551 -0.907 . . . . 64.14 108.551 178.559 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.473 ' HB ' HG13 ' A' ' 102' ' ' VAL . 63.3 mt -99.13 111.66 29.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 124.227 1.011 . . . . 74.11 109.537 -176.085 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.454 ' HB2' ' HB2' ' A' ' 9' ' ' GLN . 2.6 mpt_? -90.88 133.8 34.95 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 108.481 -0.933 . . . . 75.41 108.481 177.044 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.68 HG13 HG21 ' A' ' 6' ' ' VAL . 39.0 t -107.32 110.78 33.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 N-CA-C 107.581 -1.266 . . . . 65.11 107.581 173.048 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.12 101.96 9.96 Favored 'General case' 0 C--N 1.353 0.751 0 N-CA-C 107.095 -1.446 . . . . 65.01 107.095 -176.018 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . 0.492 ' HD2' HG12 ' A' ' 62' ' ' VAL . 65.0 m170 -68.13 108.73 3.23 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 114.796 -1.093 . . . . 72.25 110.369 -175.204 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 47.8 t -60.22 -58.34 8.92 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 124.147 0.905 . . . . 74.33 111.379 -173.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -106.93 143.17 35.41 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.513 0.725 . . . . 75.41 110.718 -176.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.445 ' O ' ' HG2' ' A' ' 70' ' ' GLU . . . -72.59 -46.41 54.37 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.833 0.853 . . . . 71.0 111.563 -175.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -67.81 -31.75 71.83 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.02 0.528 . . . . 75.42 112.004 -179.735 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -80.51 -32.78 36.84 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 112.47 0.544 . . . . 74.13 112.47 -174.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.604 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 12.8 pt-20 -66.31 -17.63 64.87 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 114.556 1.317 . . . . 62.2 114.556 -165.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -70.59 -44.46 67.3 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 108.899 -0.778 . . . . 72.35 108.899 176.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 16.6 tppt? -71.5 -44.33 64.9 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 114.945 -1.025 . . . . 70.1 110.277 174.598 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.604 ' HB3' ' HA ' ' A' ' 70' ' ' GLU . 0.3 OUTLIER -63.84 -52.49 59.88 Favored 'General case' 0 C--O 1.209 -1.076 0 CA-C-N 114.603 -1.181 . . . . 73.11 110.982 -170.365 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.78 -49.58 74.87 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.526 0.73 . . . . 41.43 112.186 -175.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -56.36 -47.39 78.95 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 114.945 -1.025 . . . . 31.21 111.678 177.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -78.85 -22.53 45.96 Favored 'General case' 0 CA--C 1.556 1.207 0 C-N-CA 123.355 0.662 . . . . 61.52 111.317 -177.095 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -81.79 -21.76 37.53 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.939 0.896 . . . . 72.23 109.204 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -59.73 -36.17 76.05 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.087 0.555 . . . . 73.2 110.006 169.416 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -74.7 -37.02 62.73 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.895 0.878 . . . . 53.01 111.324 176.169 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.535 HG23 ' HG2' ' A' ' 34' ' ' LYS . 31.8 mm -62.42 -43.73 98.53 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 C-N-CA 123.853 0.861 . . . . 54.31 110.456 175.814 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.543 HD13 HG11 ' A' ' 102' ' ' VAL . 47.5 mt -67.34 -39.33 85.76 Favored 'General case' 0 C--O 1.22 -0.486 0 C-N-CA 124.243 1.017 . . . . 72.0 110.289 176.649 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -62.89 -34.9 78.38 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.725 0.81 . . . . 73.51 110.996 179.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 41.6 mmtm -61.56 -51.29 69.19 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 123.511 0.507 . . . . 73.02 110.306 172.007 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.472 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 73.9 t -61.31 -46.9 95.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 124.174 0.99 . . . . 61.11 110.73 -173.789 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.512 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 21.1 m-85 -61.5 -35.46 77.74 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 115.267 -0.879 . . . . 75.32 110.54 179.581 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -76.02 -29.53 58.14 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.999 0.519 . . . . 73.13 111.366 176.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -78.58 -13.7 59.69 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 122.997 0.519 . . . . 72.22 110.249 178.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 57.7 mt -108.86 -25.14 10.93 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.791 0.836 . . . . 61.11 110.725 178.22 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 119.77 -17.63 10.08 Favored Glycine 0 C--N 1.349 1.278 0 N-CA-C 115.207 0.843 . . . . 51.02 115.207 176.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.512 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 36.9 m-85 -59.83 135.76 57.79 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.619 0.768 . . . . 74.1 111.476 -177.241 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -99.05 167.75 10.52 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.965 0.906 . . . . 64.22 111.799 -172.181 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -56.66 -39.43 73.72 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 125.106 1.363 . . . . 73.51 112.516 -179.408 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 51.2 p -59.5 -29.03 67.57 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.299 1.039 . . . . 54.24 111.873 179.135 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -84.16 -26.55 28.74 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.706 0.802 . . . . 72.22 111.72 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 44.7 t -83.52 104.96 12.67 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 N-CA-C 109.364 -0.606 . . . . 74.25 109.364 -175.467 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 97.2 m -133.02 112.88 12.19 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.442 0.697 . . . . 63.34 110.248 178.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 59.8 m95 -76.32 112.3 12.67 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 123.198 0.599 . . . . 74.05 110.481 178.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -121.6 106.08 11.03 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.753 1.221 . . . . 64.21 109.303 179.608 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 72.86 54.75 6.95 Favored Glycine 0 C--N 1.35 1.342 0 O-C-N 123.518 0.511 . . . . 51.24 113.99 172.417 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 60.03 22.77 11.93 Favored 'General case' 0 N--CA 1.503 2.179 0 C-N-CA 124.755 1.222 . . . . 64.3 111.757 -179.383 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 40.4 m -138.96 141.71 38.41 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.073 1.349 . . . . 72.12 107.685 -171.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . 0.543 HG11 HD13 ' A' ' 81' ' ' LEU . 5.1 p -94.99 107.65 19.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 N-CA-C 108.878 -0.786 . . . . 71.43 108.878 179.271 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 89.0 m -98.55 107.72 20.24 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.766 0.826 . . . . 72.54 109.145 -178.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 45.2 t -94.73 131.87 40.35 Favored 'Isoleucine or valine' 0 C--O 1.243 0.733 0 C-N-CA 124.818 1.247 . . . . 70.45 109.631 -178.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -85.13 112.92 21.12 Favored 'General case' 0 C--O 1.24 0.556 0 N-CA-C 107.647 -1.242 . . . . 72.22 107.647 170.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -110.29 137.08 14.04 Favored Glycine 0 N--CA 1.465 0.617 0 CA-C-N 117.8 0.273 . . . . 60.05 112.889 -177.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 . . . . . 0 C--O 1.239 0.505 0 N-CA-C 106.126 -1.805 . . . . 63.03 106.126 164.379 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? . . . . . 0 N--CA 1.472 0.657 0 N-CA-C 109.707 -0.479 . . . . 73.25 109.707 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.483 ' HA ' ' HA ' ' A' ' 26' ' ' TYR . 23.7 ttpp -83.81 115.04 22.05 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.18 -1.044 . . . . 71.54 108.18 165.637 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -101.53 152.56 5.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 N-CA-C 106.341 -1.725 . . . . 64.32 106.341 170.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.476 ' H ' ' HB2' ' A' ' 63' ' ' LYS . 42.6 mt-10 -120.0 114.55 22.2 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.676 0.75 . . . . 73.12 109.607 175.59 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.407 HG21 HD12 ' A' ' 25' ' ' LEU . 62.3 t -96.36 113.39 30.61 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 125.105 1.362 . . . . 55.44 109.165 -174.434 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 91.9 mt-30 -96.94 103.03 14.92 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 108.231 -1.026 . . . . 55.52 108.231 -178.125 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 79.9 t -95.98 110.01 23.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 N-CA-C 109.028 -0.73 . . . . 64.32 109.028 -177.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.405 ' HG3' ' HB3' ' A' ' 20' ' ' GLU . 39.5 ttmt -113.21 102.79 10.7 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.905 0.882 . . . . 72.35 108.754 -178.339 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 10.3 tt -118.07 118.07 56.94 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 C-N-CA 123.098 0.559 . . . . 70.13 110.302 -176.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 60.1 m -90.62 110.49 21.64 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 109.079 -0.711 . . . . 72.42 109.079 175.663 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.609 ' SG ' HG23 ' A' ' 48' ' ' ILE . 42.4 t -112.67 124.47 52.63 Favored 'General case' 0 C--O 1.244 0.796 0 N-CA-C 107.631 -1.248 . . . . 70.33 107.631 179.353 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.517 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 43.8 t30 70.19 -80.45 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.021 1.328 . . . . 64.22 109.51 -176.314 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -158.98 18.47 0.27 Allowed Glycine 0 N--CA 1.464 0.536 0 N-CA-C 111.166 -0.774 . . . . 70.22 111.166 176.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.477 ' HE2' ' HA ' ' A' ' 17' ' ' LYS . 11.1 mmpt? -117.46 126.23 52.27 Favored 'General case' 0 C--N 1.348 0.529 0 C-N-CA 124.344 1.058 . . . . 75.32 108.77 -179.562 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 38.2 m -94.68 122.09 36.92 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.646 0.778 . . . . 51.14 109.532 -176.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.688 ' HB3' HH21 ' A' ' 44' ' ' ARG . 67.3 m-85 -113.71 101.21 9.1 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.807 0.843 . . . . 74.53 109.639 -175.172 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.405 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 12.8 pt-20 -118.82 149.24 41.85 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.408 0.683 . . . . 74.33 110.528 -178.476 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 39.8 ttp180 -166.22 137.08 3.52 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.622 0.769 . . . . 72.24 109.904 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 39.4 m -86.24 109.36 18.88 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 109.009 -0.737 . . . . 60.42 109.009 175.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 28.3 m-85 -96.7 134.33 40.1 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 107.985 -1.117 . . . . 72.54 107.985 177.338 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -92.58 108.52 20.04 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 107.661 -1.237 . . . . 63.23 107.661 177.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.407 HD12 HG21 ' A' ' 8' ' ' VAL . 69.7 mt -111.62 96.81 6.31 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 109.187 -0.672 . . . . 44.5 109.187 177.281 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.483 ' HA ' ' HA ' ' A' ' 5' ' ' LYS . 44.6 t80 -93.41 133.92 36.19 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.259 1.024 . . . . 61.01 109.19 173.536 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.556 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -151.67 144.79 24.61 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 122.453 0.301 . . . . 51.44 111.217 179.387 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 94.3 t -65.12 -45.98 92.52 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 O-C-N 124.578 1.174 . . . . 30.43 109.586 173.29 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.564 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 58.4 mtt85 -124.05 155.96 37.38 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.42 0.688 . . . . 74.52 110.118 -179.186 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -65.37 -27.35 68.51 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.58 0.752 . . . . 74.24 110.37 170.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -53.08 -44.88 67.9 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.419 1.088 . . . . 64.33 110.962 168.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.564 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 13.6 mm-40 -73.1 -23.73 60.56 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 115.527 -0.76 . . . . 75.43 111.143 -177.433 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.418 HD22 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -76.15 -26.83 56.67 Favored 'General case' 0 CA--C 1.559 1.292 0 C-N-CA 123.346 0.658 . . . . 71.2 110.133 -178.28 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.498 ' HG2' HG23 ' A' ' 80' ' ' ILE . 55.7 mtpt -60.64 -47.38 86.49 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 123.386 0.674 . . . . 74.33 112.765 -176.037 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -62.33 -35.39 78.94 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.527 0.731 . . . . 75.12 111.511 175.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.418 ' HD2' HD22 ' A' ' 33' ' ' LEU . 66.7 mttm -67.72 -42.82 81.34 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.655 0.782 . . . . 64.11 110.54 -179.069 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.466 HD13 HD23 ' A' ' 81' ' ' LEU . 88.8 mt -59.27 -45.95 89.85 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 124.15 0.906 . . . . 71.33 110.216 176.029 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -54.76 -48.47 72.58 Favored 'General case' 0 N--CA 1.482 1.144 0 O-C-N 123.741 0.651 . . . . 72.04 110.964 174.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.477 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 4.5 mmmp? -60.81 -59.51 5.27 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.233 0.613 . . . . 74.44 110.98 -178.23 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 60.7 t -48.65 -44.49 14.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 C-N-CA 125.196 1.398 . . . . 63.03 111.894 -178.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.468 HD21 HD11 ' A' ' 60' ' ' ILE . 58.5 mt -65.88 -51.41 59.0 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.312 -0.858 . . . . 73.03 110.802 177.305 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -68.56 -22.35 64.48 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 113.145 0.794 . . . . 72.55 113.145 -176.438 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 15.6 mm-40 -74.73 -53.56 8.99 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 108.61 -0.885 . . . . 73.44 108.61 174.453 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.688 HH21 ' HB3' ' A' ' 19' ' ' TYR . 17.7 tpt180 -74.64 -25.86 59.49 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-N 114.888 -1.051 . . . . 74.12 111.695 -171.133 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 55.6 mtp -92.39 -8.39 45.02 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 112.639 0.607 . . . . 54.4 112.639 -179.091 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.563 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 33.9 t70 -59.27 -49.84 90.66 Favored Pre-proline 0 CA--C 1.567 1.609 0 CA-C-O 118.791 -0.623 . . . . 72.41 112.206 177.527 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.442 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 39.5 Cg_endo -65.36 -28.53 54.72 Favored 'Trans proline' 0 C--N 1.39 2.761 0 C-N-CA 121.835 1.69 . . . . 74.44 112.644 173.698 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.609 HG23 ' SG ' ' A' ' 14' ' ' CYS . 50.0 mm -67.91 -36.97 77.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 C-N-CA 124.148 0.979 . . . . 54.35 111.511 -170.749 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.563 ' HE2' ' HA ' ' A' ' 46' ' ' ASP . 44.3 mtmt -66.81 -41.15 88.01 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 115.98 -0.554 . . . . 74.34 109.701 177.167 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -72.52 -24.73 61.19 Favored 'General case' 0 CA--C 1.557 1.233 0 CA-C-N 114.603 -1.18 . . . . 70.35 110.189 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 83.3 mt -75.7 -33.01 60.32 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.265 0.626 . . . . 75.2 110.416 173.654 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 72.59 55.05 6.94 Favored Glycine 0 C--N 1.345 1.073 0 CA-C-N 115.91 -0.586 . . . . 43.53 113.052 178.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.517 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 65.6 m -94.54 113.8 25.68 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 108.525 -0.917 . . . . 61.33 108.525 173.153 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.4 mtpm? -63.73 -78.33 0.05 OUTLIER 'General case' 0 N--CA 1.476 0.851 0 O-C-N 123.601 0.563 . . . . 74.24 110.216 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 15.1 ttm180 -84.3 121.21 27.2 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 109.321 -0.622 . . . . 71.41 109.321 178.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 29.3 m -126.26 138.5 54.43 Favored 'Isoleucine or valine' 0 C--O 1.243 0.738 0 C-N-CA 124.275 1.03 . . . . 64.14 108.589 173.618 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 58.9 ttt180 -103.09 109.43 20.99 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 107.775 -1.195 . . . . 53.32 107.775 169.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.409 HG22 HG13 ' A' ' 60' ' ' ILE . 34.0 mt -96.05 102.33 13.4 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 N-CA-C 106.791 -1.559 . . . . 62.21 106.791 173.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.3 m -100.68 102.77 13.96 Favored 'General case' 0 C--O 1.24 0.593 0 N-CA-C 107.597 -1.26 . . . . 75.41 107.597 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.468 HD11 HD21 ' A' ' 41' ' ' LEU . 72.2 mt -102.75 118.62 49.94 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 C-N-CA 123.343 0.657 . . . . 73.34 109.279 -178.136 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 51.9 mtm180 -108.5 118.84 37.83 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 108.55 -0.907 . . . . 71.21 108.55 175.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 7.2 p -92.82 138.25 20.49 Favored 'Isoleucine or valine' 0 C--O 1.242 0.679 0 N-CA-C 108.063 -1.088 . . . . 74.33 108.063 177.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.476 ' HB2' ' H ' ' A' ' 7' ' ' GLU . 10.3 mmpt? -80.12 110.1 15.21 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 107.355 -1.35 . . . . 75.22 107.355 174.134 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 55.6 m80 -75.98 142.65 41.88 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 115.342 -0.844 . . . . 74.11 109.125 -176.192 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.466 ' H ' ' HG2' ' A' ' 73' ' ' GLU . 32.0 m -52.15 -40.46 61.44 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.627 1.171 . . . . 71.41 113.641 -170.627 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -169.28 164.88 10.93 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.155 0.982 . . . . 73.15 108.732 -174.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -74.92 -26.19 59.45 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 112.697 0.629 . . . . 74.44 112.697 -178.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.69 -40.51 25.29 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 109.587 -0.523 . . . . 75.33 109.587 171.682 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -70.01 -17.58 63.28 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 115.436 -0.802 . . . . 73.14 111.658 175.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -49.72 -44.06 48.12 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 125.472 1.509 . . . . 75.05 112.284 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 24.5 mtpp -61.8 -37.24 83.65 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 114.623 -1.171 . . . . 73.2 111.357 -178.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.5 ' HE3' ' HA ' ' A' ' 72' ' ' LYS . 0.9 OUTLIER -83.65 -39.59 20.06 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 115.474 -0.784 . . . . 53.32 111.206 178.104 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.466 ' HG2' ' H ' ' A' ' 65' ' ' SER . 16.4 tp10 -76.65 -44.4 34.1 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.851 0.861 . . . . 74.21 111.18 -161.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.02 -48.87 74.63 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 123.928 0.767 . . . . 71.11 110.685 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 49.6 tptt -61.44 -43.81 98.21 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.291 1.037 . . . . 71.34 111.584 -179.318 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.9 tmmm? -64.18 -50.86 66.45 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 124.522 1.129 . . . . 72.21 110.137 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -75.21 -24.2 57.71 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 115.445 -0.798 . . . . 74.32 111.023 -171.314 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.72 -42.71 99.79 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.613 0.765 . . . . 72.12 110.769 174.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.28 -37.11 84.68 Favored 'General case' 0 CA--C 1.547 0.865 0 CA-C-N 115.227 -0.897 . . . . 72.21 111.214 177.354 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.498 HG23 ' HG2' ' A' ' 34' ' ' LYS . 48.2 mm -63.16 -47.12 93.92 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 C-N-CA 124.055 0.942 . . . . 74.54 110.728 177.197 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.659 HD13 HG11 ' A' ' 102' ' ' VAL . 56.1 mt -64.37 -46.2 84.41 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.862 0.865 . . . . 65.43 111.253 -177.178 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -59.59 -32.97 70.88 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.851 0.86 . . . . 75.3 109.907 -174.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -69.15 -48.01 63.46 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.324 0.65 . . . . 73.22 111.222 174.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 77.5 t -64.97 -44.86 96.02 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 C-N-CA 123.03 0.532 . . . . 53.33 111.371 -172.318 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 33.9 m-85 -61.29 -37.32 82.76 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.189 0.596 . . . . 53.33 110.942 175.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.53 -30.64 70.35 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.453 0.701 . . . . 75.53 111.437 175.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -81.18 -2.25 47.88 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.214 1.006 . . . . 75.23 111.138 178.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.7 mt -104.94 -24.56 12.82 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.924 0.89 . . . . 74.12 109.772 173.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 128.15 -17.15 5.98 Favored Glycine 0 C--N 1.346 1.118 0 CA-C-O 119.421 -0.655 . . . . 61.43 113.109 178.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -61.05 138.06 58.21 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-N 117.266 0.533 . . . . 72.54 110.422 178.222 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . 0.456 HD22 ' N ' ' A' ' 91' ' ' ASN . 0.7 OUTLIER -81.01 169.25 17.74 Favored 'General case' 0 C--O 1.243 0.756 0 C-N-CA 123.26 0.624 . . . . 73.32 109.525 176.359 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -61.94 -37.16 83.65 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.009 0.524 . . . . 44.02 111.448 -178.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 40.4 p -63.54 -25.41 68.24 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.367 1.067 . . . . 73.31 113.083 179.203 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . 0.428 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 12.7 m120 -63.56 -39.92 95.64 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 122.687 0.395 . . . . 70.43 110.251 172.548 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 36.3 t -83.74 102.58 9.9 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.93 0 C-N-CA 124.352 1.061 . . . . 74.44 109.8 -171.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.412 ' O ' ' HA ' ' A' ' 102' ' ' VAL . 5.9 m -111.21 152.86 26.61 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.683 0.793 . . . . 62.33 109.079 -179.258 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 20.6 m95 -128.6 115.7 18.48 Favored 'General case' 0 N--CA 1.484 1.243 0 CA-C-N 118.335 0.516 . . . . 74.33 109.777 176.02 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -157.77 126.78 5.75 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.426 1.09 . . . . 72.31 110.131 -174.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 62.48 46.75 93.15 Favored Glycine 0 C--N 1.352 1.47 0 C-N-CA 123.049 0.356 . . . . 72.42 112.981 179.024 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 59.08 9.3 1.24 Allowed 'General case' 0 N--CA 1.503 2.198 0 C-N-CA 126.632 1.973 . . . . 73.4 113.243 -176.575 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 33.0 m -109.27 145.12 36.46 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.637 1.175 . . . . 73.22 109.199 -174.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . 0.659 HG11 HD13 ' A' ' 81' ' ' LEU . 6.0 p -97.89 108.85 22.51 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.852 0 N-CA-C 107.961 -1.126 . . . . 64.22 107.961 166.006 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 80.0 m -92.64 100.93 13.35 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 108.564 -0.902 . . . . 74.41 108.564 179.205 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.428 ' HA ' ' O ' ' A' ' 94' ' ' ASN . 52.3 t -95.29 108.43 20.92 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 N-CA-C 107.483 -1.303 . . . . 73.23 107.483 175.345 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -119.06 129.47 55.11 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 107.644 -1.243 . . . . 74.03 107.644 179.594 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -160.71 -164.88 16.43 Favored Glycine 0 C--O 1.241 0.54 0 N-CA-C 111.344 -0.702 . . . . 73.44 111.344 -178.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 . . . . . 0 C--O 1.243 0.751 0 C-N-CA 123.064 0.546 . . . . 73.41 110.049 177.986 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.48 ' HE3' ' HA ' ' A' ' 4' ' ' LYS . 0.8 OUTLIER . . . . . 0 CA--C 1.544 0.729 0 N-CA-C 110.305 -0.258 . . . . 72.12 110.305 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -97.84 139.81 33.14 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 108.434 -0.95 . . . . 72.11 108.434 168.749 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 5.6 p -143.05 146.68 21.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 123.547 0.739 . . . . 75.45 109.919 177.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.525 ' HG3' ' HG3' ' A' ' 24' ' ' GLN . 3.4 mp0 -106.19 117.85 35.1 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 107.917 -1.142 . . . . 70.22 107.917 174.517 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.583 HG22 HG23 ' A' ' 62' ' ' VAL . 95.0 t -104.48 127.92 58.45 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 124.324 1.05 . . . . 74.13 108.757 -176.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.421 ' O ' ' HA ' ' A' ' 60' ' ' ILE . 45.7 mt-30 -111.1 101.88 10.38 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 109.198 -0.668 . . . . 52.45 109.198 176.126 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 88.0 t -93.84 112.07 26.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 N-CA-C 108.466 -0.939 . . . . 60.32 108.466 -179.533 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.437 ' O ' ' HA ' ' A' ' 58' ' ' ILE . 39.6 ttmt -106.48 104.4 14.08 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 108.455 -0.943 . . . . 65.14 108.455 179.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 14.9 tt -116.49 116.91 53.73 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 CA-C-O 121.381 0.61 . . . . 72.24 109.813 -178.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 50.7 m -104.81 135.79 45.53 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 123.372 0.669 . . . . 73.23 111.122 -175.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 39.8 t -163.32 141.21 7.78 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.179 0.992 . . . . 75.35 111.339 174.344 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.452 ' ND2' ' HB3' ' A' ' 51' ' ' LEU . 91.9 m-20 60.49 32.24 20.46 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 125.279 1.432 . . . . 64.51 112.74 171.885 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 87.97 -1.98 85.33 Favored Glycine 0 C--N 1.345 1.056 0 CA-C-N 115.974 -0.557 . . . . 34.52 113.837 177.084 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 24.4 mmmt -115.21 147.63 40.09 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.243 0.617 . . . . 62.2 110.392 178.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 53.2 m -116.15 130.46 56.81 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 124.102 0.961 . . . . 54.13 108.731 175.69 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.1 m-85 -114.76 100.36 8.18 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 108.407 -0.96 . . . . 61.32 108.407 -179.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -127.84 142.05 51.39 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.108 0.563 . . . . 74.43 110.254 -177.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.3 tpt180 -159.4 145.27 16.14 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 115.87 -0.605 . . . . 73.41 109.939 -173.243 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 22.6 m -98.33 109.08 21.89 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 124.307 1.043 . . . . 63.24 109.706 178.028 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.402 ' HE1' HH21 ' A' ' 44' ' ' ARG . 5.8 m-85 -100.83 137.87 38.64 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.555 1.142 . . . . 74.12 108.67 -179.107 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.525 ' HG3' ' HG3' ' A' ' 7' ' ' GLU . 27.0 mp0 -103.59 108.23 19.42 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 108.349 -0.982 . . . . 65.4 108.349 178.457 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 80.4 mt -112.07 99.29 7.96 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.335 1.054 . . . . 55.32 109.637 -174.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 89.1 t80 -92.93 135.55 34.04 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 108.88 -0.785 . . . . 64.12 108.88 169.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.565 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -141.03 150.22 42.72 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.989 0.916 . . . . 70.23 109.467 179.718 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.0 t -80.87 -38.92 17.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-O 121.263 0.554 . . . . 74.22 110.338 175.285 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.542 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 52.2 mtt180 -119.92 163.34 17.71 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.279 0.631 . . . . 73.53 110.174 175.386 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -65.18 -34.57 78.69 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 115.253 -0.885 . . . . 52.44 109.919 170.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.524 ' HA ' ' HD3' ' A' ' 34' ' ' LYS . 25.4 mm-40 -56.99 -39.66 75.08 Favored 'General case' 0 C--N 1.359 1.015 0 C-N-CA 124.297 1.039 . . . . 71.14 111.573 173.255 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.565 ' HB2' ' HB1' ' A' ' 27' ' ' ALA . 29.9 mm-40 -68.04 -40.85 82.76 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 116.005 -0.543 . . . . 51.51 110.274 178.599 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.49 -33.92 76.64 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.637 0.775 . . . . 74.3 110.368 -179.305 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.524 ' HD3' ' HA ' ' A' ' 31' ' ' GLU . 59.6 mtpt -59.43 -51.79 68.4 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.629 0.772 . . . . 72.42 112.21 -178.649 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.524 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 1.2 pp20? -67.86 -28.04 67.19 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-O 119.467 -0.301 . . . . 63.02 111.33 179.659 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -64.89 -40.99 95.96 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.137 0.575 . . . . 75.04 111.054 174.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.475 HD13 HD23 ' A' ' 81' ' ' LEU . 70.3 mt -61.18 -44.17 97.72 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 123.747 0.655 . . . . 74.14 110.729 173.736 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -61.23 -39.35 89.95 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 122.834 0.453 . . . . 71.31 111.474 176.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.524 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 33.7 mmtp -61.39 -54.42 43.9 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.45 0.7 . . . . 74.04 110.691 176.828 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 47.1 t -58.43 -51.52 70.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 124.549 1.139 . . . . 71.5 112.169 -177.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 70.3 mt -65.72 -48.79 70.79 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 124.054 0.846 . . . . 65.34 111.384 -174.304 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 31.0 t-20 -60.79 -46.52 90.19 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.256 0.622 . . . . 64.52 110.419 -178.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -60.7 -43.87 97.25 Favored 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 123.622 0.769 . . . . 73.52 112.177 177.371 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . 0.402 HH21 ' HE1' ' A' ' 23' ' ' TYR . 17.1 tpp180 -66.45 -24.89 66.51 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 123.504 0.722 . . . . 75.0 111.298 -178.829 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.483 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 65.3 mtp -85.43 -14.03 47.43 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-O 118.205 -0.902 . . . . 62.14 112.877 176.774 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.462 ' HA ' ' HD2' ' A' ' 49' ' ' LYS . 0.8 OUTLIER -60.34 -43.98 94.73 Favored Pre-proline 0 N--CA 1.503 2.21 0 CA-C-N 119.861 1.209 . . . . 73.33 113.42 -179.746 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.469 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 12.3 Cg_endo -56.71 -37.19 98.35 Favored 'Trans proline' 0 C--N 1.394 2.956 0 C-N-CA 121.715 1.61 . . . . 73.44 111.802 167.556 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.438 HG23 ' SG ' ' A' ' 53' ' ' CYS . 35.1 mm -72.78 -29.2 29.09 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.211 0 C-N-CA 124.77 1.228 . . . . 74.32 110.844 -174.06 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 45' ' ' MET . 80.9 mttt -75.1 -39.25 60.82 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.288 0.635 . . . . 73.34 109.681 179.401 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.6 ttpm? -69.44 -26.05 64.41 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 115.185 -0.916 . . . . 73.35 111.233 173.168 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 69.8 mt -72.3 -32.48 66.62 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 109.311 -0.626 . . . . 73.25 109.311 171.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 82.59 38.31 12.45 Favored Glycine 0 C--N 1.348 1.212 0 CA-C-N 115.897 -0.592 . . . . 42.5 112.297 178.497 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.438 ' SG ' HG23 ' A' ' 48' ' ' ILE . 33.1 m -73.51 118.98 17.11 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.563 0.745 . . . . 74.21 110.541 -179.076 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.95 -55.47 16.66 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 122.909 0.484 . . . . 71.44 110.349 177.417 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.1 ttm180 -121.51 144.57 48.64 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.984 0.913 . . . . 75.2 109.05 178.479 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 35.2 m -125.78 145.0 33.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 124.191 0.996 . . . . 75.52 109.326 179.165 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 38.6 ttm180 -109.37 109.61 20.53 Favored 'General case' 0 C--O 1.238 0.5 0 N-CA-C 107.948 -1.13 . . . . 74.53 107.948 173.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.437 ' HA ' ' O ' ' A' ' 11' ' ' LYS . 36.6 mt -105.95 134.85 46.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 C-N-CA 123.82 0.848 . . . . 70.13 108.933 179.329 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 50.9 m -129.35 106.97 9.15 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 107.45 -1.315 . . . . 44.2 107.45 173.372 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.474 ' HB ' HG13 ' A' ' 102' ' ' VAL . 76.3 mt -98.88 122.21 50.33 Favored 'Isoleucine or valine' 0 C--O 1.24 0.563 0 C-N-CA 123.513 0.725 . . . . 75.24 110.066 -177.784 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -104.28 103.4 13.15 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 107.078 -1.453 . . . . 75.32 107.078 172.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.583 HG23 HG22 ' A' ' 8' ' ' VAL . 6.7 p -95.98 146.09 7.63 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 N-CA-C 108.776 -0.824 . . . . 74.33 108.776 -177.774 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.441 ' HG3' ' HB2' ' A' ' 7' ' ' GLU . 12.7 mmmm -81.35 109.26 15.68 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.123 0.487 . . . . 71.15 110.236 177.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . 0.428 ' HB2' ' HG2' ' A' ' 70' ' ' GLU . 53.4 m-70 -80.88 111.66 17.55 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 107.501 -1.296 . . . . 74.41 107.501 178.592 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 38.8 t -20.29 -68.35 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 C-N-CA 127.249 2.22 . . . . 45.04 115.281 -166.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.558 ' H ' ' HB2' ' A' ' 69' ' ' GLU . 6.6 m-20 -137.1 173.17 11.98 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 108.057 -1.09 . . . . 74.44 108.057 174.81 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.8 -41.91 97.81 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.431 0.693 . . . . 75.22 111.479 -173.682 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -73.57 -26.87 61.02 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.097 0.559 . . . . 71.14 111.372 176.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.558 ' HB2' ' H ' ' A' ' 66' ' ' ASP . 18.4 mm-40 -74.97 -27.55 60.21 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-O 118.697 -0.668 . . . . 52.54 111.707 179.74 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.428 ' HG2' ' HB2' ' A' ' 64' ' ' HIS . 48.5 mt-10 -46.98 -40.03 13.63 Favored 'General case' 0 N--CA 1.498 1.959 0 N-CA-C 114.449 1.277 . . . . 75.14 114.449 -166.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 58.2 mttp -65.99 -58.21 6.05 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.23 0.612 . . . . 74.34 111.088 -176.65 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.9 tptt -66.19 -35.71 81.17 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.192 0.997 . . . . 72.23 111.048 -178.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -64.61 -48.02 76.43 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.433 1.093 . . . . 71.33 109.438 -179.371 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.48 -39.84 92.41 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 124.129 0.893 . . . . 24.33 111.631 -177.233 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -62.01 -43.64 98.4 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.495 0.718 . . . . 71.15 110.949 175.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.16 -44.55 83.76 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 124.109 0.964 . . . . 71.22 110.351 178.394 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -76.15 -20.27 57.73 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 115.55 -0.75 . . . . 74.11 110.523 -174.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.83 -43.07 94.29 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.344 0.657 . . . . 72.53 109.915 171.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.4 -41.03 85.6 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 123.439 0.696 . . . . 52.01 111.092 176.392 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.446 HG23 ' HG2' ' A' ' 34' ' ' LYS . 31.8 mm -57.71 -53.45 44.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 124.514 1.126 . . . . 63.25 110.914 177.125 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.475 HD23 HD13 ' A' ' 37' ' ' LEU . 43.8 mt -69.24 -33.25 72.99 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.779 0.832 . . . . 62.14 112.294 -178.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 62.3 t30 -59.32 -38.22 79.75 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.318 0.647 . . . . 65.24 110.394 -178.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -71.11 -46.08 62.4 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 114.575 -1.193 . . . . 75.45 111.756 175.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 54.6 t -62.34 -54.33 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 C-N-CA 123.949 0.9 . . . . 75.23 110.801 -173.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.581 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 22.2 m-85 -59.5 -37.08 77.34 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 115.017 -0.992 . . . . 61.1 111.93 -179.609 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.69 -26.64 67.12 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.306 0.643 . . . . 74.3 112.015 179.454 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -85.85 -12.76 49.94 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.023 0.929 . . . . 72.33 110.683 177.582 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.7 mt -107.21 0.51 23.32 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.608 0.763 . . . . 74.33 111.751 -174.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 103.18 -7.13 51.51 Favored Glycine 0 C--N 1.345 1.061 0 N-CA-C 114.252 0.461 . . . . 71.24 114.252 176.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.581 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 46.6 m-85 -84.44 131.82 34.63 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.469 0.708 . . . . 65.22 110.059 178.389 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -116.44 -166.06 1.12 Allowed 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 124.509 1.124 . . . . 61.22 109.874 -177.479 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -50.65 -51.13 51.94 Favored 'General case' 0 N--CA 1.492 1.668 0 C-N-CA 124.024 0.929 . . . . 72.51 112.278 -179.216 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 20.1 m -63.17 -17.69 62.66 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 124.205 1.002 . . . . 74.23 112.838 -176.564 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . 0.426 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 18.4 m120 -94.12 -38.98 10.82 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.511 0.725 . . . . 72.34 110.827 -175.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 42.1 t -89.82 127.32 42.5 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 122.708 0.403 . . . . 74.22 109.98 -176.154 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 27.1 m -145.74 113.68 6.49 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.314 0.646 . . . . 75.2 109.862 178.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 68.2 m95 -82.07 142.34 32.39 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 122.778 0.431 . . . . 73.44 110.411 174.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -144.22 94.62 2.6 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.344 1.057 . . . . 73.31 108.93 -177.039 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 67.5 -92.98 0.23 Allowed Glycine 0 C--N 1.348 1.204 0 CA-C-N 115.531 -0.758 . . . . 74.32 113.686 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -114.72 -19.45 11.05 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.348 1.059 . . . . 72.51 110.395 -175.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 89.0 m -100.14 149.65 23.3 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.998 1.319 . . . . 72.45 110.541 -177.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . 0.474 HG13 ' HB ' ' A' ' 60' ' ' ILE . 3.3 p -110.99 113.39 44.14 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 N-CA-C 108.523 -0.917 . . . . 75.2 108.523 169.863 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 48.7 m -100.54 111.19 23.41 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 108.957 -0.757 . . . . 54.45 108.957 178.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.426 ' HA ' ' O ' ' A' ' 94' ' ' ASN . 86.1 t -110.37 109.93 30.29 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 N-CA-C 109.297 -0.631 . . . . 55.12 109.297 177.419 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -110.46 111.49 22.78 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 107.463 -1.31 . . . . 73.43 107.463 177.059 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -157.85 172.87 35.12 Favored Glycine 0 C--N 1.342 0.903 0 C-N-CA 121.802 -0.237 . . . . 70.53 112.718 -174.405 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 . . . . . 0 C--O 1.241 0.651 0 CA-C-O 121.906 0.86 . . . . 73.42 112.142 -172.591 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.24 0.603 0 CA-C-O 121.247 0.546 . . . . 74.22 110.218 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.7 ttpm? -98.05 113.32 25.15 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 107.884 -1.154 . . . . 73.12 107.884 170.052 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -100.42 127.74 53.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 N-CA-C 107.396 -1.335 . . . . 63.41 107.396 172.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -102.34 113.76 27.35 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 108.303 -0.999 . . . . 74.41 108.303 177.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 75.0 t -95.05 106.14 17.83 Favored 'Isoleucine or valine' 0 C--O 1.239 0.522 0 C-N-CA 125.147 1.379 . . . . 72.13 108.606 -174.274 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.506 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 65.5 mt-30 -99.84 98.84 9.59 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 108.373 -0.973 . . . . 52.03 108.373 -172.51 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.404 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 57.3 t -93.67 107.37 19.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 N-CA-C 108.919 -0.771 . . . . 70.11 108.919 -173.609 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.414 ' HG3' ' HB3' ' A' ' 20' ' ' GLU . 40.1 ttmt -106.19 101.65 11.11 Favored 'General case' 0 C--N 1.346 0.416 0 N-CA-C 107.817 -1.179 . . . . 64.51 107.817 178.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.489 ' HA ' ' O ' ' A' ' 57' ' ' ARG . 14.6 tt -119.09 122.08 68.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 122.965 0.506 . . . . 73.45 110.301 -174.062 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 30.0 m -90.33 123.16 33.86 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 109.178 -0.675 . . . . 75.31 109.178 178.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.639 ' SG ' HG23 ' A' ' 48' ' ' ILE . 16.2 t -156.66 126.27 6.23 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.142 0.977 . . . . 74.35 109.01 -173.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.492 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 6.3 t-20 66.33 25.22 10.45 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 125.218 1.407 . . . . 74.4 110.975 175.569 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.19 1.51 86.34 Favored Glycine 0 C--N 1.352 1.443 0 CA-C-N 115.585 -0.734 . . . . 72.22 113.843 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm -109.85 153.07 24.95 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.937 0.895 . . . . 75.13 110.023 -179.729 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 28.0 m -113.26 107.5 15.98 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.266 0.627 . . . . 71.12 109.415 -179.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -100.89 99.2 9.65 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 107.586 -1.265 . . . . 71.32 107.586 -175.135 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.414 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 8.4 pt-20 -115.4 122.61 46.34 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 109.578 -0.527 . . . . 73.1 109.578 -179.533 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.5 tpm_? -140.76 127.36 20.18 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.554 -0.748 . . . . 71.44 110.243 -169.699 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 27.3 m -86.67 111.35 20.59 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 123.661 0.784 . . . . 73.54 109.891 176.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -97.66 119.81 36.9 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.724 0.81 . . . . 74.22 109.374 177.29 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 26.8 mp0 -86.69 109.26 19.08 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 108.135 -1.061 . . . . 74.41 108.135 -179.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.466 HD11 HG21 ' A' ' 40' ' ' VAL . 86.1 mt -120.26 132.58 55.39 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.922 0.889 . . . . 51.21 109.286 -178.069 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 39.8 t80 -126.4 135.97 52.09 Favored 'General case' 0 C--O 1.24 0.577 0 N-CA-C 108.673 -0.862 . . . . 72.0 108.673 177.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.444 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -156.15 152.55 28.04 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.245 0.618 . . . . 64.12 109.439 173.157 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 95.8 t -67.99 -60.05 2.99 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 O-C-N 124.158 0.911 . . . . 65.3 109.294 174.031 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.577 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 97.4 mtt180 -96.57 162.87 13.27 Favored 'General case' 0 C--O 1.242 0.665 0 CA-C-O 121.837 0.827 . . . . 61.32 111.61 -178.267 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 18.2 p-10 -67.29 -37.16 82.95 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 113.598 -1.637 . . . . 65.14 111.055 174.057 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -67.68 -31.83 72.08 Favored 'General case' 0 C--N 1.353 0.747 0 C-N-CA 124.244 1.017 . . . . 71.25 111.58 -175.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.577 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 26.1 mm-40 -66.4 -35.63 80.8 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.861 -0.609 . . . . 64.35 109.926 177.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.407 HD23 ' HB3' ' A' ' 27' ' ' ALA . 0.1 OUTLIER -69.86 -25.85 63.92 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 123.893 0.877 . . . . 54.4 110.784 -176.243 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.508 ' HG2' HG23 ' A' ' 80' ' ' ILE . 53.2 mtmt -55.19 -62.13 1.87 Allowed 'General case' 0 C--N 1.365 1.28 0 C-N-CA 122.944 0.498 . . . . 75.54 111.556 -178.71 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.542 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 3.1 pp20? -61.29 -29.99 70.21 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 115.979 -0.555 . . . . 72.11 111.857 -176.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 56.4 mttm -67.08 -43.38 82.75 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.231 0.612 . . . . 71.25 110.423 177.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.493 HD13 HD23 ' A' ' 81' ' ' LEU . 88.8 mt -59.7 -40.55 88.27 Favored 'General case' 0 N--CA 1.474 0.746 0 O-C-N 123.989 0.806 . . . . 73.21 110.496 176.269 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -58.91 -46.51 87.73 Favored 'General case' 0 C--N 1.359 0.995 0 C-N-CA 123.025 0.53 . . . . 74.25 110.971 175.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.542 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 14.2 mmmm -60.58 -52.0 67.02 Favored 'General case' 0 N--CA 1.48 1.046 0 O-C-N 123.586 0.554 . . . . 75.44 110.04 179.183 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.466 HG21 HD11 ' A' ' 25' ' ' LEU . 46.5 t -55.16 -42.87 67.84 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 125.127 1.371 . . . . 70.24 111.996 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 67.0 mt -71.95 -36.64 69.93 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 122.869 0.468 . . . . 70.22 110.611 -179.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.3 m-80 -65.52 -30.95 71.77 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 122.78 0.432 . . . . 74.12 111.643 173.182 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 13.6 mm-40 -75.18 -54.54 6.94 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 122.501 0.32 . . . . 64.25 110.624 179.158 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.7 tpp180 -66.58 -36.38 82.5 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.29 0.636 . . . . 63.13 111.113 -175.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.505 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 69.9 mtp -86.41 -10.8 53.54 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 118.728 -0.653 . . . . 71.52 112.613 -178.159 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.54 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 22.4 t70 -58.79 -53.22 68.57 Favored Pre-proline 0 CA--C 1.564 1.49 0 CA-C-O 118.41 -0.805 . . . . 73.53 111.479 178.705 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -61.59 -29.67 84.65 Favored 'Trans proline' 0 C--N 1.395 2.988 0 C-N-CA 121.877 1.718 . . . . 75.21 111.912 174.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.639 HG23 ' SG ' ' A' ' 14' ' ' CYS . 49.4 mm -70.25 -34.0 56.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 123.893 0.877 . . . . 71.11 110.804 -173.158 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.54 ' HE2' ' HA ' ' A' ' 46' ' ' ASP . 45.6 mtmt -71.01 -38.97 72.64 Favored 'General case' 0 C--N 1.353 0.722 0 N-CA-C 109.667 -0.494 . . . . 75.02 109.667 178.195 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.1 tmmt? -73.85 -26.05 60.38 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 116.046 -0.524 . . . . 73.52 110.34 177.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.6 mt -70.9 -27.79 64.06 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 108.726 -0.842 . . . . 63.03 108.726 170.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 69.43 37.73 79.45 Favored Glycine 0 C--N 1.353 1.473 0 O-C-N 124.275 0.985 . . . . 70.32 112.933 172.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.492 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 71.4 m -70.74 111.25 6.06 Favored 'General case' 0 C--O 1.241 0.635 0 O-C-N 124.282 0.637 . . . . 51.21 109.917 177.881 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -58.01 -55.01 40.41 Favored 'General case' 0 C--O 1.215 -0.746 0 O-C-N 124.804 1.315 . . . . 75.54 110.465 -173.231 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 73.9 ttt180 -108.62 136.06 48.83 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 108.641 -0.874 . . . . 64.14 108.641 172.207 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 30.1 m -124.75 139.76 49.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 123.546 0.739 . . . . 73.11 109.623 175.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.489 ' O ' ' HA ' ' A' ' 12' ' ' ILE . 48.8 ttt180 -109.05 106.92 17.05 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 108.569 -0.9 . . . . 71.24 108.569 171.654 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 41.9 mt -102.31 106.16 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 N-CA-C 108.383 -0.969 . . . . 72.33 108.383 -179.67 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 17.5 m -109.22 102.5 11.44 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 107.963 -1.125 . . . . 63.23 107.963 -177.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 71.2 mt -99.67 113.83 36.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 123.496 0.718 . . . . 74.42 109.884 -174.261 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.506 ' HB2' ' HB2' ' A' ' 9' ' ' GLN . 58.5 mtm180 -98.96 122.72 42.59 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 107.705 -1.22 . . . . 73.43 107.705 -179.042 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.2 p -93.59 129.01 44.6 Favored 'Isoleucine or valine' 0 C--O 1.242 0.673 0 N-CA-C 108.932 -0.766 . . . . 61.45 108.932 -177.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.3 tmtt? -97.1 121.97 39.58 Favored 'General case' 0 C--O 1.239 0.532 0 N-CA-C 107.524 -1.287 . . . . 54.3 107.524 176.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 5.9 p80 -113.12 131.51 55.81 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.765 1.226 . . . . 74.41 109.369 -179.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 16.9 m -89.32 -59.22 2.27 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.611 0.765 . . . . 54.1 111.227 -173.365 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -87.53 131.81 34.25 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 116.276 -0.42 . . . . 74.41 110.244 -175.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -75.3 -24.27 57.45 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 123.653 0.781 . . . . 34.32 112.815 -173.223 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -81.33 -40.19 23.96 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 122.918 0.487 . . . . 61.0 110.417 178.356 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 -68.81 -49.19 60.55 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.017 0.527 . . . . 72.52 111.983 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -49.84 -30.02 9.09 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 124.911 1.382 . . . . 72.0 114.692 -166.07 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.9 ttpm? -64.96 -48.26 74.67 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.018 0.927 . . . . 44.42 110.725 -176.322 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 4.6 ttmp? -79.39 -40.98 28.78 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.123 0.569 . . . . 64.12 110.26 173.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -63.15 -37.97 89.32 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.321 1.049 . . . . 65.12 111.524 -166.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.71 -36.78 62.72 Favored 'General case' 0 C--N 1.356 0.871 0 C-N-CA 123.494 0.718 . . . . 55.25 111.623 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -66.41 -36.83 83.81 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 122.997 0.519 . . . . 63.34 111.179 174.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.454 ' O ' HG12 ' A' ' 80' ' ' ILE . 79.3 tttt -76.19 -31.71 58.61 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.719 -0.673 . . . . 63.25 109.456 177.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -75.96 -21.97 56.43 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.811 0.845 . . . . 71.05 109.605 176.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.37 -40.3 93.37 Favored 'General case' 0 C--N 1.35 0.615 0 C-N-CA 123.574 0.75 . . . . 71.35 109.757 172.137 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.94 -43.25 93.32 Favored 'General case' 0 C--N 1.351 0.632 0 O-C-N 123.969 0.793 . . . . 52.2 110.38 174.138 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.508 HG23 ' HG2' ' A' ' 34' ' ' LYS . 29.3 mm -62.4 -46.27 96.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 124.306 1.042 . . . . 73.12 111.267 -179.396 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.506 HD13 HG11 ' A' ' 102' ' ' VAL . 39.2 mt -63.05 -46.9 85.31 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.839 0.856 . . . . 55.23 110.013 178.606 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -62.47 -36.94 84.05 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 123.999 0.812 . . . . 73.32 109.819 -175.022 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.426 ' O ' ' HG2' ' A' ' 87' ' ' GLU . 30.2 mmmt -65.54 -41.63 92.83 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 122.902 0.481 . . . . 73.21 111.115 175.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.458 HG21 ' HB2' ' A' ' 37' ' ' LEU . 53.6 t -65.69 -43.16 93.78 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 123.428 0.691 . . . . 71.03 110.919 -178.453 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.461 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 26.4 m-85 -60.31 -41.62 93.83 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 115.308 -0.86 . . . . 72.31 109.808 175.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.75 -31.75 73.11 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.588 0.755 . . . . 40.53 111.711 177.275 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 83' ' ' LYS . 23.5 mm-40 -76.2 -19.6 58.26 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.65 0.78 . . . . 73.05 111.336 178.819 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 78.5 mt -109.32 14.32 23.78 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.551 0.74 . . . . 64.3 110.999 -177.838 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 81.17 28.5 44.71 Favored Glycine 0 C--N 1.35 1.356 0 N-CA-C 114.488 0.555 . . . . 63.03 114.488 171.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.639 ' HB3' HD21 ' A' ' 94' ' ' ASN . 13.7 m-85 -111.04 146.7 36.26 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 107.856 -1.164 . . . . 64.45 107.856 171.744 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . 0.413 ' O ' HG23 ' A' ' 95' ' ' VAL . 18.4 m120 -101.18 172.11 7.21 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.064 0.546 . . . . 62.12 111.402 -178.115 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -65.64 -36.93 85.1 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.372 1.069 . . . . 70.53 111.594 -173.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 18.3 m -62.51 -36.01 81.2 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 124.029 0.931 . . . . 61.52 112.776 -175.527 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ASN . . . . . 0.639 HD21 ' HB3' ' A' ' 90' ' ' TYR . 2.1 p-10 -86.08 -0.53 55.84 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 111.936 0.347 . . . . 64.11 111.936 178.124 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.553 ' HA ' HG22 ' A' ' 104' ' ' VAL . 57.9 t -101.07 106.59 19.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 N-CA-C 107.908 -1.145 . . . . 72.3 107.908 174.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 26.2 m -136.74 133.41 36.01 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.195 0.598 . . . . 74.23 109.622 -175.18 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 40.5 m95 -87.77 152.91 21.76 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-O 121.703 0.763 . . . . 74.22 111.826 -179.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -149.89 79.2 1.37 Allowed 'General case' 0 C--O 1.242 0.688 0 C-N-CA 126.254 1.821 . . . . 74.11 106.57 -175.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 72.99 -117.38 5.96 Favored Glycine 0 CA--C 1.531 1.091 0 CA-C-N 115.149 -0.932 . . . . 73.23 112.173 -173.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -97.43 11.16 37.68 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.764 0.825 . . . . 73.02 110.912 175.829 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 61.6 m -119.58 125.87 49.83 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.663 0.785 . . . . 50.24 109.976 -178.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . 0.506 HG11 HD13 ' A' ' 81' ' ' LEU . 8.9 p -96.02 116.78 38.72 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.763 0 N-CA-C 107.866 -1.161 . . . . 65.11 107.866 170.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 4.3 m -99.64 108.14 20.44 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 108.337 -0.986 . . . . 62.54 108.337 -177.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.583 HG13 HD22 ' A' ' 94' ' ' ASN . 83.6 t -115.12 112.28 39.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 C-N-CA 124.819 1.248 . . . . 50.25 108.549 -177.609 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . 0.426 ' HG2' ' HA ' ' A' ' 57' ' ' ARG . 28.1 mt-10 -111.22 152.23 27.35 Favored 'General case' 0 C--O 1.241 0.631 0 N-CA-C 109.484 -0.562 . . . . 70.04 109.484 177.561 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -170.39 145.87 9.41 Favored Glycine 0 N--CA 1.449 -0.436 0 CA-C-N 115.748 -0.66 . . . . 74.51 112.189 177.799 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 57.8 tt0 . . . . . 0 CA--C 1.536 0.423 0 N-CA-C 109.025 -0.731 . . . . 75.44 109.025 168.238 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.485 1.276 0 CA-C-O 120.775 0.321 . . . . 62.2 110.202 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.7 t -78.42 163.01 25.99 Favored 'General case' 0 C--O 1.245 0.827 0 CA-C-N 115.339 -0.846 . . . . 34.33 109.798 175.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.482 ' HA2' ' HA ' ' A' ' 28' ' ' VAL . . . -68.5 89.29 0.22 Allowed Glycine 0 C--N 1.343 0.97 0 N-CA-C 110.487 -1.045 . . . . 72.22 110.487 171.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.5 tppt? -81.59 100.71 9.55 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.013 0.525 . . . . 72.24 110.973 -171.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -84.83 93.5 8.51 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 106.792 -1.559 . . . . 74.13 106.792 169.383 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.445 HG21 HG22 ' A' ' 62' ' ' VAL . 5.9 p -106.36 152.82 7.87 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 C-N-CA 123.982 0.913 . . . . 74.0 110.395 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.429 ' OE2' ' HG3' ' A' ' 24' ' ' GLN . 11.1 mp0 -100.32 114.32 27.73 Favored 'General case' 0 C--N 1.351 0.631 0 N-CA-C 107.935 -1.135 . . . . 72.13 107.935 173.546 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.438 HG22 HG23 ' A' ' 62' ' ' VAL . 78.1 t -112.63 113.62 44.66 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 C-N-CA 124.617 1.167 . . . . 70.23 108.314 -177.424 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -101.0 108.45 20.17 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 108.906 -0.776 . . . . 73.41 108.906 -175.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 91.8 t -93.53 108.25 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 N-CA-C 108.062 -1.088 . . . . 70.3 108.062 179.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -112.72 103.47 11.5 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.269 1.028 . . . . 74.02 108.422 -174.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 11.7 tt -120.61 125.92 74.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 CA-C-O 121.337 0.589 . . . . 51.1 111.156 -171.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 19.9 m -98.34 121.38 40.2 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.974 0.909 . . . . 62.44 109.193 -177.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 5.4 t -148.06 131.78 16.94 Favored 'General case' 0 C--O 1.242 0.696 0 N-CA-C 109.579 -0.526 . . . . 72.34 109.579 179.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.648 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 2.8 t-20 78.49 -65.31 0.24 Allowed 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 125.93 1.692 . . . . 73.44 110.56 172.548 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -170.44 6.82 0.04 OUTLIER Glycine 0 N--CA 1.465 0.586 0 CA-C-N 116.474 -0.33 . . . . 35.15 112.624 172.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -119.72 154.55 33.96 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.126 0.971 . . . . 74.1 109.782 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 7.3 m -115.58 122.16 44.81 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 108.073 -1.084 . . . . 75.43 108.073 175.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -106.77 99.9 9.44 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 108.283 -1.006 . . . . 72.3 108.283 -174.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -114.77 146.1 41.36 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 121.063 0.459 . . . . 73.31 110.014 175.627 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -155.55 132.41 10.61 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 107.812 -1.181 . . . . 71.4 107.812 -176.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 51.7 m -87.47 111.25 20.96 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 109.536 -0.542 . . . . 74.35 109.536 177.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -98.71 140.66 32.58 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.48 0.712 . . . . 72.31 109.621 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.429 ' HG3' ' OE2' ' A' ' 7' ' ' GLU . 21.5 mp0 -97.21 105.91 18.14 Favored 'General case' 0 C--O 1.24 0.578 0 N-CA-C 107.151 -1.426 . . . . 73.12 107.151 174.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 45.7 mt -107.09 115.28 29.91 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 109.051 -0.722 . . . . 70.12 109.051 -179.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -107.12 123.63 48.52 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 109.21 -0.663 . . . . 75.21 109.21 177.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -145.9 122.05 10.81 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 122.738 0.415 . . . . 73.34 110.02 175.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.482 ' HA ' ' HA2' ' A' ' 3' ' ' GLY . 60.3 t -73.29 -30.86 31.96 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 C-N-CA 123.815 0.846 . . . . 54.45 109.774 171.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.422 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 58.4 mtt-85 -112.78 150.37 31.72 Favored 'General case' 0 CA--C 1.552 1.033 0 CA-C-N 114.96 -1.018 . . . . 72.2 110.043 -174.589 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -67.23 -44.85 78.44 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 123.939 0.896 . . . . 72.5 110.937 -178.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.403 ' HA ' ' HD3' ' A' ' 34' ' ' LYS . 56.2 mm-40 -61.77 -30.9 71.1 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.801 0.84 . . . . 74.52 111.633 179.247 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.422 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 35.0 mm-40 -61.7 -46.14 90.97 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 122.705 0.402 . . . . 61.14 111.293 177.142 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.7 -33.88 75.77 Favored 'General case' 0 CA--C 1.553 1.063 0 N-CA-C 109.871 -0.418 . . . . 62.04 109.871 -177.842 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.403 ' HD3' ' HA ' ' A' ' 31' ' ' GLU . 54.7 mtpt -54.31 -58.2 8.3 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.131 0.572 . . . . 74.22 111.395 176.159 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.8 pp20? -66.91 -26.89 67.08 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 115.92 -0.582 . . . . 71.43 112.354 -177.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 40.2 mttp -71.59 -35.17 70.43 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.129 0.571 . . . . 54.12 111.048 176.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.604 HD13 HD23 ' A' ' 81' ' ' LEU . 81.5 mt -64.23 -45.31 88.77 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 123.334 0.397 . . . . 73.24 110.058 171.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.434 ' HG2' HG13 ' A' ' 84' ' ' VAL . 50.1 mtpt -58.88 -38.11 78.1 Favored 'General case' 0 C--N 1.357 0.917 0 C-N-CA 122.782 0.433 . . . . 74.13 111.086 174.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 43.3 mmtm -60.32 -62.83 1.58 Allowed 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 122.865 0.466 . . . . 62.41 110.515 175.542 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 93.9 t -59.7 -45.94 93.92 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 123.583 0.753 . . . . 62.34 111.695 -172.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.619 HD21 HD11 ' A' ' 60' ' ' ILE . 68.9 mt -64.95 -58.33 6.4 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.382 0.673 . . . . 74.45 111.271 -179.252 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -60.32 -38.4 83.59 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 123.357 0.663 . . . . 71.33 112.054 -176.366 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -67.67 -48.24 67.2 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 122.577 0.351 . . . . 74.44 111.027 178.207 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -73.55 -32.96 64.47 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 116.342 -0.39 . . . . 72.32 111.287 -172.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.406 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 43.3 mtp -83.62 -11.53 57.18 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 122.972 0.509 . . . . 74.41 112.059 -177.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -61.02 -53.34 64.76 Favored Pre-proline 0 CA--C 1.564 1.484 0 CA-C-O 118.577 -0.725 . . . . 71.51 111.684 178.116 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.526 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 56.8 Cg_endo -68.47 -25.23 35.53 Favored 'Trans proline' 0 C--N 1.387 2.581 0 CA-C-N 121.169 1.453 . . . . 72.42 112.435 173.258 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 32.1 mm -63.52 -43.66 98.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 123.434 0.694 . . . . 54.02 111.398 -178.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.72 ' HA ' HD11 ' A' ' 108' ' ' LEU . 48.4 mtmt -67.12 -32.51 73.69 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 121.035 0.445 . . . . 61.31 110.098 178.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -71.57 -29.04 64.27 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.616 1.166 . . . . 71.41 111.101 176.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.526 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 86.9 mt -70.5 -33.86 71.69 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 109.312 -0.625 . . . . 71.43 109.312 175.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 89.58 119.99 1.91 Allowed Glycine 0 C--N 1.344 0.987 0 CA-C-N 115.448 -0.796 . . . . 64.43 113.315 168.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.648 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 72.3 m -153.24 156.11 37.88 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.322 1.049 . . . . 73.12 108.755 -179.33 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.49 ' HD2' ' H ' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -74.8 -37.2 62.42 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 109.152 -0.685 . . . . 73.14 109.152 171.377 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.558 ' HA ' ' H ' ' A' ' 108' ' ' LEU . 29.0 ttm180 -157.81 148.47 20.9 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 123.951 0.901 . . . . 73.33 109.102 -175.02 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 15.7 m -114.68 140.47 35.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 123.527 0.731 . . . . 64.12 109.97 177.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 45.5 ttm105 -104.96 103.36 12.91 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 108.25 -1.018 . . . . 61.53 108.25 173.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 40.5 mt -94.76 146.11 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 N-CA-C 107.886 -1.153 . . . . 74.34 107.886 178.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 28.8 m -144.15 103.37 3.99 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 106.836 -1.542 . . . . 63.4 106.836 177.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.619 HD11 HD21 ' A' ' 41' ' ' LEU . 72.7 mt -101.92 107.44 21.64 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 N-CA-C 108.827 -0.805 . . . . 70.44 108.827 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 38.1 ttp85 -97.53 121.16 39.11 Favored 'General case' 0 C--O 1.238 0.468 0 N-CA-C 108.036 -1.098 . . . . 74.02 108.036 176.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.445 HG22 HG21 ' A' ' 6' ' ' VAL . 4.1 p -94.85 140.29 17.04 Favored 'Isoleucine or valine' 0 C--O 1.243 0.744 0 N-CA-C 107.49 -1.3 . . . . 74.31 107.49 178.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 19.6 ttpp -81.52 136.39 35.61 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 109.262 -0.644 . . . . 73.34 109.262 178.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . 0.579 ' HE1' ' HB2' ' A' ' 100' ' ' ASP . 37.6 m80 -85.89 117.3 24.66 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 108.663 -0.865 . . . . 71.25 108.663 178.444 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 30.7 p -65.79 -62.13 1.68 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.742 0.817 . . . . 62.31 111.79 -173.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -148.29 140.39 24.07 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 107.969 -1.123 . . . . 73.32 107.969 -177.199 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -53.67 -34.53 58.99 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.939 0.895 . . . . 72.13 113.379 -172.046 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.6 -42.16 74.79 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 122.783 0.433 . . . . 62.52 111.272 178.292 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -74.97 -47.63 28.41 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.372 0.669 . . . . 45.3 111.494 -176.591 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.3 pp20? -68.16 -20.61 64.9 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 114.458 1.281 . . . . 63.01 114.458 -159.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 64.6 mttm -65.48 -42.46 92.2 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-O 121.407 0.623 . . . . 74.22 109.848 173.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -79.71 -40.79 28.15 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 114.858 -1.064 . . . . 63.42 110.566 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -74.03 -33.4 63.74 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 112.429 0.529 . . . . 75.05 112.429 -172.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.91 -35.93 64.67 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 117.795 0.271 . . . . 64.22 110.694 177.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 65.1 tttp -65.65 -39.85 91.86 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.101 0.56 . . . . 75.22 110.243 175.005 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 5.6 tmmm? -67.15 -40.06 86.61 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.974 0.909 . . . . 63.51 109.825 175.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -72.76 -23.72 60.86 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.788 0.835 . . . . 73.33 110.702 -175.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.56 -46.15 89.69 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 123.576 0.547 . . . . 71.53 109.913 173.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.439 ' O ' ' HG2' ' A' ' 83' ' ' LYS . . . -65.98 -40.73 91.48 Favored 'General case' 0 CA--C 1.545 0.75 0 CA-C-N 115.531 -0.759 . . . . 43.12 111.223 177.389 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 37.5 mm -56.09 -47.43 80.47 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 C-N-CA 124.287 1.035 . . . . 74.03 110.773 176.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.604 HD23 HD13 ' A' ' 37' ' ' LEU . 45.8 mt -67.09 -40.02 86.89 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.865 0.866 . . . . 72.24 111.762 -179.685 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 -60.13 -33.15 71.74 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.259 0.624 . . . . 64.4 111.433 -178.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.439 ' HG2' ' O ' ' A' ' 79' ' ' ALA . 32.9 mmtp -67.2 -49.54 64.18 Favored 'General case' 0 N--CA 1.473 0.704 0 O-C-N 123.697 0.623 . . . . 74.33 110.706 173.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.434 HG13 ' HG2' ' A' ' 38' ' ' LYS . 71.1 t -65.13 -49.26 80.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 123.988 0.915 . . . . 61.31 111.456 -171.273 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.496 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 26.4 m-85 -63.24 -33.71 76.08 Favored 'General case' 0 N--CA 1.477 0.902 0 O-C-N 123.582 0.552 . . . . 65.34 111.326 179.062 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -68.06 -30.06 69.18 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.104 0.562 . . . . 73.2 111.389 175.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -85.47 -13.51 48.94 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.905 0.882 . . . . 75.41 111.89 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 94.3 mt -107.49 -16.04 14.46 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 122.984 0.513 . . . . 64.3 111.385 -175.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 97.57 49.23 1.85 Allowed Glycine 0 C--N 1.345 1.079 0 CA-C-O 120.857 0.143 . . . . 63.3 113.373 176.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.496 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 40.6 m-85 -126.31 134.66 51.06 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 107.889 -1.152 . . . . 75.24 107.889 174.441 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -78.1 159.27 28.77 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.297 0.639 . . . . 73.54 111.528 -174.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -62.38 -46.06 90.32 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.859 0.864 . . . . 72.15 112.173 -175.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 63.9 p -58.53 -34.82 71.42 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 124.05 0.94 . . . . 74.23 112.16 177.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . 0.409 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 2.5 m-20 -65.19 -25.66 67.81 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 115.412 -0.813 . . . . 53.44 110.932 -179.098 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 45.4 t -91.74 114.71 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.87 0 C-N-CA 124.333 1.053 . . . . 63.24 108.897 178.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 32.9 m -144.41 129.62 18.71 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 122.879 0.472 . . . . 74.51 110.389 178.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 66.3 m95 -86.05 137.97 32.3 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.403 0.681 . . . . 72.52 110.509 177.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -169.17 123.52 0.83 Allowed 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.481 1.112 . . . . 72.0 109.245 179.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 69.76 51.97 22.34 Favored Glycine 0 C--N 1.349 1.26 0 O-C-N 123.883 0.739 . . . . 55.54 113.193 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . 0.579 ' HB2' ' HE1' ' A' ' 64' ' ' HIS . 4.4 p-10 46.67 26.09 0.5 Allowed 'General case' 0 N--CA 1.499 2.018 0 C-N-CA 126.444 1.898 . . . . 71.51 113.537 -176.359 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 50.0 m -135.54 148.01 48.99 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 125.313 1.445 . . . . 72.23 107.931 -177.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.601 HG11 HD13 ' A' ' 81' ' ' LEU . 13.4 p -103.35 121.58 54.83 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 N-CA-C 108.709 -0.849 . . . . 64.41 108.709 171.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 24.7 m -97.79 111.31 23.65 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 107.532 -1.284 . . . . 33.05 107.532 178.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.409 ' HA ' ' O ' ' A' ' 94' ' ' ASN . 55.1 t -119.35 125.0 74.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 N-CA-C 108.533 -0.914 . . . . 72.31 108.533 -178.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -107.95 153.83 22.49 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 109.578 -0.527 . . . . 73.14 109.578 174.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -148.51 136.98 6.15 Favored Glycine 0 C--O 1.238 0.368 0 N-CA-C 110.643 -0.983 . . . . 73.54 110.643 173.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 58.9 tp60 -68.35 102.34 1.38 Allowed 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 108.081 -1.081 . . . . 72.31 108.081 179.046 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.72 HD11 ' HA ' ' A' ' 49' ' ' LYS . 2.5 tm? -67.3 148.09 52.14 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.93 0.892 . . . . 62.53 109.759 -172.136 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.497 ' N ' HD13 ' A' ' 108' ' ' LEU . 31.8 tt0 74.6 -73.21 0.1 Allowed 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 124.762 1.225 . . . . 65.4 109.72 -176.139 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -82.67 67.4 3.73 Favored Glycine 0 C--N 1.346 1.136 0 N-CA-C 111.412 -0.675 . . . . 63.32 111.412 173.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 15.4 m -75.8 74.37 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.03 0 CA-C-O 121.911 0.863 . . . . 54.12 111.826 -173.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -171.82 144.6 1.8 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.783 1.233 . . . . 71.34 108.684 176.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 97.7 mt -126.33 -31.57 2.78 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.529 0.731 . . . . 74.31 109.944 173.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.404 ' HB3' ' CD2' ' A' ' 116' ' ' HIS . 47.7 mt-10 -86.1 85.66 7.36 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.655 0.782 . . . . 71.44 111.674 -174.625 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 21.2 p80 -99.43 69.33 1.66 Allowed 'General case' 0 CA--C 1.549 0.904 0 CA-C-O 121.723 0.773 . . . . 75.31 109.726 173.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.404 ' CD2' ' HB3' ' A' ' 114' ' ' GLU . 99.0 m-70 -75.04 129.75 38.13 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-N 115.531 -0.759 . . . . 70.22 112.087 -173.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 42.6 m-70 -119.65 92.04 3.69 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.141 0.977 . . . . 72.21 108.534 169.189 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 18.5 p80 -107.57 122.06 45.92 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.602 0.761 . . . . 70.54 109.873 -176.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 32.5 p-80 -78.22 119.68 21.94 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 109.512 -0.551 . . . . 75.32 109.512 177.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 49.9 t-80 . . . . . 0 CA--C 1.565 1.536 0 C-N-CA 124.357 1.063 . . . . 73.12 109.491 -174.191 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.8 mtm . . . . . 0 N--CA 1.485 1.323 0 N-CA-C 108.903 -0.777 . . . . 73.51 108.903 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.3 t -92.75 -170.17 2.38 Favored 'General case' 0 CA--C 1.554 1.12 0 N-CA-C 108.504 -0.925 . . . . 64.54 108.504 171.521 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -56.55 114.01 4.77 Favored Glycine 0 C--N 1.356 1.655 0 C-N-CA 122.716 0.198 . . . . 54.41 112.805 -179.331 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.33 134.53 38.01 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.503 0.721 . . . . 71.32 110.225 -171.143 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 33.6 ttpt -100.57 117.02 33.86 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.51 0.724 . . . . 72.41 110.593 -178.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.419 HG21 HG13 ' A' ' 62' ' ' VAL . 3.7 p -101.06 138.83 23.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 N-CA-C 107.673 -1.232 . . . . 72.31 107.673 164.634 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -104.32 111.66 24.38 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 108.07 -1.085 . . . . 72.05 108.07 174.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.624 HG13 HG23 ' A' ' 60' ' ' ILE . 56.7 t -98.98 107.36 20.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 CA-C-N 113.593 -1.639 . . . . 73.41 108.841 -174.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.418 ' HB2' ' HB3' ' A' ' 61' ' ' ARG . 42.1 mt-30 -97.16 101.57 13.16 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 108.16 -1.052 . . . . 75.04 108.16 -176.537 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 67.0 t -93.23 111.95 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 108.848 -0.797 . . . . 72.21 108.848 -176.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -119.46 103.5 9.51 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.416 1.086 . . . . 61.51 108.259 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.48 HD13 HG13 ' A' ' 48' ' ' ILE . 12.3 tt -118.53 122.02 68.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.6 0 CA-C-O 121.036 0.446 . . . . 62.31 111.436 -173.648 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 31.9 m -97.39 112.08 24.06 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 108.361 -0.978 . . . . 75.12 108.361 178.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.666 ' SG ' HG23 ' A' ' 48' ' ' ILE . 14.6 t -122.24 115.92 23.22 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.464 1.106 . . . . 54.2 108.253 179.694 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 40.4 t-20 71.57 -73.1 0.1 Allowed 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 125.222 1.409 . . . . 60.14 110.29 178.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -161.48 10.18 0.12 Allowed Glycine 0 N--CA 1.469 0.894 0 N-CA-C 111.465 -0.654 . . . . 62.43 111.465 175.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.424 ' HA ' ' HE3' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -110.98 123.89 51.06 Favored 'General case' 0 C--N 1.349 0.559 0 C-N-CA 124.197 0.999 . . . . 75.01 109.264 177.207 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 91.5 m -106.81 123.89 48.81 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.688 0.795 . . . . 73.3 109.62 -179.398 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -109.64 101.84 10.72 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.487 1.115 . . . . 71.44 108.316 -176.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -114.58 142.42 46.46 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.05 0.54 . . . . 74.45 110.043 -177.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 52.6 ttm-85 -168.05 140.74 3.1 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 122.863 0.465 . . . . 65.14 111.393 175.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 24.7 m -86.68 109.24 19.06 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.661 1.185 . . . . 43.31 109.549 174.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -97.36 135.44 39.25 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.618 0.767 . . . . 75.44 109.41 177.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -94.48 109.46 21.34 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 107.85 -1.167 . . . . 51.42 107.85 177.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.417 HD22 ' HB3' ' A' ' 36' ' ' LYS . 58.0 mt -113.7 116.48 29.5 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.561 0.744 . . . . 70.31 109.344 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -114.79 120.53 40.33 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.438 1.095 . . . . 73.41 108.969 -176.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.498 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -150.98 150.88 31.31 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 122.946 0.499 . . . . 74.41 110.425 176.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.2 t -78.81 -42.94 25.08 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.773 0 CA-C-N 114.957 -1.019 . . . . 70.03 109.459 174.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.52 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 59.5 mtt-85 -116.83 164.33 14.83 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.846 0.858 . . . . 61.25 111.451 -169.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -62.39 -48.65 78.78 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 124.467 1.107 . . . . 61.54 111.662 178.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.425 ' HA ' ' HD3' ' A' ' 34' ' ' LYS . 49.4 mm-40 -64.29 -28.75 69.93 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-N 115.586 -0.733 . . . . 72.01 111.453 -176.543 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.52 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 29.1 mm-40 -74.52 -26.2 59.83 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.026 0.53 . . . . 52.41 111.123 177.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.434 HD23 ' HB3' ' A' ' 27' ' ' ALA . 0.2 OUTLIER -81.69 -37.87 26.72 Favored 'General case' 0 CA--C 1.555 1.147 0 N-CA-C 109.788 -0.449 . . . . 71.11 109.788 178.885 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.462 ' HG2' HG23 ' A' ' 80' ' ' ILE . 56.8 mtpt -56.12 -52.13 65.45 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 124.094 0.958 . . . . 73.24 112.452 -176.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -54.67 -37.87 66.27 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.667 0.787 . . . . 73.4 111.868 177.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.417 ' HB3' HD22 ' A' ' 25' ' ' LEU . 54.2 mttm -70.63 -38.0 73.85 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.232 0.613 . . . . 73.51 110.811 -178.667 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 57.6 mt -62.35 -40.86 97.79 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.571 0.748 . . . . 75.31 110.984 175.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.501 ' HG2' HG13 ' A' ' 84' ' ' VAL . 57.2 mtpt -63.71 -41.11 98.13 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.544 0.738 . . . . 55.44 111.326 175.236 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.6 mmmp? -61.61 -53.09 60.85 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.332 0.653 . . . . 73.51 110.638 176.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 46.4 t -60.05 -38.95 78.88 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 124.826 1.25 . . . . 73.43 111.988 -179.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.448 HD21 HD11 ' A' ' 60' ' ' ILE . 23.3 mt -71.28 -50.11 35.97 Favored 'General case' 0 C--O 1.212 -0.877 0 CA-C-O 118.948 -0.549 . . . . 72.02 110.943 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 56.5 m-80 -66.4 -21.8 66.23 Favored 'General case' 0 N--CA 1.491 1.593 0 CA-C-N 118.513 0.597 . . . . 72.13 111.594 177.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -74.87 -55.65 5.58 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.048 0.539 . . . . 72.24 110.252 176.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.419 ' HA ' ' CZ ' ' A' ' 44' ' ' ARG . 0.3 OUTLIER -72.94 -26.28 61.33 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.437 0.695 . . . . 74.35 111.312 -176.666 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 57.0 mtp -96.43 2.58 52.72 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.191 0.596 . . . . 63.4 112.326 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -59.37 -55.8 42.44 Favored Pre-proline 0 CA--C 1.566 1.579 0 CA-C-O 118.697 -0.668 . . . . 73.43 110.973 170.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.408 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 56.3 Cg_endo -66.79 -20.93 51.75 Favored 'Trans proline' 0 C--N 1.39 2.718 0 C-N-CA 121.788 1.659 . . . . 75.43 112.429 176.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.666 HG23 ' SG ' ' A' ' 14' ' ' CYS . 48.2 mm -74.46 -40.19 48.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 124.434 1.094 . . . . 73.24 111.513 -174.446 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -68.44 -32.53 72.61 Favored 'General case' 0 N--CA 1.48 1.028 0 N-CA-C 109.424 -0.584 . . . . 74.4 109.424 176.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -69.45 -28.09 65.82 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 124.357 1.063 . . . . 73.14 110.959 175.343 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 83.9 mt -72.31 -39.37 68.3 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 109.004 -0.739 . . . . 74.33 109.004 172.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 62.42 62.27 5.76 Favored Glycine 0 C--N 1.352 1.433 0 CA-C-N 115.269 -0.878 . . . . 71.01 111.833 179.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 63.6 m -84.96 152.44 23.49 Favored 'General case' 0 C--O 1.242 0.686 0 C-N-CA 123.069 0.547 . . . . 64.14 112.145 -174.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -67.53 -39.5 85.04 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 115.073 -0.967 . . . . 63.44 110.018 178.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 11.4 ttm180 -142.53 140.77 31.91 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.387 1.075 . . . . 74.54 109.582 176.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 27.0 m -123.76 136.89 58.73 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 C-N-CA 124.471 1.109 . . . . 64.05 109.0 171.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.468 ' O ' ' HA ' ' A' ' 12' ' ' ILE . 47.1 mtt180 -112.09 106.63 15.31 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 108.749 -0.834 . . . . 60.32 108.749 172.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.473 HG12 HD12 ' A' ' 12' ' ' ILE . 17.8 mt -94.86 106.96 18.8 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 N-CA-C 108.014 -1.106 . . . . 65.3 108.014 179.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.9 m -99.64 102.45 13.94 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 107.045 -1.465 . . . . 75.32 107.045 179.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.624 HG23 HG13 ' A' ' 8' ' ' VAL . 72.2 mt -96.59 107.99 20.65 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 N-CA-C 108.314 -0.995 . . . . 73.34 108.314 179.22 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.418 ' HB3' ' HB2' ' A' ' 9' ' ' GLN . 0.2 OUTLIER -93.17 106.71 18.64 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 107.204 -1.406 . . . . 73.54 107.204 -178.713 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.419 HG13 HG21 ' A' ' 6' ' ' VAL . 22.6 t -92.57 114.27 29.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 N-CA-C 107.966 -1.124 . . . . 74.52 107.966 177.557 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -84.92 105.7 15.88 Favored 'General case' 0 C--O 1.239 0.507 0 N-CA-C 108.118 -1.068 . . . . 72.3 108.118 177.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 25.6 p80 -64.64 139.36 58.76 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 109.336 -0.616 . . . . 75.22 109.336 177.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 30.4 t -80.46 -36.79 33.01 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.208 0.603 . . . . 74.01 111.389 -174.078 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.525 ' HB2' ' HB2' ' A' ' 69' ' ' GLU . 7.2 m-20 -125.07 137.94 54.2 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.606 0.763 . . . . 74.24 110.232 -174.555 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -79.68 -15.52 57.41 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.715 0.806 . . . . 41.33 112.502 -174.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -86.22 -44.54 12.08 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.168 0.587 . . . . 63.44 109.538 171.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.525 ' HB2' ' HB2' ' A' ' 66' ' ' ASP . 11.2 mm-40 -76.81 -14.3 59.93 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 114.711 -1.131 . . . . 72.44 112.821 -175.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.601 ' HG3' ' HD2' ' A' ' 71' ' ' LYS . 9.4 pt-20 -50.55 -31.42 15.61 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 114.554 1.316 . . . . 62.05 114.554 -176.44 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.601 ' HD2' ' HG3' ' A' ' 70' ' ' GLU . 3.7 mptp? -67.15 -42.09 84.93 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 109.418 -0.586 . . . . 64.41 109.418 176.187 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -71.3 -36.35 71.61 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.421 1.088 . . . . 74.14 110.664 177.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -77.7 -42.81 33.18 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.88 0.872 . . . . 72.22 112.159 -172.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.82 -41.81 67.76 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-O 120.806 0.336 . . . . 70.25 110.272 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -63.59 -33.46 75.66 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.134 0.974 . . . . 75.31 111.465 172.151 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 20.8 ttmm -60.97 -53.25 59.53 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.675 0.79 . . . . 73.42 109.703 173.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.562 ' HA ' ' HB ' ' A' ' 80' ' ' ILE . 19.1 m-85 -69.67 -20.11 63.58 Favored 'General case' 0 C--O 1.221 -0.443 0 C-N-CA 123.57 0.748 . . . . 74.23 111.943 -178.076 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.478 ' O ' ' HB2' ' A' ' 82' ' ' ASN . . . -55.55 -55.17 35.08 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 109.765 -0.458 . . . . 72.42 109.765 171.123 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.434 ' O ' ' HG2' ' A' ' 83' ' ' LYS . . . -69.86 -45.7 67.17 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.503 0.721 . . . . 71.23 111.389 178.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.562 ' HB ' ' HA ' ' A' ' 77' ' ' PHE . 21.6 mm -60.81 -52.38 62.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 C-N-CA 124.624 1.17 . . . . 54.01 111.823 -175.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 37.5 mt -67.09 -36.25 81.58 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 118.97 -0.538 . . . . 74.33 111.202 177.237 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.579 HD21 ' HB3' ' A' ' 92' ' ' ASP . 0.2 OUTLIER -60.55 -36.74 79.19 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 123.413 0.445 . . . . 73.53 109.892 178.655 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.434 ' HG2' ' O ' ' A' ' 79' ' ' ALA . 75.0 mmtt -61.74 -47.19 86.32 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.014 0.526 . . . . 74.54 110.261 174.796 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.501 HG13 ' HG2' ' A' ' 38' ' ' LYS . 74.2 t -62.26 -45.44 98.75 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 C-N-CA 124.03 0.932 . . . . 65.14 110.601 -175.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.5 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 20.0 m-85 -62.52 -41.07 98.61 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.617 0.767 . . . . 75.22 110.731 177.235 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -69.87 -24.76 63.47 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.607 0.763 . . . . 73.31 111.516 178.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -84.78 -11.42 55.79 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.614 0.766 . . . . 64.42 111.566 176.213 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.531 ' O ' ' HG3' ' A' ' 109' ' ' GLU . 82.1 mt -99.71 -32.7 10.92 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 109.519 -0.548 . . . . 75.33 109.519 177.143 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 131.32 -19.43 4.84 Favored Glycine 0 C--N 1.349 1.268 0 C-N-CA 123.265 0.46 . . . . 45.33 112.938 -179.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.5 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 23.8 m-85 -68.48 145.93 53.61 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.452 0.701 . . . . 70.1 110.995 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -92.87 159.56 15.3 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.368 0.667 . . . . 72.15 110.142 -177.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . 0.579 ' HB3' HD21 ' A' ' 82' ' ' ASN . 9.2 p-10 -64.85 -25.24 67.82 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.875 0.87 . . . . 72.24 110.969 172.645 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 80.4 p -67.03 -11.02 55.88 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.933 0.893 . . . . 54.43 112.643 176.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -90.91 -19.69 23.05 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.697 0.799 . . . . 64.21 110.723 175.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.52 HG13 HG21 ' A' ' 102' ' ' VAL . 59.3 t -90.71 115.18 29.47 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.975 0 C-N-CA 124.702 1.201 . . . . 74.51 110.757 -166.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 63.7 m -120.89 108.61 14.12 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.603 0.761 . . . . 62.44 110.299 178.234 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 68.2 m95 -87.91 121.86 30.84 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.367 0.667 . . . . 75.43 111.672 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -117.92 81.85 1.74 Allowed 'General case' 0 C--O 1.243 0.748 0 C-N-CA 124.621 1.169 . . . . 73.54 107.895 169.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 76.05 -115.1 4.38 Favored Glycine 0 C--N 1.345 1.07 0 CA-C-N 114.908 -1.042 . . . . 71.51 112.535 -178.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -96.72 1.88 51.43 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.888 0.875 . . . . 64.32 111.363 -178.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 43.1 m -118.58 140.29 50.13 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 108.911 -0.774 . . . . 61.14 108.911 179.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.52 HG21 HG13 ' A' ' 95' ' ' VAL . 5.9 p -121.19 128.07 75.94 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 C-N-CA 123.22 0.608 . . . . 71.42 110.087 174.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 85.7 m -101.75 104.56 15.36 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 107.375 -1.343 . . . . 73.34 107.375 172.137 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.401 HG21 ' CZ ' ' A' ' 85' ' ' PHE . 59.1 t -94.01 111.84 25.82 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 N-CA-C 107.639 -1.245 . . . . 65.14 107.639 178.728 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -113.17 118.79 35.69 Favored 'General case' 0 C--O 1.241 0.658 0 N-CA-C 108.297 -1.001 . . . . 74.22 108.297 -177.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -167.78 -173.62 36.0 Favored Glycine 0 CA--C 1.502 -0.772 0 N-CA-C 110.884 -0.887 . . . . 61.24 110.884 -178.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -102.96 161.57 13.65 Favored 'General case' 0 C--O 1.241 0.634 0 N-CA-C 108.579 -0.897 . . . . 74.53 108.579 175.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 82.8 mt -59.0 124.71 20.82 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 123.675 0.609 . . . . 63.5 110.023 175.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.571 ' HG2' HD21 ' A' ' 113' ' ' LEU . 0.4 OUTLIER -58.83 -29.29 66.8 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.376 1.07 . . . . 70.35 110.657 -179.897 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 168.84 142.58 3.55 Favored Glycine 0 C--N 1.34 0.796 0 N-CA-C 110.523 -1.031 . . . . 65.43 110.523 174.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 80.5 t -62.0 -44.27 98.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 N-CA-C 108.159 -1.052 . . . . 72.1 108.159 167.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -133.38 146.28 51.11 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 114.353 -1.294 . . . . 63.25 108.017 170.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.571 HD21 ' HG2' ' A' ' 109' ' ' GLU . 65.5 mt -107.8 176.63 5.08 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.103 0.561 . . . . 74.52 111.432 -170.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 47.7 mm-40 -61.24 -38.4 86.54 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.349 0.66 . . . . 73.3 109.823 170.277 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 36.5 m80 -84.47 90.37 7.6 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 106.932 -1.507 . . . . 72.23 106.932 163.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 43.4 m-70 -65.96 92.84 0.17 Allowed 'General case' 0 N--CA 1.476 0.873 0 O-C-N 123.854 0.721 . . . . 71.53 109.993 -173.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -139.48 31.59 2.09 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.358 1.063 . . . . 75.42 109.451 -178.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 3.3 p80 -56.88 119.56 6.44 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.146 0.578 . . . . 74.51 110.669 175.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 22.8 t-80 -74.58 -34.73 62.94 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 109.321 -0.622 . . . . 72.31 109.321 -176.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 16.3 m80 . . . . . 0 C--O 1.248 1.013 0 N-CA-C 107.995 -1.113 . . . . 74.31 107.995 161.932 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 ptm . . . . . 0 N--CA 1.488 1.445 0 CA-C-O 121.222 0.534 . . . . 74.12 111.074 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.9 t -152.69 169.0 23.8 Favored 'General case' 0 C--O 1.248 1.018 0 N-CA-C 108.122 -1.066 . . . . 53.55 108.122 172.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -70.08 97.28 0.58 Allowed Glycine 0 C--N 1.337 0.628 0 N-CA-C 109.306 -1.518 . . . . 74.34 109.306 168.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.3 tpmt? -115.3 150.41 36.29 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.374 0.67 . . . . 72.2 110.82 -169.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.8 ttmt -86.54 122.43 30.46 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.654 -0.703 . . . . 71.05 109.147 167.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -103.89 136.56 36.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 107.241 -1.392 . . . . 52.32 107.241 167.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.421 ' HB2' ' HD3' ' A' ' 63' ' ' LYS . 53.6 mt-10 -107.83 115.04 29.41 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 108.958 -0.756 . . . . 75.25 108.958 -179.75 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 92.2 t -96.34 114.41 33.08 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.688 0 C-N-CA 124.21 1.004 . . . . 75.55 109.572 -174.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -94.62 98.74 11.02 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 108.312 -0.996 . . . . 52.21 108.312 -177.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 90.7 t -93.76 108.23 20.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 N-CA-C 108.693 -0.854 . . . . 73.44 108.693 -176.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -108.04 103.93 13.26 Favored 'General case' 0 C--O 1.216 -0.709 0 N-CA-C 109.065 -0.717 . . . . 74.14 109.065 179.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.514 HD12 ' SD ' ' A' ' 45' ' ' MET . 12.8 tt -107.38 130.19 59.99 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 CA-C-O 121.085 0.469 . . . . 72.23 111.025 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 11.0 m -99.66 107.66 19.83 Favored 'General case' 0 C--O 1.241 0.61 0 C-N-CA 123.916 0.886 . . . . 75.14 108.652 177.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 37.5 t -130.66 120.31 23.72 Favored 'General case' 0 C--O 1.246 0.899 0 C-N-CA 123.911 0.884 . . . . 75.32 109.966 -179.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 57.9 t30 56.75 53.36 8.39 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.492 1.117 . . . . 60.34 110.986 178.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 68.95 6.87 54.65 Favored Glycine 0 C--N 1.343 0.922 0 CA-C-N 114.85 -1.068 . . . . 71.1 115.055 174.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -117.08 139.67 50.43 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.603 0.761 . . . . 52.24 110.376 -178.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 92.0 m -102.15 118.22 36.43 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.075 0.95 . . . . 62.14 110.17 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.559 ' HB3' ' NH2' ' A' ' 44' ' ' ARG . 50.4 m-85 -114.28 101.01 8.77 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.123 0.969 . . . . 71.23 109.0 -178.518 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -116.47 136.85 52.64 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 120.911 0.386 . . . . 71.32 110.719 178.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 51.8 ttt85 -147.43 139.88 24.63 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 123.518 0.727 . . . . 74.5 109.473 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 27.6 m -98.47 108.95 21.77 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 123.91 0.884 . . . . 64.34 109.671 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -97.37 127.09 43.03 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.094 0.957 . . . . 70.32 109.339 -176.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 26.2 mp0 -87.04 109.33 19.33 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 108.765 -0.828 . . . . 64.11 108.765 -178.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 70.4 mt -113.79 130.45 56.45 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.772 0.829 . . . . 65.1 109.144 179.282 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -121.79 119.06 30.58 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 108.473 -0.936 . . . . 74.24 108.473 -177.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.511 ' HB3' HD23 ' A' ' 33' ' ' LEU . . . -149.45 166.07 30.21 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-O 121.576 0.703 . . . . 71.11 110.753 177.478 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 41.6 t -106.33 -57.6 4.28 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 CA-C-N 114.38 -1.282 . . . . 65.23 108.825 176.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.663 ' HB2' ' HG3' ' A' ' 32' ' ' GLU . 66.5 mtp180 -87.97 158.29 18.69 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.805 1.242 . . . . 74.11 109.977 -179.783 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -77.07 -37.12 55.15 Favored 'General case' 0 N--CA 1.493 1.682 0 C-N-CA 124.485 1.114 . . . . 72.53 110.654 -172.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -64.08 -30.64 71.69 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 114.91 -1.041 . . . . 72.25 111.167 174.112 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.663 ' HG3' ' HB2' ' A' ' 29' ' ' ARG . 49.8 mt-10 -69.35 -23.18 63.72 Favored 'General case' 0 C--N 1.358 0.943 0 C-N-CA 122.161 0.184 . . . . 70.54 110.698 175.514 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.511 HD23 ' HB3' ' A' ' 27' ' ' ALA . 0.2 OUTLIER -84.24 -34.56 23.83 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-O 119.152 -0.451 . . . . 75.2 110.1 178.047 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.603 ' HG2' HG23 ' A' ' 80' ' ' ILE . 29.9 mtpt -53.75 -53.52 51.02 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 123.794 0.684 . . . . 62.23 112.033 -177.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.52 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 4.4 pt-20 -50.85 -47.21 60.35 Favored 'General case' 0 N--CA 1.474 0.772 0 O-C-N 124.515 1.135 . . . . 65.22 111.551 176.503 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 55.3 mttm -63.93 -38.05 89.65 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.415 0.686 . . . . 72.23 111.365 -173.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.456 HD13 HD23 ' A' ' 81' ' ' LEU . 79.8 mt -62.24 -50.48 71.56 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 124.098 0.874 . . . . 74.21 110.479 175.33 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.423 ' HG2' HG13 ' A' ' 84' ' ' VAL . 7.1 mtpm? -59.72 -34.69 73.25 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.76 0.824 . . . . 74.25 111.535 177.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.52 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 32.5 mmmt -65.49 -61.33 2.16 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 123.527 0.517 . . . . 73.03 110.739 176.152 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 46.4 t -57.6 -39.72 71.2 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.226 0 C-N-CA 124.672 1.189 . . . . 75.32 111.537 -175.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 63.5 mt -63.63 -57.19 10.85 Favored 'General case' 0 C--O 1.217 -0.642 0 CA-C-N 115.732 -0.667 . . . . 75.04 110.27 175.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.457 HD21 HD22 ' A' ' 88' ' ' LEU . 0.9 OUTLIER -60.5 -26.23 66.68 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 112.58 0.585 . . . . 75.31 112.58 -179.399 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.486 ' HA ' ' CE1' ' A' ' 117' ' ' HIS . 38.4 mm-40 -70.89 -51.86 23.64 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 120.879 0.371 . . . . 73.22 110.681 174.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.559 ' NH2' ' HB3' ' A' ' 19' ' ' TYR . 7.9 tpt180 -76.37 -32.29 58.51 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 115.481 -0.781 . . . . 73.14 112.139 -172.614 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.514 ' SD ' HD12 ' A' ' 12' ' ' ILE . 97.2 mmm -80.17 -12.8 59.61 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.161 0.584 . . . . 71.21 111.94 -172.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.77 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 9.5 t70 -70.85 -51.7 10.99 Favored Pre-proline 0 CA--C 1.569 1.707 0 CA-C-O 118.525 -0.75 . . . . 62.3 111.7 -177.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -62.04 -23.95 76.2 Favored 'Trans proline' 0 C--N 1.386 2.549 0 C-N-CA 122.031 1.821 . . . . 63.12 113.927 173.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.403 HG21 HD11 ' A' ' 12' ' ' ILE . 46.2 mm -65.27 -37.59 80.51 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 C-N-CA 123.889 0.876 . . . . 74.14 111.858 -178.32 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.77 ' HE2' ' HA ' ' A' ' 46' ' ' ASP . 45.1 mtmt -62.19 -34.41 76.39 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 122.777 0.431 . . . . 54.11 110.323 175.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -74.86 -29.09 60.92 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.767 0.827 . . . . 54.12 111.278 177.058 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 82.4 mt -68.28 -23.87 64.81 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 109.476 -0.564 . . . . 64.53 109.476 173.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.56 46.96 5.86 Favored Glycine 0 C--N 1.347 1.168 0 CA-C-N 115.163 -0.926 . . . . 24.11 112.481 166.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 20.8 p -117.03 107.35 14.42 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 123.803 0.841 . . . . 74.45 108.799 175.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -78.0 -12.8 60.02 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 110.293 -0.262 . . . . 71.54 110.293 177.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 37.1 ttt180 -116.7 127.71 54.66 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 108.781 -0.822 . . . . 73.33 108.781 170.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 28.7 m -130.8 142.11 44.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 123.825 0.85 . . . . 70.42 109.578 178.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 42.0 ttm180 -118.0 108.29 15.08 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.434 0.694 . . . . 64.3 109.819 173.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 36.6 mt -105.17 105.76 19.25 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 C-N-CA 124.593 1.157 . . . . 62.02 109.944 -177.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.416 ' HA ' ' O ' ' A' ' 102' ' ' VAL . 29.0 m -96.36 105.5 17.59 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 108.414 -0.958 . . . . 75.01 108.414 174.305 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 50.8 mt -97.5 125.11 50.7 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.726 0 C-N-CA 123.017 0.527 . . . . 70.0 110.428 178.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 1.4 mpp_? -112.79 121.32 44.35 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 107.243 -1.391 . . . . 72.24 107.243 178.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.4 p -94.59 131.12 42.32 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 N-CA-C 109.563 -0.532 . . . . 55.44 109.563 -175.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.421 ' HD3' ' HB2' ' A' ' 7' ' ' GLU . 53.6 mtpt -95.85 133.3 40.16 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 108.29 -1.004 . . . . 64.13 108.29 -178.22 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 94.6 m-70 -101.17 155.89 17.75 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 114.009 1.115 . . . . 75.12 114.009 -161.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 34.0 t -69.47 -49.36 55.52 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 113.184 -1.825 . . . . 62.44 110.863 176.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -160.19 162.21 33.77 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 122.682 0.393 . . . . 74.02 110.688 -177.242 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.32 -37.5 83.49 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.171 0.989 . . . . 74.02 111.858 177.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.17 -39.05 78.96 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.921 -0.581 . . . . 72.21 111.421 177.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -83.01 -25.94 31.7 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 115.322 -0.854 . . . . 75.3 112.362 -173.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -62.58 -36.84 83.98 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 113.204 0.816 . . . . 72.32 113.204 -167.057 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.504 ' O ' ' HD3' ' A' ' 75' ' ' LYS . 21.3 pttp -67.11 -19.89 65.7 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.941 0.896 . . . . 74.41 112.139 178.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -86.24 -50.42 6.97 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.029 0.532 . . . . 60.32 110.69 169.312 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -52.44 -48.58 65.69 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 124.427 1.091 . . . . 62.01 112.132 -173.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.88 -49.56 75.74 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.877 0.871 . . . . 61.12 112.541 -176.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.504 ' HD3' ' O ' ' A' ' 71' ' ' LYS . 3.3 mptp? -69.8 -34.12 73.27 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 115.575 -0.738 . . . . 71.2 111.035 -175.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -64.67 -48.04 76.24 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.165 0.586 . . . . 72.0 110.106 171.16 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -70.18 -21.27 63.07 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.481 1.112 . . . . 75.33 110.111 -173.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.487 ' HA ' ' NE1' ' A' ' 97' ' ' TRP . . . -63.72 -48.77 75.71 Favored 'General case' 0 C--N 1.343 0.324 0 C-N-CA 123.955 0.902 . . . . 42.01 110.722 172.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.09 -42.21 85.01 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.573 -0.739 . . . . 44.13 111.021 176.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.603 HG23 ' HG2' ' A' ' 34' ' ' LYS . 44.0 mm -58.73 -50.33 79.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 123.966 0.907 . . . . 62.44 110.797 179.633 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.456 HD23 HD13 ' A' ' 37' ' ' LEU . 23.3 mt -68.12 -36.85 80.4 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 122.928 0.491 . . . . 74.13 111.883 179.027 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -59.74 -36.96 77.67 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.295 0.638 . . . . 75.32 110.21 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -71.98 -48.55 44.12 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 115.332 -0.849 . . . . 75.02 111.119 175.069 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.479 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 23.2 t -58.76 -55.33 23.82 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 C-N-CA 123.989 0.916 . . . . 74.51 111.323 -174.307 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.448 ' CE2' HG21 ' A' ' 104' ' ' VAL . 55.3 m-85 -59.89 -36.43 76.94 Favored 'General case' 0 N--CA 1.48 1.059 0 O-C-N 123.929 0.768 . . . . 64.21 112.231 179.257 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -71.19 -24.18 62.18 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 122.941 0.496 . . . . 75.11 111.858 178.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -84.8 -5.78 59.34 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.824 0.85 . . . . 70.31 111.004 175.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 68.4 mt -105.41 -31.06 9.2 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 122.701 0.4 . . . . 41.12 110.873 -179.578 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 143.6 -10.77 2.17 Favored Glycine 0 C--N 1.348 1.234 0 CA-C-O 119.404 -0.665 . . . . 64.11 114.287 177.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.443 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 97.1 m-85 -74.75 126.56 31.16 Favored 'General case' 0 N--CA 1.484 1.229 0 CA-C-N 118.271 1.036 . . . . 73.14 110.682 176.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.416 HD22 ' N ' ' A' ' 91' ' ' ASN . 0.8 OUTLIER -95.62 91.72 6.27 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.494 0.718 . . . . 75.11 111.333 -174.023 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 20.8 t70 54.8 -81.19 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 124.819 1.247 . . . . 73.04 113.989 165.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 20.1 m -66.73 -13.8 61.8 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 124.172 0.989 . . . . 50.21 113.144 -175.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . 0.459 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 10.6 m120 -55.37 -37.44 67.53 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.175 0.59 . . . . 73.51 110.671 168.506 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 45.1 t -99.03 118.32 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 125.137 1.375 . . . . 71.45 110.092 -174.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 45.5 m -144.69 128.05 16.87 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-N 118.442 0.565 . . . . 73.51 110.568 173.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.487 ' NE1' ' HA ' ' A' ' 78' ' ' ALA . 27.7 m95 -87.17 152.49 22.28 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 124.129 0.971 . . . . 73.41 111.513 -179.317 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -159.72 92.76 1.05 Allowed 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.139 0.975 . . . . 73.03 109.036 177.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 59.25 58.54 13.92 Favored Glycine 0 C--N 1.346 1.105 0 CA-C-N 115.887 -0.597 . . . . 73.25 113.501 177.273 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 71.03 3.41 4.64 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 124.88 1.272 . . . . 61.41 113.055 179.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 37.7 m -119.59 110.75 17.23 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 108.916 -0.772 . . . . 74.24 108.916 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.416 ' O ' ' HA ' ' A' ' 59' ' ' SER . 6.9 p -99.76 119.8 48.3 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 N-CA-C 109.471 -0.566 . . . . 72.13 109.471 179.842 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 87.0 m -92.35 104.4 16.75 Favored 'General case' 0 C--O 1.241 0.634 0 N-CA-C 108.221 -1.029 . . . . 73.15 108.221 176.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.459 ' HA ' ' O ' ' A' ' 94' ' ' ASN . 48.8 t -108.48 109.49 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 C-N-CA 124.234 1.013 . . . . 72.35 108.37 179.056 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -135.76 147.24 48.32 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 122.465 0.306 . . . . 62.32 110.269 -176.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.413 ' HA3' ' ND2' ' A' ' 94' ' ' ASN . . . 168.27 -160.39 33.9 Favored Glycine 0 C--O 1.245 0.782 0 CA-C-N 115.825 -0.625 . . . . 72.12 112.338 -177.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 27.2 pt20 -88.4 117.67 27.49 Favored 'General case' 0 CA--C 1.55 0.964 0 CA-C-O 121.758 0.789 . . . . 70.34 111.623 -174.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 28.0 tp -78.79 172.77 13.27 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 124.502 1.121 . . . . 44.13 109.876 169.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 84.12 -44.33 0.09 Allowed 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 126.313 1.845 . . . . 74.54 109.707 -176.05 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -69.7 -35.66 74.21 Favored Glycine 0 C--N 1.343 0.948 0 N-CA-C 110.887 -0.885 . . . . 53.44 110.887 169.138 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 65.2 t -80.79 97.25 3.19 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.877 0 N-CA-C 108.545 -0.909 . . . . 70.44 108.545 169.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -168.63 131.09 1.35 Allowed 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.978 0.911 . . . . 74.31 108.974 -174.184 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 79.5 mt -119.48 147.03 44.9 Favored 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 108.893 -0.781 . . . . 71.11 108.893 175.017 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -69.96 80.39 0.48 Allowed 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.506 1.122 . . . . 73.21 111.909 -172.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 3.6 p-80 -169.85 80.33 0.11 Allowed 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.159 1.384 . . . . 74.45 108.121 173.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 83.0 t60 -79.06 73.48 5.61 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-O 122.303 1.049 . . . . 55.12 108.734 177.087 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.486 ' CE1' ' HA ' ' A' ' 43' ' ' GLU . 23.8 p80 -64.33 -33.66 76.35 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 113.508 -1.678 . . . . 63.14 110.88 179.062 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 21.5 t-80 -86.35 111.51 20.55 Favored 'General case' 0 C--O 1.224 -0.255 0 C-N-CA 124.418 1.087 . . . . 74.55 110.05 -176.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 33.4 p-80 -124.15 39.03 4.06 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.37 1.068 . . . . 75.23 109.351 -178.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 59.3 t-80 . . . . . 0 C--O 1.249 1.067 0 C-N-CA 123.717 0.807 . . . . 74.24 109.562 -178.043 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.551 1.009 0 CA-C-O 121.771 0.796 . . . . 73.31 110.13 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.2 m -75.38 -42.9 52.84 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 121.748 0.785 . . . . 73.22 110.052 173.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -172.64 71.45 0.1 Allowed Glycine 0 C--N 1.338 0.65 0 N-CA-C 109.81 -1.316 . . . . 70.41 109.81 179.291 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.9 mmmm -72.93 141.69 47.83 Favored 'General case' 0 C--O 1.24 0.604 0 CA-C-O 121.221 0.534 . . . . 72.14 110.975 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.52 ' HA ' ' HA ' ' A' ' 26' ' ' TYR . 40.5 ttpt -83.05 110.9 18.39 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 106.89 -1.522 . . . . 74.44 106.89 166.591 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.539 HG21 HG22 ' A' ' 62' ' ' VAL . 7.2 p -98.21 149.91 5.05 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 N-CA-C 108.87 -0.789 . . . . 74.1 108.87 -176.101 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.446 ' HB3' HG22 ' A' ' 22' ' ' THR . 37.2 mt-10 -109.85 113.19 25.73 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 108.988 -0.745 . . . . 72.41 108.988 -176.002 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 79.5 t -100.71 118.24 47.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 C-N-CA 124.614 1.166 . . . . 73.43 109.333 -176.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -96.84 102.48 14.27 Favored 'General case' 0 C--O 1.24 0.588 0 N-CA-C 108.034 -1.099 . . . . 75.43 108.034 -178.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.433 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 48.2 t -93.67 104.65 15.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 N-CA-C 108.442 -0.947 . . . . 44.43 108.442 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -108.17 105.17 14.78 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.946 0.898 . . . . 71.35 109.009 -175.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.546 HD13 HG13 ' A' ' 48' ' ' ILE . 17.6 tt -123.41 118.4 54.36 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-O 121.256 0.551 . . . . 74.11 110.973 -178.337 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 21.8 m -95.01 121.03 36.21 Favored 'General case' 0 C--O 1.242 0.703 0 N-CA-C 108.676 -0.861 . . . . 64.11 108.676 177.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.422 ' SG ' HG23 ' A' ' 48' ' ' ILE . 26.3 t -145.26 141.92 29.04 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 124.213 1.005 . . . . 62.43 109.756 -178.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 46.6 t-20 72.03 -74.02 0.09 Allowed 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 125.182 1.393 . . . . 72.52 109.471 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -168.2 11.56 0.06 OUTLIER Glycine 0 C--N 1.338 0.662 0 N-CA-C 111.024 -0.83 . . . . 53.04 111.024 172.018 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 27.8 mmmt -122.3 138.29 54.56 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 124.743 1.217 . . . . 65.4 109.368 -175.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 53.7 m -98.09 122.78 41.65 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 108.819 -0.808 . . . . 63.54 108.819 174.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -106.13 101.47 10.95 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 107.106 -1.442 . . . . 73.33 107.106 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.433 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 12.8 pt-20 -130.7 141.75 50.41 Favored 'General case' 0 C--O 1.241 0.619 0 CA-C-O 121.217 0.532 . . . . 71.14 110.17 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 57.9 ttt85 -155.29 148.01 24.28 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 114.805 -1.089 . . . . 74.52 108.497 174.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.446 HG22 ' HB3' ' A' ' 7' ' ' GLU . 22.4 m -93.38 108.69 20.31 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.88 0.872 . . . . 74.03 108.926 177.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 80.3 m-85 -98.76 132.14 44.36 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.121 0.968 . . . . 64.14 110.169 -174.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.426 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 1.9 mp0 -88.96 107.59 19.11 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 108.365 -0.976 . . . . 61.13 108.365 178.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 33.5 mt -112.06 106.82 15.56 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.119 0.967 . . . . 73.32 109.288 179.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.52 ' HA ' ' HA ' ' A' ' 5' ' ' LYS . 55.0 t80 -81.07 128.16 33.42 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.165 0.586 . . . . 73.44 109.844 176.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.427 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -141.19 147.88 39.07 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.182 0.593 . . . . 73.03 110.461 174.096 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 58.7 t -84.85 -40.23 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 CA-C-N 115.645 -0.707 . . . . 53.25 109.163 172.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.53 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 40.0 mtt180 -120.16 162.49 19.26 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 115.043 -0.98 . . . . 74.42 109.841 -178.166 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -63.56 -38.01 89.52 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 115.133 -0.939 . . . . 64.21 110.797 171.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -65.91 -27.49 68.23 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.942 0.897 . . . . 65.21 111.781 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.53 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 12.4 mm-40 -68.0 -39.13 83.3 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 122.399 0.28 . . . . 72.41 110.362 177.682 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.572 HD22 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -66.11 -20.19 66.08 Favored 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 123.583 0.753 . . . . 71.5 110.986 -175.136 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.1 mtpp -54.03 -62.97 1.31 Allowed 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.661 0.785 . . . . 73.33 111.994 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.554 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 2.5 pp20? -65.0 -30.37 71.36 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 116.107 -0.497 . . . . 73.53 111.471 -176.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.572 ' HD2' HD22 ' A' ' 33' ' ' LEU . 53.8 mttm -64.42 -41.69 96.47 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.665 0.786 . . . . 65.4 110.495 178.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.437 HD13 HD23 ' A' ' 81' ' ' LEU . 74.4 mt -56.31 -52.75 63.37 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 124.014 0.821 . . . . 43.13 109.746 171.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.2 mtpm? -56.77 -37.79 71.57 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 124.121 0.888 . . . . 64.21 112.004 -178.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.554 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 29.9 mmtp -61.84 -55.29 31.45 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 122.948 0.499 . . . . 74.14 110.137 177.105 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 92.7 t -64.55 -34.11 67.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-N 115.008 -0.997 . . . . 73.32 111.422 -176.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.462 HD21 HD11 ' A' ' 60' ' ' ILE . 64.2 mt -72.4 -41.0 66.78 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.358 0.663 . . . . 74.3 111.023 -177.17 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.8 m-80 -64.94 -40.38 94.95 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 122.356 0.262 . . . . 70.31 111.109 174.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 47.7 mm-40 -65.95 -46.81 76.78 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.262 0.625 . . . . 64.52 111.4 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? -69.58 -39.26 77.45 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.35 0.66 . . . . 74.25 111.54 -177.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.476 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 54.3 mtp -88.45 -7.91 55.81 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 113.169 0.803 . . . . 74.1 113.169 -175.63 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -63.27 -51.47 68.59 Favored Pre-proline 0 CA--C 1.569 1.693 0 CA-C-O 118.548 -0.739 . . . . 73.3 111.573 178.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -66.49 -23.28 50.58 Favored 'Trans proline' 0 C--N 1.398 3.181 0 C-N-CA 122.383 2.056 . . . . 74.33 112.801 175.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.546 HG13 HD13 ' A' ' 12' ' ' ILE . 51.2 mm -67.07 -29.98 47.95 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 C-N-CA 124.148 0.979 . . . . 71.44 110.077 179.693 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.476 ' HG3' ' O ' ' A' ' 45' ' ' MET . 92.7 mttt -70.02 -34.5 73.37 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 115.272 -0.877 . . . . 74.44 110.6 175.625 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.4 ttmp? -74.24 -26.64 60.35 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.088 0.555 . . . . 71.45 111.319 178.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 88.8 mt -70.99 -45.01 64.76 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 108.995 -0.743 . . . . 62.33 108.995 172.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 88.21 17.87 56.64 Favored Glycine 0 C--N 1.342 0.903 0 CA-C-N 115.392 -0.822 . . . . 63.14 114.671 171.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.537 ' SG ' HG12 ' A' ' 56' ' ' VAL . 6.6 p -62.04 122.45 15.54 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 123.602 0.761 . . . . 70.11 110.131 175.209 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm -62.65 -57.15 12.06 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.212 0.605 . . . . 75.13 110.445 -177.189 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 33.5 ttp180 -103.48 128.23 50.71 Favored 'General case' 0 C--N 1.345 0.384 0 CA-C-N 115.504 -0.771 . . . . 71.54 109.11 176.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.537 HG12 ' SG ' ' A' ' 53' ' ' CYS . 34.5 m -116.08 142.96 27.32 Favored 'Isoleucine or valine' 0 C--O 1.244 0.785 0 C-N-CA 123.62 0.768 . . . . 75.32 109.437 176.467 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -100.42 103.1 14.46 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 108.52 -0.918 . . . . 73.05 108.52 177.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 36.9 mt -102.09 140.07 21.56 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 N-CA-C 107.994 -1.113 . . . . 64.03 107.994 179.065 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 32.4 t -141.9 104.24 4.47 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 107.327 -1.36 . . . . 60.32 107.327 175.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.462 HD11 HD21 ' A' ' 41' ' ' LEU . 78.2 mt -103.26 107.55 22.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 N-CA-C 108.511 -0.922 . . . . 74.31 108.511 -178.308 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 28.0 ttt180 -102.27 131.79 48.62 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 108.518 -0.919 . . . . 71.02 108.518 173.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.539 HG22 HG21 ' A' ' 6' ' ' VAL . 8.0 p -95.04 139.2 19.16 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 N-CA-C 106.979 -1.489 . . . . 75.13 106.979 174.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -82.77 136.99 34.52 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-O 121.134 0.492 . . . . 73.25 109.872 -175.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . 0.57 ' HB3' ' HG3' ' A' ' 70' ' ' GLU . 73.7 m80 -105.43 127.61 53.08 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 124.47 1.108 . . . . 61.33 109.397 -169.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 23.3 t -83.35 -47.81 11.07 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.643 0.777 . . . . 64.23 111.481 -171.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -109.29 -105.04 0.36 Allowed 'General case' 0 CA--C 1.56 1.329 0 C-N-CA 123.439 0.696 . . . . 74.23 109.998 -175.027 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.405 ' O ' ' HG2' ' A' ' 71' ' ' LYS . . . 176.71 -60.25 0.01 OUTLIER 'General case' 0 C--N 1.362 1.111 0 C-N-CA 125.351 1.46 . . . . 75.54 107.9 -177.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.27 -42.79 68.31 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 115.436 -0.802 . . . . 73.52 110.419 178.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -62.19 -36.04 80.69 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 115.572 -0.74 . . . . 43.42 110.461 173.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.57 ' HG3' ' HB3' ' A' ' 64' ' ' HIS . 41.5 mm-40 -73.2 -22.61 60.42 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.23 0.612 . . . . 71.14 112.137 -175.024 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.405 ' HG2' ' O ' ' A' ' 67' ' ' ALA . 3.1 mmmp? -63.39 -33.58 75.85 Favored 'General case' 0 N--CA 1.483 1.187 0 CA-C-O 121.285 0.564 . . . . 73.0 110.128 172.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 34.1 ttpt -84.29 -46.0 12.25 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.764 1.226 . . . . 71.34 110.96 177.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -80.5 -30.81 37.3 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 112.873 0.694 . . . . 70.43 112.873 -168.293 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -78.62 -30.6 46.58 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 122.594 0.358 . . . . 73.4 110.279 175.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 51.9 tttm -63.39 -40.5 97.39 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.618 0.767 . . . . 61.5 110.201 168.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -67.19 -40.69 86.57 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.693 0.797 . . . . 71.43 110.384 175.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -76.47 -19.04 58.43 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.984 0.914 . . . . 72.12 110.588 -175.215 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.2 -45.74 83.5 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.286 0.634 . . . . 40.53 110.448 173.221 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.69 -34.17 75.28 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.54 -0.755 . . . . 74.13 111.255 176.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 46.4 mm -67.68 -50.72 58.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 123.86 0.864 . . . . 74.1 110.918 -179.249 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.437 HD23 HD13 ' A' ' 37' ' ' LEU . 34.4 mt -66.11 -50.72 63.07 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 123.625 0.578 . . . . 72.34 110.174 -176.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -56.89 -41.29 77.78 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 124.029 0.932 . . . . 64.35 111.543 -177.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 19.7 mmmt -64.96 -44.71 88.5 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 123.76 0.663 . . . . 74.35 111.255 176.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.419 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 25.0 t -62.61 -44.7 99.62 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 C-N-CA 123.017 0.527 . . . . 64.2 110.124 -176.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.558 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 20.6 m-85 -60.77 -42.3 97.2 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 124.091 0.869 . . . . 74.42 110.273 177.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.39 -34.13 77.07 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.529 0.731 . . . . 73.51 111.331 177.558 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -81.27 -8.02 59.67 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.022 0.929 . . . . 74.25 110.85 -178.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 93.1 mt -107.22 -9.77 16.01 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.821 0.848 . . . . 70.01 110.397 176.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 109.4 -5.73 31.65 Favored Glycine 0 N--CA 1.478 1.485 0 N-CA-C 114.096 0.399 . . . . 50.14 114.096 175.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.619 ' HB3' HD21 ' A' ' 94' ' ' ASN . 9.9 m-85 -79.66 138.85 37.51 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.374 0.67 . . . . 63.13 109.438 179.048 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 28.3 m-80 -96.53 168.77 10.34 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.548 0.739 . . . . 71.23 111.735 -176.167 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -54.45 -45.46 73.11 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.926 1.29 . . . . 75.43 111.041 177.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 23.9 m -57.48 -46.45 83.69 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 124.71 1.204 . . . . 61.31 113.424 -173.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . 0.619 HD21 ' HB3' ' A' ' 90' ' ' TYR . 3.7 p-10 -83.05 -11.24 58.23 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 122.743 0.417 . . . . 51.35 111.675 -177.111 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 97.0 t -88.6 102.1 12.48 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 N-CA-C 107.956 -1.127 . . . . 51.5 107.956 172.031 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 22.7 m -108.25 103.78 13.03 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.572 0.749 . . . . 64.14 110.458 -173.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 43.0 m95 -79.94 150.48 30.5 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.347 0.659 . . . . 74.11 111.65 178.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -144.28 69.88 1.28 Allowed 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 106.966 -1.494 . . . . 72.31 106.966 170.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 52.37 -82.4 0.01 OUTLIER Glycine 0 C--N 1.361 1.955 0 CA-C-N 114.156 -1.384 . . . . 41.12 114.777 179.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -72.55 -39.1 67.75 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 126.041 1.736 . . . . 34.04 112.776 -174.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 35.6 m -131.4 149.65 52.46 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.754 0.822 . . . . 50.43 110.475 -174.422 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 7.4 p -116.82 137.98 48.93 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 C-N-CA 123.329 0.652 . . . . 75.04 110.361 176.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 39.4 m -114.28 108.76 17.36 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.864 1.266 . . . . 71.01 109.073 176.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.4 t -101.04 119.69 49.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 C-N-CA 123.406 0.682 . . . . 73.43 109.475 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -86.32 113.07 22.01 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 107.333 -1.358 . . . . 75.22 107.333 171.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -105.02 167.31 14.99 Favored Glycine 0 C--N 1.34 0.804 0 N-CA-C 111.815 -0.514 . . . . 43.53 111.815 -176.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -138.36 128.58 25.84 Favored 'General case' 0 C--O 1.241 0.633 0 C-N-CA 123.79 0.836 . . . . 65.03 110.179 -175.29 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.401 HD11 ' HG2' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -74.34 123.74 25.17 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.894 0.878 . . . . 72.02 108.8 -178.766 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 42.56 22.45 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.86 0 C-N-CA 126.165 1.786 . . . . 74.14 114.482 -173.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -74.97 -32.33 56.85 Favored Glycine 0 C--N 1.352 1.434 0 N-CA-C 108.796 -1.722 . . . . 43.41 108.796 164.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 30.6 m -69.15 -164.17 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.559 1.311 0 C-N-CA 125.055 1.342 . . . . 73.41 110.293 164.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -51.13 121.11 5.64 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.293 0.637 . . . . 73.01 111.353 -178.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 85.6 mt -64.5 98.17 0.24 Allowed 'General case' 0 C--O 1.242 0.659 0 C-N-CA 123.795 0.838 . . . . 73.43 109.339 176.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -67.09 126.49 29.34 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 115.048 -0.978 . . . . 73.25 111.028 -172.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 59.0 m80 -67.97 -24.16 65.12 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.5 0.72 . . . . 73.1 110.569 177.335 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 50.3 t60 -61.76 104.91 0.49 Allowed 'General case' 0 C--O 1.244 0.8 0 N-CA-C 107.807 -1.183 . . . . 74.1 107.807 164.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 30.1 m80 -67.28 90.93 0.23 Allowed 'General case' 0 CA--C 1.534 0.334 0 O-C-N 124.074 0.859 . . . . 74.15 111.519 -172.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 55.4 p-80 -98.53 -162.75 0.98 Allowed 'General case' 0 C--O 1.248 0.988 0 N-CA-C 107.341 -1.355 . . . . 73.52 107.341 166.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -66.19 159.34 26.57 Favored 'General case' 0 CA--C 1.558 1.279 0 CA-C-N 118.424 0.556 . . . . 73.31 111.052 -178.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 4.3 p80 . . . . . 0 CA--C 1.553 1.091 0 C-N-CA 125.112 1.365 . . . . 62.43 108.4 162.509 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.1 ptt? . . . . . 0 N--CA 1.48 1.03 0 N-CA-C 109.934 -0.395 . . . . 72.34 109.934 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.8 m 67.62 167.96 0.25 Allowed 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.69 1.196 . . . . 63.25 111.023 -173.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -69.09 81.68 0.25 Allowed Glycine 0 C--N 1.343 0.941 0 N-CA-C 112.12 -0.392 . . . . 74.53 112.12 178.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.7 tppp? -124.06 128.49 49.4 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 123.494 0.718 . . . . 72.45 110.126 -175.265 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 26.8 ttpt -85.94 111.07 19.9 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-N 115.436 -0.802 . . . . 72.31 109.12 174.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.4 p -99.66 142.38 15.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 N-CA-C 108.122 -1.066 . . . . 61.22 108.122 171.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.548 ' HB3' HG22 ' A' ' 22' ' ' THR . 50.2 mt-10 -113.71 118.91 35.65 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 109.521 -0.548 . . . . 41.12 109.521 177.507 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 59.2 t -106.75 116.02 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 C-N-CA 124.429 1.092 . . . . 62.11 109.688 -171.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.409 ' O ' ' HA ' ' A' ' 60' ' ' ILE . 43.4 tt0 -92.26 102.7 15.2 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 107.987 -1.116 . . . . 54.43 107.987 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 98.0 t -96.89 102.71 13.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 N-CA-C 108.317 -0.994 . . . . 73.35 108.317 178.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.497 ' HA ' ' HB3' ' A' ' 20' ' ' GLU . 22.1 ttmm -104.22 103.56 13.34 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 108.573 -0.899 . . . . 72.11 108.573 -178.119 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.494 HD13 HG13 ' A' ' 48' ' ' ILE . 11.8 tt -112.55 124.21 69.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 CA-C-O 121.069 0.462 . . . . 75.45 109.943 179.419 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 11.9 m -98.04 113.5 25.39 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.615 0.766 . . . . 75.34 109.247 178.386 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.596 ' SG ' HG23 ' A' ' 48' ' ' ILE . 18.4 t -153.81 150.6 28.63 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.914 1.286 . . . . 53.24 108.849 179.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.525 ' HB2' HD13 ' A' ' 51' ' ' LEU . 62.5 t30 69.82 12.77 8.02 Favored 'General case' 0 N--CA 1.504 2.261 0 C-N-CA 124.273 1.029 . . . . 70.44 111.295 178.715 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 77.94 4.86 86.39 Favored Glycine 0 C--N 1.349 1.291 0 CA-C-N 116.414 -0.357 . . . . 53.22 112.319 -171.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.4 mmpt? -113.53 165.78 12.15 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.583 1.153 . . . . 73.21 109.526 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 39.8 m -119.36 115.66 24.59 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 109.281 -0.637 . . . . 71.1 109.281 174.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -103.62 106.22 16.67 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 107.131 -1.433 . . . . 73.14 107.131 -179.4 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.497 ' HB3' ' HA ' ' A' ' 11' ' ' LYS . 16.9 pt-20 -143.29 161.6 37.88 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.523 0.678 . . . . 71.2 112.212 -176.032 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 35.6 ttm180 -167.21 148.24 5.66 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-N 113.764 -1.562 . . . . 74.52 108.063 176.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.548 HG22 ' HB3' ' A' ' 7' ' ' GLU . 27.8 m -92.37 112.99 25.13 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 107.337 -1.357 . . . . 52.24 107.337 169.651 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 -97.51 127.26 43.33 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.062 0.945 . . . . 74.04 109.902 -173.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -83.85 106.07 15.24 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 107.502 -1.296 . . . . 73.54 107.502 178.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 81.5 mt -112.98 119.95 39.69 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.292 1.037 . . . . 71.23 108.337 -179.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -109.1 118.81 37.73 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 109.024 -0.732 . . . . 75.54 109.024 -177.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -124.84 150.91 45.92 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.269 0.628 . . . . 50.14 110.098 178.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 44.9 t -95.01 -26.31 4.39 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 C-N-CA 123.881 0.872 . . . . 75.11 109.489 175.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.6 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 90.3 mtt180 -131.72 157.03 44.86 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 108.158 -1.052 . . . . 73.01 108.158 174.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -67.67 -32.96 74.0 Favored 'General case' 0 N--CA 1.488 1.427 0 CA-C-O 121.239 0.542 . . . . 64.14 111.012 -178.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -70.2 -21.35 63.04 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.138 0.975 . . . . 73.42 111.343 -179.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.6 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 27.6 mm-40 -68.93 -23.7 64.19 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 122.875 0.47 . . . . 73.01 110.813 174.8 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.61 HD22 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -73.18 -19.29 61.14 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 123.238 0.615 . . . . 65.21 111.217 -177.386 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -54.86 -59.19 5.06 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.682 0.793 . . . . 74.33 111.573 178.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -57.5 -36.37 71.45 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.847 0.859 . . . . 54.33 112.487 -177.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.61 ' HD2' HD22 ' A' ' 33' ' ' LEU . 62.0 mttm -67.25 -46.09 74.77 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.298 -0.865 . . . . 73.42 109.912 -177.327 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.479 HD13 HD23 ' A' ' 81' ' ' LEU . 95.9 mt -65.63 -40.04 92.12 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.411 0.684 . . . . 63.41 111.874 177.767 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 60.2 mtpt -59.47 -42.44 92.06 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 122.929 0.492 . . . . 62.12 110.697 177.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 34.1 mmtm -67.64 -57.21 6.82 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 123.506 0.504 . . . . 74.2 111.268 176.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 53.0 t -56.07 -44.51 78.9 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.94 0 C-N-CA 123.213 0.605 . . . . 74.11 111.508 -175.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.47 HD21 HD11 ' A' ' 60' ' ' ILE . 83.8 mt -68.99 -59.82 2.79 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.003 0.521 . . . . 70.24 111.311 179.407 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 60.8 t30 -60.69 -38.42 84.92 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 123.415 0.686 . . . . 70.15 112.173 -172.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 26.7 mm-40 -80.17 -32.55 38.77 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.366 0.666 . . . . 63.35 111.921 -177.322 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 4.5 tpt180 -68.74 -33.83 74.57 Favored 'General case' 0 N--CA 1.486 1.358 0 CA-C-O 121.318 0.58 . . . . 74.43 109.506 172.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.528 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 58.2 mtp -86.64 -6.35 58.88 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.295 -0.866 . . . . 72.22 112.058 178.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -63.19 -51.08 72.05 Favored Pre-proline 0 CA--C 1.565 1.549 0 CA-C-O 118.814 -0.612 . . . . 73.51 111.723 178.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -66.72 -22.31 50.23 Favored 'Trans proline' 0 C--N 1.384 2.422 0 C-N-CA 121.423 1.415 . . . . 62.43 112.263 172.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.596 HG23 ' SG ' ' A' ' 14' ' ' CYS . 45.3 mm -71.82 -27.13 26.91 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 123.552 0.741 . . . . 71.42 110.354 179.13 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.556 ' HB3' ' HA2' ' A' ' 110' ' ' GLY . 90.1 mttt -71.08 -36.58 72.29 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.474 0.71 . . . . 70.32 110.348 174.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.33 -32.73 70.58 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 123.561 0.744 . . . . 63.41 109.335 175.545 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.525 HD13 ' HB2' ' A' ' 15' ' ' ASN . 92.9 mt -70.07 -34.42 73.17 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 109.655 -0.498 . . . . 54.43 109.655 175.176 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 73.83 45.62 26.72 Favored Glycine 0 C--N 1.342 0.871 0 CA-C-N 115.513 -0.767 . . . . 61.51 113.285 176.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 49.9 m -76.0 112.74 12.75 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 108.918 -0.771 . . . . 73.11 108.918 169.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -58.52 -33.06 69.43 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.254 1.021 . . . . 70.04 111.084 -179.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 43.9 ttp180 -145.7 143.79 29.98 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.452 1.101 . . . . 75.24 108.489 177.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.476 ' O ' ' HA ' ' A' ' 105' ' ' GLU . 28.7 m -131.42 147.88 32.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 123.953 0.901 . . . . 55.22 109.488 179.371 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 52.3 ttt85 -102.7 107.22 18.03 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 108.812 -0.81 . . . . 71.45 108.812 175.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 37.9 mt -107.6 107.91 23.93 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 C-N-CA 123.371 0.668 . . . . 63.34 109.641 -177.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 18.2 m -98.75 105.67 17.84 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 108.479 -0.934 . . . . 74.43 108.479 174.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.47 HD11 HD21 ' A' ' 41' ' ' LEU . 71.8 mt -100.3 134.27 40.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 123.129 0.572 . . . . 62.01 109.481 177.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 21.9 mtm180 -128.37 136.53 51.06 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.564 0.746 . . . . 55.33 109.544 174.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 14.7 p -95.78 137.22 24.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 123.542 0.737 . . . . 61.3 109.203 178.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.419 ' HB3' ' H ' ' A' ' 7' ' ' GLU . 63.8 tttm -83.16 114.8 21.58 Favored 'General case' 0 C--O 1.244 0.798 0 N-CA-C 107.602 -1.258 . . . . 54.24 107.602 174.527 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . 0.597 ' HA ' ' HG2' ' A' ' 73' ' ' GLU . 21.6 m170 -69.71 132.97 46.96 Favored 'General case' 0 C--O 1.234 0.258 0 O-C-N 123.885 0.741 . . . . 73.43 110.132 -172.214 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 19.7 t -57.04 -52.34 65.65 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 123.836 0.854 . . . . 51.24 111.529 -179.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.603 ' H ' ' HB2' ' A' ' 69' ' ' GLU . 21.8 m-20 -144.99 179.69 7.18 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 124.306 1.043 . . . . 61.51 109.576 -178.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.26 -51.28 64.36 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.974 0.91 . . . . 71.22 111.085 176.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.17 -26.27 68.09 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.473 0.709 . . . . 63.52 111.421 177.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.603 ' HB2' ' H ' ' A' ' 66' ' ' ASP . 30.9 mm-40 -73.97 -30.2 62.38 Favored 'General case' 0 C--O 1.204 -1.327 0 CA-C-O 118.136 -0.935 . . . . 71.41 112.516 179.147 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -49.48 -47.89 48.2 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 114.166 1.173 . . . . 74.4 114.166 -168.463 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 40.9 mtmt -69.2 -39.71 78.47 Favored 'General case' 0 N--CA 1.479 0.975 0 CA-C-N 115.477 -0.783 . . . . 53.22 110.585 -177.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -69.54 -33.66 73.1 Favored 'General case' 0 C--O 1.212 -0.914 0 CA-C-N 114.581 -1.191 . . . . 74.23 110.225 175.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.597 ' HG2' ' HA ' ' A' ' 64' ' ' HIS . 10.1 tp10 -73.16 -39.32 65.74 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.953 1.301 . . . . 73.42 110.376 -166.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.23 -53.46 56.9 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 115.304 -0.862 . . . . 63.13 110.841 173.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 59.0 mttp -66.44 -39.47 88.93 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 124.396 1.078 . . . . 70.2 112.447 -179.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -58.32 -54.58 45.45 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 125.387 1.475 . . . . 63.32 109.815 -179.12 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -73.37 -26.5 61.03 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 113.45 -1.705 . . . . 74.54 110.371 -177.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.4 -44.66 90.61 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.433 0.693 . . . . 73.34 111.076 175.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.51 -43.13 99.42 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.351 0.66 . . . . 50.03 111.219 178.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 49.0 mm -66.45 -44.29 90.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 CA-C-N 115.866 -0.606 . . . . 72.51 110.756 178.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.479 HD23 HD13 ' A' ' 37' ' ' LEU . 32.1 mt -64.7 -36.98 86.02 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.368 0.667 . . . . 63.41 110.975 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -55.53 -44.26 76.51 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.215 1.006 . . . . 54.22 110.233 179.238 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.421 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 33.7 mmtp -68.05 -45.09 74.89 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 114.841 -1.072 . . . . 75.52 110.961 177.562 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 77.5 t -66.87 -45.75 86.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 123.312 0.645 . . . . 73.22 111.151 -172.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.467 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 24.1 m-85 -60.75 -38.48 85.34 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.214 0.606 . . . . 72.45 110.718 176.145 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.32 -28.22 67.81 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.105 0.562 . . . . 65.24 111.485 176.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.421 ' HG3' ' O ' ' A' ' 83' ' ' LYS . 45.0 mt-10 -82.07 -14.96 55.06 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.538 0.735 . . . . 75.22 110.645 176.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 97.2 mt -107.34 -2.77 20.31 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.77 0.828 . . . . 73.42 110.846 -178.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 82.01 19.21 65.64 Favored Glycine 0 C--N 1.348 1.245 0 N-CA-C 114.503 0.561 . . . . 71.43 114.503 175.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.467 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 14.6 m-85 -89.39 137.68 32.11 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 109.419 -0.586 . . . . 71.13 109.419 173.084 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -80.51 150.69 29.55 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.57 0.748 . . . . 74.53 110.189 -176.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -67.37 -31.63 72.0 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.903 0.881 . . . . 71.33 112.11 -176.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 16.8 m -58.42 -27.02 63.92 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.123 0.569 . . . . 72.25 112.224 174.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 42.1 m-20 -75.6 -22.34 57.0 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.071 0.549 . . . . 70.42 111.116 178.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.515 ' HA ' HG22 ' A' ' 104' ' ' VAL . 47.9 t -91.16 105.84 16.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 124.335 1.054 . . . . 71.24 109.616 -171.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 19.3 m -129.75 112.84 14.02 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.059 0.544 . . . . 71.41 111.318 -174.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 65.5 m95 -87.34 119.34 27.51 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.683 0.793 . . . . 72.12 111.351 177.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -137.85 115.06 10.97 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.437 1.095 . . . . 71.43 108.64 172.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 64.26 43.7 96.62 Favored Glycine 0 C--N 1.351 1.404 0 O-C-N 124.05 0.844 . . . . 71.34 113.63 175.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 63.07 17.55 10.23 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 124.97 1.308 . . . . 74.52 111.672 179.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 25.4 m -118.56 119.78 35.53 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 107.087 -1.449 . . . . 71.03 107.087 175.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.409 HG11 HD13 ' A' ' 81' ' ' LEU . 7.7 p -99.04 115.65 40.13 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 N-CA-C 109.013 -0.736 . . . . 75.32 109.013 178.188 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 41.7 m -94.52 118.52 31.79 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 107.913 -1.143 . . . . 70.43 107.913 177.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.515 HG22 ' HA ' ' A' ' 95' ' ' VAL . 55.9 t -128.54 114.97 35.73 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 C-N-CA 123.994 0.917 . . . . 74.31 108.609 -178.236 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.476 ' HA ' ' O ' ' A' ' 56' ' ' VAL . 3.4 mp0 -85.1 110.95 19.33 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 108.007 -1.109 . . . . 73.55 108.007 171.219 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -104.11 148.14 16.77 Favored Glycine 0 C--N 1.337 0.629 0 N-CA-C 109.747 -1.341 . . . . 64.25 109.747 179.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -131.94 143.37 50.07 Favored 'General case' 0 C--O 1.241 0.658 0 CA-C-O 121.216 0.531 . . . . 71.23 110.518 -173.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -147.74 157.76 43.69 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-N 114.702 -1.135 . . . . 71.14 109.486 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -94.98 -25.87 16.33 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.581 0.752 . . . . 70.41 109.408 170.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . 0.556 ' HA2' ' HB3' ' A' ' 49' ' ' LYS . . . 89.27 -60.96 3.68 Favored Glycine 0 C--N 1.341 0.858 0 CA-C-N 115.585 -0.734 . . . . 63.02 111.773 -177.157 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 33.7 m -78.93 156.15 4.85 Favored 'Isoleucine or valine' 0 C--O 1.244 0.8 0 C-N-CA 123.593 0.757 . . . . 61.51 109.986 173.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -66.1 145.06 56.28 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 122.777 0.431 . . . . 73.32 110.538 -177.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 86.2 mt -82.19 -7.1 59.61 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.997 0.919 . . . . 44.34 113.358 -170.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -83.78 -162.61 0.66 Allowed 'General case' 0 N--CA 1.488 1.449 0 CA-C-N 118.142 0.428 . . . . 53.34 110.463 174.186 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 67.1 m-70 -67.33 79.26 0.15 Allowed 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 109.536 -0.542 . . . . 74.35 109.536 177.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 56.9 t-80 -76.04 121.73 23.19 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 121.128 0.489 . . . . 43.44 111.816 -169.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 11.8 m170 -97.35 119.56 36.1 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 108.317 -0.994 . . . . 71.33 108.317 169.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 14.2 t-80 -81.8 94.65 7.08 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 108.452 -0.944 . . . . 60.24 108.452 169.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 23.1 p80 -72.17 159.98 33.2 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 116.021 -0.536 . . . . 73.32 111.25 -175.077 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 53.4 t-80 . . . . . 0 C--O 1.249 1.028 0 N-CA-C 107.464 -1.31 . . . . 51.03 107.464 174.487 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.48 1.046 0 N-CA-C 109.01 -0.737 . . . . 72.31 109.01 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.3 p -87.02 138.78 31.2 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.209 0.603 . . . . 70.04 110.03 -179.336 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -165.1 56.91 0.26 Allowed Glycine 0 C--N 1.337 0.61 0 N-CA-C 110.215 -1.154 . . . . 71.43 110.215 179.116 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.53 ' HE3' ' HA ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -115.33 131.53 56.9 Favored 'General case' 0 C--O 1.239 0.513 0 CA-C-N 114.565 -0.817 . . . . 75.4 110.801 -176.051 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.515 ' HA ' ' HA ' ' A' ' 26' ' ' TYR . 5.7 ttpm? -88.8 105.35 17.67 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 107.241 -1.392 . . . . 71.15 107.241 162.316 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 2.8 p -97.1 143.18 12.9 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 N-CA-C 108.901 -0.777 . . . . 74.45 108.901 -178.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.52 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 49.6 mt-10 -106.97 111.71 24.33 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 108.107 -1.072 . . . . 63.41 108.107 176.109 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 95.7 t -101.17 116.27 44.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 C-N-CA 124.773 1.229 . . . . 74.52 108.952 -175.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -96.64 101.34 12.93 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 107.982 -1.118 . . . . 72.3 107.982 -178.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 84.6 t -93.69 108.11 20.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 N-CA-C 108.434 -0.95 . . . . 54.25 108.434 179.127 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.401 ' HG3' ' HB3' ' A' ' 20' ' ' GLU . 39.4 ttmt -108.07 137.81 45.42 Favored 'General case' 0 C--O 1.224 -0.255 0 C-N-CA 124.748 1.219 . . . . 72.12 107.718 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.484 HD13 HG13 ' A' ' 48' ' ' ILE . 11.9 tt -143.98 136.57 23.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 CA-C-N 118.405 0.548 . . . . 73.35 110.966 176.642 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 28.0 m -101.9 120.48 40.47 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 108.66 -0.867 . . . . 71.12 108.66 173.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.614 ' SG ' HG23 ' A' ' 48' ' ' ILE . 0.9 OUTLIER -157.58 137.96 12.8 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.467 1.107 . . . . 75.32 109.201 -178.99 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.418 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 3.1 t-20 75.89 -46.33 0.55 Allowed 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 126.107 1.763 . . . . 74.52 112.482 179.378 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 155.44 2.02 0.12 Allowed Glycine 0 CA--C 1.522 0.52 0 N-CA-C 110.949 -0.86 . . . . 73.03 110.949 -175.167 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 49.3 mtpt -119.13 162.63 18.32 Favored 'General case' 0 C--N 1.355 0.822 0 C-N-CA 123.976 0.91 . . . . 63.52 109.621 -178.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.0 m -117.74 114.91 24.01 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 108.605 -0.887 . . . . 74.22 108.605 176.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -101.34 100.16 10.62 Favored 'General case' 0 C--O 1.24 0.563 0 N-CA-C 106.536 -1.653 . . . . 73.43 106.536 -175.039 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.401 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 11.9 pt-20 -134.48 145.2 48.59 Favored 'General case' 0 C--O 1.243 0.724 0 C-N-CA 123.361 0.665 . . . . 64.43 110.589 -173.337 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 15.8 ttm180 -167.71 144.71 4.3 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.619 0.768 . . . . 61.43 109.755 -179.144 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 28.1 m -87.6 108.74 19.21 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 123.645 0.778 . . . . 62.22 109.484 175.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -97.81 128.45 44.46 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.778 0.831 . . . . 75.22 109.48 -178.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.52 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 26.8 mp0 -93.87 109.15 20.86 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 108.414 -0.958 . . . . 74.44 108.414 -176.34 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 78.5 mt -120.04 106.73 12.27 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.533 1.133 . . . . 55.21 109.469 -175.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.515 ' HA ' ' HA ' ' A' ' 5' ' ' LYS . 61.9 t80 -95.23 142.0 28.17 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 122.745 0.418 . . . . 74.02 110.312 175.087 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.484 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -148.46 149.16 31.19 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 123.43 0.692 . . . . 72.11 110.243 174.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.0 t -86.13 -21.89 7.41 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.043 0 C-N-CA 124.613 1.165 . . . . 23.32 109.463 175.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.63 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 48.2 mtp180 -131.47 141.77 49.85 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 108.025 -1.102 . . . . 72.24 108.025 171.493 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -64.45 -19.39 65.51 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 122.565 0.346 . . . . 63.15 111.027 174.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 -66.78 -33.36 75.46 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.284 0.634 . . . . 70.01 111.621 170.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.63 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 8.4 mm-40 -68.83 -25.81 64.85 Favored 'General case' 0 N--CA 1.49 1.544 0 CA-C-N 117.871 0.305 . . . . 65.42 110.47 177.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.575 HD22 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -71.37 -25.39 62.35 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 123.426 0.691 . . . . 73.44 111.146 -177.901 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.451 ' HG2' HG23 ' A' ' 80' ' ' ILE . 57.3 mtpt -56.97 -52.18 66.27 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.786 0.834 . . . . 75.14 112.28 -176.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -61.46 -35.43 77.58 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.095 0.558 . . . . 72.34 111.645 179.495 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.575 ' HD2' HD22 ' A' ' 33' ' ' LEU . 65.4 mttm -65.88 -45.33 82.45 Favored 'General case' 0 C--N 1.352 0.7 0 C-N-CA 123.573 0.749 . . . . 74.45 109.988 -178.078 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 71.9 mt -58.39 -47.7 83.01 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 124.518 1.136 . . . . 75.5 110.843 176.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -58.41 -43.02 88.47 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 123.903 0.752 . . . . 63.21 111.346 178.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -70.85 -41.38 71.54 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.585 0.754 . . . . 60.42 112.52 -178.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.455 HG23 ' O ' ' A' ' 36' ' ' LYS . 94.5 t -64.66 -42.15 94.23 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 C-N-CA 123.234 0.614 . . . . 72.23 110.46 175.591 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.637 HD21 HD11 ' A' ' 60' ' ' ILE . 35.7 mt -64.74 -48.95 72.69 Favored 'General case' 0 C--O 1.212 -0.874 0 CA-C-N 115.481 -0.781 . . . . 64.23 110.135 179.129 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -63.04 -34.65 78.04 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.18 0.592 . . . . 50.44 111.678 177.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.689 ' HG3' ' H ' ' A' ' 120' ' ' HIS . 4.3 tm-20 -68.86 -40.19 79.47 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.134 0.574 . . . . 63.43 110.079 178.321 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.41 ' HA ' ' CZ ' ' A' ' 44' ' ' ARG . 0.0 OUTLIER -76.14 -30.14 58.05 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 123.729 0.812 . . . . 74.21 111.337 179.166 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.459 ' SD ' HD12 ' A' ' 12' ' ' ILE . 87.7 mmm -91.1 -15.8 28.86 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 124.272 1.029 . . . . 74.13 112.35 -175.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.588 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 14.4 t70 -68.24 -50.77 28.1 Favored Pre-proline 0 CA--C 1.555 1.172 0 CA-C-O 118.247 -0.882 . . . . 73.22 112.038 -175.732 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.49 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 38.8 Cg_endo -63.08 -23.47 73.54 Favored 'Trans proline' 0 C--N 1.391 2.786 0 C-N-CA 121.812 1.675 . . . . 53.24 111.837 176.339 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.614 HG23 ' SG ' ' A' ' 14' ' ' CYS . 49.1 mm -71.12 -30.34 40.38 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 C-N-CA 124.788 1.235 . . . . 55.14 111.149 -177.244 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.588 ' HE2' ' HA ' ' A' ' 46' ' ' ASP . 45.7 mtmt -73.31 -36.99 66.33 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 122.87 0.468 . . . . 75.13 109.994 176.126 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 5.5 tmmm? -67.03 -31.48 72.05 Favored 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 123.398 0.679 . . . . 73.33 110.476 173.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 81.8 mt -72.6 -36.45 68.11 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 122.671 0.388 . . . . 64.51 110.021 173.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.57 40.51 18.37 Favored Glycine 0 C--N 1.345 1.083 0 CA-C-N 115.672 -0.695 . . . . 74.04 113.421 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.418 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 94.8 m -77.21 109.77 11.36 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 109.493 -0.558 . . . . 60.44 109.493 174.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -63.53 -51.46 65.37 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.978 0.911 . . . . 61.01 110.697 -174.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 68.5 ttt180 -111.36 133.5 53.63 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 109.313 -0.625 . . . . 74.42 109.313 174.007 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 31.5 m -126.34 146.11 32.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 124.002 0.921 . . . . 73.24 109.455 178.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 24.7 ttm180 -110.0 104.8 13.75 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 108.663 -0.866 . . . . 73.1 108.663 173.064 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.418 HD11 ' SD ' ' A' ' 45' ' ' MET . 38.0 mt -101.34 105.91 18.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 N-CA-C 108.697 -0.853 . . . . 73.23 108.697 -179.248 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 11.7 t -103.85 104.7 14.74 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 108.928 -0.767 . . . . 61.24 108.928 178.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.637 HD11 HD21 ' A' ' 41' ' ' LEU . 73.9 mt -96.51 112.43 28.63 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 124.266 1.026 . . . . 75.32 108.921 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 70.4 ttt180 -101.08 120.08 39.68 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 108.019 -1.104 . . . . 73.43 108.019 174.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 4.1 p -95.21 144.67 9.46 Favored 'Isoleucine or valine' 0 C--O 1.243 0.729 0 N-CA-C 108.433 -0.951 . . . . 74.14 108.433 -178.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.408 ' HB3' ' H ' ' A' ' 7' ' ' GLU . 60.0 tttm -92.05 144.17 25.72 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 109.137 -0.69 . . . . 70.31 109.137 177.338 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -117.32 154.87 30.51 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 124.162 0.985 . . . . 75.11 109.112 -167.725 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 36.7 t -64.54 -56.0 16.88 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 124.311 1.007 . . . . 74.12 111.598 -175.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -149.26 159.63 44.09 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 115.474 -0.784 . . . . 74.51 109.867 -167.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.73 -20.26 65.93 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 114.091 1.145 . . . . 61.43 114.091 -174.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -88.05 -31.05 19.48 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.175 0.59 . . . . 72.13 110.247 170.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 46.0 mm-40 -79.72 -11.25 59.85 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 114.913 -1.04 . . . . 74.55 113.298 -177.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -38.5 -51.45 1.59 Allowed 'General case' 0 N--CA 1.5 2.064 0 C-N-CA 124.381 1.072 . . . . 62.5 112.561 -179.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -80.93 -29.63 35.46 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 114.215 -1.357 . . . . 74.1 111.814 -172.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 56.7 tptt -74.46 -35.82 63.33 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.679 0.792 . . . . 72.41 110.458 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -84.94 -29.11 25.39 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.311 0.644 . . . . 72.04 110.157 -179.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.26 -47.67 75.9 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 123.897 0.748 . . . . 53.3 110.602 173.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp -73.79 -30.28 62.66 Favored 'General case' 0 CA--C 1.551 1.005 0 CA-C-N 116.093 -0.503 . . . . 64.33 111.395 179.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 4.6 ttmp? -57.43 -52.24 66.16 Favored 'General case' 0 N--CA 1.487 1.412 0 CA-C-O 121.438 0.637 . . . . 74.01 109.783 168.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -70.8 -19.2 62.71 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-N 114.742 -1.117 . . . . 74.32 111.812 179.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.439 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -61.61 -43.72 98.33 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 117.942 0.337 . . . . 60.23 110.665 174.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.83 -44.16 77.86 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.222 0.609 . . . . 60.12 111.569 174.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.451 HG23 ' HG2' ' A' ' 34' ' ' LYS . 35.2 mm -61.68 -46.71 95.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 C-N-CA 124.172 0.989 . . . . 74.43 111.476 -178.048 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.567 HD13 HG11 ' A' ' 102' ' ' VAL . 51.0 mt -76.53 -30.86 57.32 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.835 0.854 . . . . 74.42 111.118 -178.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 61.4 t30 -60.06 -39.27 85.43 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.207 0.603 . . . . 72.21 109.965 176.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -67.35 -43.28 81.92 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 115.104 -0.953 . . . . 60.12 111.336 175.316 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.419 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 42.8 t -64.36 -50.39 76.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 123.676 0.79 . . . . 71.31 110.676 -174.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.528 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 20.0 m-85 -66.22 -27.03 67.67 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.611 0.764 . . . . 71.25 111.239 -179.439 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.9 -35.58 78.73 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.324 0.649 . . . . 61.52 111.199 172.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -84.79 -1.99 57.09 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.73 0.812 . . . . 72.2 110.606 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 96.3 mt -107.21 -29.48 9.31 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.124 0.97 . . . . 71.44 110.415 176.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 103.44 9.28 38.9 Favored Glycine 0 C--N 1.351 1.389 0 C-N-CA 123.179 0.419 . . . . 61.34 114.121 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.528 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 27.0 m-85 -83.49 135.58 34.61 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.38 0.672 . . . . 74.22 110.052 174.777 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.416 ' O ' HG23 ' A' ' 95' ' ' VAL . 15.5 m120 -91.71 168.31 11.57 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 123.814 0.846 . . . . 74.25 110.705 -177.172 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -59.43 -30.65 68.64 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 123.982 0.913 . . . . 63.32 111.254 175.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 54.8 p -65.84 -39.56 90.91 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.175 0.99 . . . . 61.52 111.103 177.209 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -72.17 -22.9 61.22 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.558 0.743 . . . . 74.24 111.241 178.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.416 HG23 ' O ' ' A' ' 91' ' ' ASN . 88.7 t -96.36 128.38 47.61 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 C-N-CA 124.193 0.997 . . . . 62.24 110.203 -175.442 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 9.0 t -128.36 141.09 51.53 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.08 0.552 . . . . 62.41 109.885 170.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.439 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 59.9 m95 -111.86 136.76 50.74 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.904 0.882 . . . . 64.44 109.847 178.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -143.11 87.4 1.97 Allowed 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.494 1.118 . . . . 72.14 108.076 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 72.45 -83.65 0.55 Allowed Glycine 0 C--N 1.348 1.24 0 CA-C-N 115.28 -0.873 . . . . 73.24 113.613 176.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 29.4 p-10 -126.66 -6.4 6.3 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.145 0.978 . . . . 72.33 111.745 -175.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 25.8 m -116.18 133.08 56.42 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.641 0.776 . . . . 74.32 109.202 -176.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.567 HG11 HD13 ' A' ' 81' ' ' LEU . 4.8 p -115.39 123.05 70.52 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 C-N-CA 124.057 0.943 . . . . 74.51 108.947 176.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 61.0 m -107.08 114.83 29.14 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 108.633 -0.877 . . . . 44.3 108.633 176.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 49.1 t -109.11 110.73 33.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 C-N-CA 123.797 0.839 . . . . 43.13 108.786 175.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -95.56 111.95 23.77 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 107.971 -1.122 . . . . 52.32 107.971 173.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -118.72 177.73 16.5 Favored Glycine 0 C--O 1.24 0.526 0 O-C-N 123.801 0.688 . . . . 43.12 112.24 -176.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -122.86 143.49 49.84 Favored 'General case' 0 C--O 1.243 0.721 0 C-N-CA 123.804 0.842 . . . . 75.42 108.946 177.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.511 HD23 ' HA ' ' A' ' 49' ' ' LYS . 10.3 mp -78.46 169.73 17.79 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 115.5 -0.773 . . . . 74.41 110.668 176.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 61.8 26.74 16.26 Favored 'General case' 0 CA--C 1.558 1.281 0 O-C-N 124.294 0.996 . . . . 52.55 110.572 178.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -59.65 -73.94 0.42 Allowed Glycine 0 C--N 1.351 1.411 0 CA-C-N 115.562 -0.745 . . . . 74.4 112.532 -178.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 92.1 t -142.15 -61.95 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 N-CA-C 106.101 -1.815 . . . . 72.12 106.101 168.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 177.23 136.61 0.07 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 126.381 1.872 . . . . 70.21 107.181 176.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 52.3 mt -72.79 -66.47 0.66 Allowed 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 106.733 -1.581 . . . . 72.41 106.733 170.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -158.8 -176.7 6.03 Favored 'General case' 0 CA--C 1.55 0.965 0 CA-C-N 113.58 -1.645 . . . . 62.13 106.923 162.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 64.5 m80 -68.97 158.24 35.1 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 122.709 0.404 . . . . 73.45 110.54 176.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 47.5 t60 -62.61 119.29 8.93 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.367 0.667 . . . . 74.14 110.837 179.395 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 17.2 t-80 -109.55 139.41 44.59 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 106.076 -1.824 . . . . 44.11 106.076 161.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 58.1 t60 -55.12 -51.65 65.76 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.913 0.885 . . . . 74.22 112.588 -169.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 45.4 t-80 -159.84 161.61 34.52 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 115.352 -0.84 . . . . 74.01 109.383 -176.002 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . 0.689 ' H ' ' HG3' ' A' ' 43' ' ' GLU . 41.4 t-80 . . . . . 0 C--O 1.248 0.98 0 C-N-CA 123.761 0.824 . . . . 74.13 108.872 173.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mpt? . . . . . 0 N--CA 1.482 1.15 0 CA-C-O 120.904 0.383 . . . . 70.33 110.714 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.8 m -75.3 166.41 23.66 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 123.834 0.854 . . . . 70.14 109.861 170.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 69.89 54.38 12.15 Favored Glycine 0 C--N 1.346 1.123 0 N-CA-C 110.784 -0.926 . . . . 53.45 110.784 -173.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.2 tptp -105.73 137.38 43.69 Favored 'General case' 0 C--O 1.24 0.602 0 C-N-CA 123.567 0.747 . . . . 74.32 110.588 -171.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -86.18 121.9 29.42 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 108.455 -0.943 . . . . 43.41 108.455 169.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.461 HG23 HG23 ' A' ' 62' ' ' VAL . 0.9 OUTLIER -113.17 137.62 45.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 C-N-CA 124.662 1.185 . . . . 74.11 108.108 177.795 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -104.25 112.11 25.0 Favored 'General case' 0 C--O 1.242 0.678 0 N-CA-C 108.181 -1.044 . . . . 75.31 108.181 171.295 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 62.3 t -96.16 106.08 17.88 Favored 'Isoleucine or valine' 0 C--N 1.345 0.373 0 C-N-CA 125.141 1.376 . . . . 72.43 107.98 -176.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -96.81 99.81 11.37 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 108.063 -1.088 . . . . 72.33 108.063 -172.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 93.8 t -99.15 112.0 30.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 124.115 0.966 . . . . 70.21 109.726 -174.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.486 ' HB3' ' HB3' ' A' ' 59' ' ' SER . 26.6 ttpp -118.56 103.85 10.11 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 107.874 -1.158 . . . . 72.14 107.874 177.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.441 HD13 HG13 ' A' ' 48' ' ' ILE . 14.6 tt -113.94 129.84 69.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 123.441 0.696 . . . . 74.24 110.319 -173.38 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 84.8 m -97.82 117.8 32.94 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 109.394 -0.595 . . . . 71.53 109.394 174.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.744 ' SG ' HG23 ' A' ' 48' ' ' ILE . 49.1 t -129.48 118.18 21.69 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.332 1.053 . . . . 52.12 109.171 -178.581 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.569 ' HB2' ' SG ' ' A' ' 53' ' ' CYS . 6.4 t-20 74.3 -1.28 3.12 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 125.341 1.456 . . . . 74.45 112.263 170.338 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 123.41 -6.02 9.27 Favored Glycine 0 C--N 1.351 1.368 0 CA-C-O 119.874 -0.404 . . . . 71.05 113.415 -178.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -108.5 147.38 31.79 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.398 0.679 . . . . 64.41 110.242 179.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 40.2 m -112.31 115.45 28.77 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.717 0.807 . . . . 72.1 110.057 -176.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -110.79 112.74 24.82 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.446 1.098 . . . . 74.24 109.066 -175.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -112.93 140.51 47.68 Favored 'General case' 0 N--CA 1.485 1.286 0 CA-C-N 118.329 0.513 . . . . 63.41 110.537 -179.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 17.3 tpt180 -161.23 120.46 2.54 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.357 0.663 . . . . 74.42 110.059 -175.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 61.8 m -89.27 116.32 27.4 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.551 0.74 . . . . 74.33 110.013 174.201 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -98.27 136.82 37.91 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.124 0.97 . . . . 71.14 108.764 176.138 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 25.6 mp0 -101.78 111.71 24.06 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 108.823 -0.806 . . . . 73.32 108.823 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.428 ' HB2' HG13 ' A' ' 6' ' ' VAL . 89.9 mt -112.52 161.09 17.15 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.061 0.944 . . . . 75.52 109.893 -179.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 86.1 t80 -151.95 129.38 11.36 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 108.752 -0.833 . . . . 72.41 108.752 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.546 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -150.89 146.21 26.15 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 122.611 0.364 . . . . 64.03 111.171 -179.311 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 48.6 t -65.66 -52.41 50.89 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 O-C-N 124.506 1.129 . . . . 74.15 109.802 175.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 -113.56 160.99 17.94 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 115.371 -0.832 . . . . 70.34 110.167 -177.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.475 ' HB2' HG13 ' A' ' 80' ' ' ILE . 21.6 p-10 -69.59 -28.42 65.94 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.489 0.715 . . . . 71.04 109.969 173.518 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -55.09 -39.44 69.3 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.398 1.079 . . . . 62.33 111.387 170.001 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.546 ' HB2' ' HB1' ' A' ' 27' ' ' ALA . 19.5 mm-40 -77.48 -20.86 53.71 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.271 -0.877 . . . . 73.01 111.677 -177.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.01 -27.86 64.0 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 122.682 0.393 . . . . 70.14 110.556 178.214 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 20.7 mtpp -54.14 -60.25 3.58 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.225 1.01 . . . . 64.44 112.823 -177.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -53.22 -33.96 55.1 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 124.392 1.077 . . . . 50.32 112.132 178.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 52.4 mttm -77.93 -37.43 47.77 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.643 0.777 . . . . 62.22 110.819 -175.182 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.558 HD13 HD23 ' A' ' 81' ' ' LEU . 93.7 mt -65.19 -40.6 94.44 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.445 0.698 . . . . 72.31 111.202 172.868 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 58.1 mtpt -59.69 -40.83 89.16 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.203 0.601 . . . . 74.45 110.637 174.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt -65.91 -53.05 44.55 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 123.562 0.539 . . . . 55.21 111.42 175.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 20.8 t -53.49 -45.15 58.0 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 C-N-CA 124.14 0.976 . . . . 63.44 112.134 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.573 HD21 HD11 ' A' ' 60' ' ' ILE . 97.2 mt -72.94 -51.28 19.06 Favored 'General case' 0 CA--C 1.54 0.577 0 O-C-N 123.58 0.55 . . . . 70.22 111.3 -178.479 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -67.1 -40.39 86.91 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 122.924 0.49 . . . . 73.22 112.006 -174.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -62.05 -43.27 99.19 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.576 0.35 . . . . 61.32 110.079 174.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.1 tpp180 -62.12 -41.99 98.78 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.531 0.732 . . . . 73.23 111.078 176.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.509 ' SD ' HD11 ' A' ' 58' ' ' ILE . 83.2 mtp -94.41 6.91 47.31 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 112.822 0.675 . . . . 74.2 112.822 -169.74 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -75.84 -48.82 3.62 Favored Pre-proline 0 CA--C 1.56 1.363 0 CA-C-O 118.741 -0.647 . . . . 43.33 110.444 168.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.464 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 31.4 Cg_exo -51.97 -37.76 67.99 Favored 'Trans proline' 0 C--N 1.396 3.057 0 C-N-CA 122.146 1.897 . . . . 72.21 112.72 166.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.744 HG23 ' SG ' ' A' ' 14' ' ' CYS . 50.6 mm -66.64 -30.47 49.82 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.35 0 C-N-CA 124.286 1.035 . . . . 74.14 111.528 -173.015 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -66.91 -45.28 78.43 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 123.399 0.679 . . . . 62.44 110.191 173.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.4 tmmm? -61.75 -34.74 76.39 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 114.695 -1.138 . . . . 65.14 111.193 176.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.539 HD12 HD13 ' A' ' 48' ' ' ILE . 85.3 mt -72.39 -29.03 63.37 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.192 0.597 . . . . 75.05 110.811 176.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 68.93 83.23 0.17 Allowed Glycine 0 C--N 1.353 1.498 0 O-C-N 123.976 0.798 . . . . 43.14 112.188 174.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.569 ' SG ' ' HB2' ' A' ' 15' ' ' ASN . 89.5 m -123.98 134.51 53.46 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.272 0.629 . . . . 44.31 110.701 -174.209 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -63.66 -65.5 0.67 Allowed 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.554 0.741 . . . . 72.11 110.156 177.075 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 31.9 ttt180 -127.99 126.94 42.33 Favored 'General case' 0 C--O 1.241 0.616 0 C-N-CA 124.019 0.928 . . . . 70.52 108.577 -176.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 34.0 m -115.91 140.54 37.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 C-N-CA 123.155 0.582 . . . . 42.23 109.664 179.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 24.4 ttm180 -105.96 106.89 17.61 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 108.417 -0.957 . . . . 72.02 108.417 177.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.509 HD11 ' SD ' ' A' ' 45' ' ' MET . 50.9 mt -93.9 114.0 29.7 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 N-CA-C 107.993 -1.114 . . . . 60.55 107.993 179.498 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.486 ' HB3' ' HB3' ' A' ' 11' ' ' LYS . 37.2 t -102.86 102.27 12.37 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.21 -1.033 . . . . 62.11 108.21 -177.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.573 HD11 HD21 ' A' ' 41' ' ' LEU . 78.9 mt -104.85 115.83 47.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 123.409 0.684 . . . . 73.15 109.555 -177.751 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -109.77 129.4 55.63 Favored 'General case' 0 C--O 1.238 0.471 0 N-CA-C 108.518 -0.919 . . . . 74.31 108.518 171.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.461 HG23 HG23 ' A' ' 6' ' ' VAL . 12.4 p -94.97 148.32 5.13 Favored 'Isoleucine or valine' 0 C--O 1.246 0.899 0 N-CA-C 108.293 -1.002 . . . . 63.11 108.293 177.106 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 24.2 ttmm -80.49 137.5 36.46 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 108.813 -0.81 . . . . 73.14 108.813 172.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 31.8 m170 -85.38 128.97 34.9 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.069 0.948 . . . . 74.42 110.446 -173.532 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 28.0 m -66.23 -65.79 0.63 Allowed 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.713 0.805 . . . . 71.55 111.061 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.458 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 29.6 t70 -162.53 151.98 15.66 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.758 0.823 . . . . 74.01 108.887 -178.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.78 -32.33 63.39 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 124.316 1.047 . . . . 42.3 113.282 -174.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.2 -41.9 89.53 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 123.054 0.541 . . . . 61.33 110.658 174.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -70.71 -50.03 40.73 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-N 115.157 -0.929 . . . . 74.22 111.592 -177.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.458 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 58.0 mt-10 -43.53 -34.56 1.41 Allowed 'General case' 0 N--CA 1.501 2.081 0 C-N-CA 126.026 1.73 . . . . 75.21 115.431 -163.503 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -65.44 -51.27 61.38 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.773 0.829 . . . . 73.25 110.77 -178.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -81.93 -29.93 32.04 Favored 'General case' 0 CA--C 1.552 1.054 0 CA-C-N 115.103 -0.953 . . . . 72.4 111.053 177.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -68.84 -39.08 80.13 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 124.509 1.124 . . . . 73.43 110.3 -173.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.08 -49.69 69.06 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 115.517 -0.765 . . . . 72.31 111.098 177.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -59.97 -40.57 89.51 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.424 1.09 . . . . 72.43 111.503 177.248 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 68.6 tttt -64.6 -50.59 66.6 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.26 1.424 . . . . 74.04 110.543 -179.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -75.28 -23.69 57.44 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 115.812 -0.631 . . . . 72.05 110.266 -177.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.61 -33.41 72.62 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.584 0.753 . . . . 51.34 110.784 174.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.8 -40.93 83.86 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.422 0.689 . . . . 63.11 110.829 173.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.475 HG13 ' HB2' ' A' ' 30' ' ' ASP . 46.2 mm -67.86 -41.82 85.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 124.023 0.929 . . . . 71.33 110.794 178.614 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.558 HD23 HD13 ' A' ' 37' ' ' LEU . 42.3 mt -63.96 -47.74 79.25 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.54 0.736 . . . . 64.23 109.533 176.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -55.84 -42.95 76.55 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 124.669 1.187 . . . . 53.3 111.337 -177.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.449 ' O ' ' HG3' ' A' ' 87' ' ' GLU . 43.4 mmtm -67.2 -41.59 85.56 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 115.562 -0.745 . . . . 73.32 111.33 179.291 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.444 HG21 ' HB2' ' A' ' 37' ' ' LEU . 54.4 t -64.68 -40.72 90.02 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.119 0 C-N-CA 123.378 0.671 . . . . 73.4 110.301 -178.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.534 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 19.6 m-85 -64.95 -39.99 94.34 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.265 -0.88 . . . . 75.33 110.53 177.51 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -68.11 -24.33 65.02 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.199 0.6 . . . . 65.52 111.95 176.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.449 ' HG3' ' O ' ' A' ' 83' ' ' LYS . 45.9 mt-10 -80.95 -20.94 40.88 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.651 0.78 . . . . 73.42 111.018 178.08 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 96.1 mt -106.68 -22.71 12.66 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 122.968 0.507 . . . . 63.42 110.923 -173.571 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 103.54 39.97 2.47 Favored Glycine 0 C--N 1.351 1.403 0 C-N-CA 123.153 0.406 . . . . 62.1 114.054 177.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.534 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 10.1 m-85 -112.76 134.6 54.2 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 107.432 -1.322 . . . . 74.21 107.432 169.625 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 -83.61 158.37 21.93 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.447 0.699 . . . . 62.32 110.092 -175.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.79 -39.66 78.04 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 124.491 1.117 . . . . 73.4 111.539 177.509 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 22.6 t -60.57 -35.64 76.56 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 124.452 1.101 . . . . 73.54 111.761 178.237 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -65.3 -26.41 68.06 Favored 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 124.222 1.009 . . . . 74.25 111.977 178.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.508 HG22 HG13 ' A' ' 104' ' ' VAL . 47.1 t -90.91 117.88 35.04 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 124.219 1.007 . . . . 62.12 109.174 -177.51 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 20.7 m -134.65 106.78 7.13 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.598 0.759 . . . . 52.04 109.958 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 69.3 m95 -68.97 109.95 4.2 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 122.731 0.413 . . . . 70.24 110.167 176.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -107.73 96.92 6.73 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 107.993 -1.114 . . . . 74.0 107.993 177.532 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 68.37 -120.32 11.51 Favored Glycine 0 C--N 1.343 0.927 0 O-C-N 123.675 0.609 . . . . 52.12 112.415 -178.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -79.67 -32.55 41.5 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 124.663 1.185 . . . . 73.42 110.335 -178.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 20.2 m -105.84 148.8 27.14 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.946 0.899 . . . . 71.45 110.129 -169.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.9 p -104.06 136.49 37.03 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 CA-C-O 121.274 0.559 . . . . 62.45 110.012 177.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 27.6 m -103.67 100.02 9.83 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.467 1.507 . . . . 70.53 108.198 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.508 HG13 HG22 ' A' ' 95' ' ' VAL . 42.0 t -108.71 109.6 28.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 N-CA-C 108.23 -1.026 . . . . 62.43 108.23 -179.612 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -106.49 109.58 21.54 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 109.855 -0.424 . . . . 73.41 109.855 -176.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -115.12 137.41 13.91 Favored Glycine 0 C--N 1.333 0.373 0 N-CA-C 110.552 -1.019 . . . . 70.54 110.552 179.163 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -87.83 139.76 30.2 Favored 'General case' 0 C--O 1.242 0.674 0 N-CA-C 108.823 -0.806 . . . . 74.21 108.823 173.028 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.72 HD11 HG22 ' A' ' 48' ' ' ILE . 36.0 mt -73.54 158.16 35.38 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-O 121.448 0.642 . . . . 72.13 111.977 -177.487 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -63.14 -35.22 79.57 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 114.246 -1.343 . . . . 71.31 110.01 164.156 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 67.87 -171.5 34.68 Favored Glycine 0 C--N 1.357 1.746 0 CA-C-N 114.96 -1.018 . . . . 74.34 112.672 -179.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 47.5 t 73.16 -58.14 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 C-N-CA 126.025 1.73 . . . . 74.23 112.466 175.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -54.3 103.62 0.09 Allowed 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 126.345 1.858 . . . . 74.13 112.427 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 78.4 mt -112.63 149.32 32.99 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.762 1.225 . . . . 74.12 108.498 173.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -70.89 148.26 47.95 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 112.183 0.438 . . . . 72.54 112.183 -173.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 9.9 t-160 -103.89 18.65 21.53 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 108.95 -0.759 . . . . 74.34 108.95 167.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -85.19 151.71 23.89 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.428 0.691 . . . . 63.34 110.032 175.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 78.2 t60 -148.84 34.65 0.76 Allowed 'General case' 0 N--CA 1.48 1.068 0 CA-C-O 122.22 1.01 . . . . 63.42 108.313 175.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 18.4 t60 -69.03 -20.64 64.13 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 114.958 -1.019 . . . . 72.44 110.331 178.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 63.2 t-80 -62.22 115.71 4.38 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.984 0.914 . . . . 75.0 110.456 173.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 7.7 m170 . . . . . 0 C--O 1.246 0.916 0 C-N-CA 124.596 1.158 . . . . 62.54 108.899 174.686 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 47.2 tpp . . . . . 0 N--CA 1.478 0.943 0 N-CA-C 110.414 -0.217 . . . . 71.35 110.414 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.5 m -73.98 83.94 1.75 Allowed 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 108.931 -0.766 . . . . 62.12 108.931 168.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 158.07 59.69 0.01 OUTLIER Glycine 0 CA--C 1.507 -0.425 0 N-CA-C 109.011 -1.636 . . . . 51.4 109.011 -173.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -87.79 124.27 33.44 Favored 'General case' 0 C--O 1.239 0.523 0 CA-C-N 114.923 -0.638 . . . . 75.31 110.788 -174.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 25.3 ttpt -88.49 98.61 11.73 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 107.062 -1.459 . . . . 51.34 107.062 163.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.546 HG23 HG23 ' A' ' 62' ' ' VAL . 0.2 OUTLIER -99.23 126.62 52.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 107.54 -1.282 . . . . 73.44 107.54 -179.745 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -102.25 113.8 27.4 Favored 'General case' 0 C--O 1.24 0.554 0 N-CA-C 108.29 -1.004 . . . . 72.34 108.29 179.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 64.0 t -100.67 109.18 24.68 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 C-N-CA 124.933 1.293 . . . . 74.01 108.658 -172.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.433 ' O ' ' HA ' ' A' ' 60' ' ' ILE . 41.7 mt-30 -96.45 98.17 10.03 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 107.7 -1.222 . . . . 44.2 107.7 -176.113 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 48.6 t -94.07 104.63 15.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 N-CA-C 108.525 -0.917 . . . . 70.5 108.525 -175.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.419 ' HE3' HG21 ' A' ' 18' ' ' THR . 1.7 tmtp? -111.98 102.82 11.03 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 107.573 -1.269 . . . . 62.24 107.573 -176.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.409 ' HA ' ' O ' ' A' ' 57' ' ' ARG . 8.7 tt -119.47 124.34 72.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 122.902 0.481 . . . . 75.23 110.451 -172.047 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 39.0 m -91.5 121.71 33.44 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.269 0.628 . . . . 51.51 109.493 178.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.662 ' SG ' HG23 ' A' ' 48' ' ' ILE . 1.3 t -158.43 143.13 16.13 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.709 1.204 . . . . 53.52 109.878 -177.543 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.401 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 63.3 t30 62.44 25.32 15.1 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 124.182 0.993 . . . . 71.02 111.526 172.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 85.86 -8.19 73.95 Favored Glycine 0 C--N 1.345 1.054 0 CA-C-N 115.766 -0.652 . . . . 73.24 113.498 179.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -108.66 169.51 8.61 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.677 0.791 . . . . 75.14 110.738 -179.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.419 HG21 ' HE3' ' A' ' 11' ' ' LYS . 87.0 m -115.03 123.96 50.4 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 114.905 -1.043 . . . . 62.14 108.771 171.298 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -110.28 100.77 9.59 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 107.718 -1.216 . . . . 50.33 107.718 178.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.7 pp20? -106.27 146.39 30.42 Favored 'General case' 0 C--O 1.242 0.704 0 N-CA-C 108.982 -0.747 . . . . 72.1 108.982 177.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.1 tpt180 -157.21 124.64 5.27 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 123.305 0.378 . . . . 53.14 110.204 174.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 44.0 m -89.17 109.57 20.42 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 108.962 -0.755 . . . . 75.45 108.962 173.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -98.01 135.79 39.21 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 108.814 -0.81 . . . . 54.42 108.814 178.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -97.12 108.69 21.47 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 107.732 -1.21 . . . . 74.04 107.732 175.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 94.7 mt -115.24 137.83 51.6 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 108.233 -1.025 . . . . 52.34 108.233 -178.291 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -132.18 132.55 43.28 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 109.334 -0.617 . . . . 73.21 109.334 -175.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -156.27 149.86 24.76 Favored 'General case' 0 C--O 1.239 0.509 0 C-N-CA 123.323 0.649 . . . . 61.43 109.626 173.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 51.7 t -63.41 -37.69 80.2 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 C-N-CA 124.215 1.006 . . . . 71.23 109.869 174.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 53.4 mtt180 -130.12 145.31 51.69 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.442 0.697 . . . . 74.32 110.848 175.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 35.2 p-10 -69.53 -23.26 63.56 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.063 0.945 . . . . 73.0 111.333 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -59.26 -37.75 78.4 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.224 0.61 . . . . 73.33 110.731 170.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -81.94 -22.24 36.81 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.486 0.715 . . . . 75.44 111.348 179.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.576 HD22 ' HD2' ' A' ' 36' ' ' LYS . 0.7 OUTLIER -70.4 -22.55 62.73 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.411 1.084 . . . . 75.44 110.265 178.189 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.568 ' HG2' HG23 ' A' ' 80' ' ' ILE . 50.1 mtpt -52.79 -53.59 46.13 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 124.004 0.922 . . . . 64.41 113.168 -178.495 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -61.1 -30.14 70.18 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 123.41 0.444 . . . . 63.24 111.717 -177.017 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.576 ' HD2' HD22 ' A' ' 33' ' ' LEU . 58.0 mttm -67.58 -45.35 75.78 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 123.503 0.502 . . . . 51.32 110.355 174.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.438 HD13 HD23 ' A' ' 81' ' ' LEU . 95.8 mt -58.63 -44.77 90.12 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.735 0.814 . . . . 74.12 111.439 177.124 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.525 ' HG2' HG13 ' A' ' 84' ' ' VAL . 51.2 mtpt -61.25 -47.45 86.0 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 123.764 0.665 . . . . 75.41 111.044 -178.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -62.42 -52.46 63.48 Favored 'General case' 0 N--CA 1.476 0.83 0 O-C-N 123.607 0.567 . . . . 64.44 110.982 178.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 22.4 t -58.0 -42.18 82.08 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 C-N-CA 124.894 1.278 . . . . 72.0 112.52 -178.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.454 HD21 HD11 ' A' ' 60' ' ' ILE . 39.4 mt -70.35 -37.75 74.7 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.341 0.657 . . . . 61.32 110.965 179.688 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -68.06 -35.76 78.73 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 119.426 -0.321 . . . . 55.34 111.473 175.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -72.93 -45.29 58.93 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.373 0.669 . . . . 73.34 110.818 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 6.7 tpm_? -60.25 -41.39 93.11 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.86 0.864 . . . . 73.24 110.235 176.022 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.436 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 64.4 mtp -92.67 2.81 56.52 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 115.64 -0.709 . . . . 61.41 112.821 -178.222 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -65.47 -49.57 62.11 Favored Pre-proline 0 CA--C 1.553 1.07 0 CA-C-O 118.603 -0.713 . . . . 71.53 111.404 178.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.49 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 37.9 Cg_endo -63.69 -27.42 68.66 Favored 'Trans proline' 0 C--N 1.389 2.699 0 C-N-CA 121.391 1.394 . . . . 55.22 111.756 172.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.662 HG23 ' SG ' ' A' ' 14' ' ' CYS . 45.0 mm -74.19 -34.06 36.7 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.02 0 C-N-CA 124.149 0.979 . . . . 72.43 110.729 -173.534 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.638 ' HA ' HD21 ' A' ' 108' ' ' LEU . 93.0 mttt -73.9 -31.36 63.07 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.276 0.63 . . . . 73.5 110.086 176.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.8 tmmm? -76.14 -29.06 57.66 Favored 'General case' 0 CA--C 1.548 0.903 0 CA-C-N 115.108 -0.951 . . . . 73.31 109.654 175.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 92.1 mt -71.89 -32.28 67.26 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 109.08 -0.711 . . . . 54.22 109.08 173.805 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 75.38 40.32 33.57 Favored Glycine 0 C--N 1.349 1.253 0 CA-C-N 115.834 -0.621 . . . . 72.42 112.369 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.401 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 68.5 m -71.44 97.11 1.58 Allowed 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 109.415 -0.587 . . . . 73.34 109.415 174.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -50.9 -39.7 55.03 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 125.792 1.637 . . . . 73.41 112.539 -169.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 9.5 ttp180 -134.21 130.76 37.68 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 107.796 -1.187 . . . . 53.21 107.796 179.154 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 23.0 m -124.86 145.19 32.55 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 C-N-CA 122.897 0.479 . . . . 71.44 110.669 -178.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.512 ' HG3' HG23 ' A' ' 103' ' ' THR . 21.1 ttt180 -104.39 108.55 20.02 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 108.237 -1.024 . . . . 74.43 108.237 170.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 37.7 mt -101.62 104.25 16.08 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 N-CA-C 108.253 -1.017 . . . . 74.22 108.253 176.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 70.3 m -101.91 103.48 14.15 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 107.839 -1.171 . . . . 75.12 107.839 177.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.454 HD11 HD21 ' A' ' 41' ' ' LEU . 61.5 mt -98.93 130.25 48.09 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 123.258 0.623 . . . . 70.23 109.83 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 27.8 ttm-85 -115.92 120.04 37.89 Favored 'General case' 0 C--O 1.239 0.506 0 N-CA-C 107.726 -1.212 . . . . 70.01 107.726 174.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.546 HG23 HG23 ' A' ' 6' ' ' VAL . 7.6 p -94.73 139.09 19.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 N-CA-C 108.636 -0.875 . . . . 61.52 108.636 -178.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -81.08 121.56 26.24 Favored 'General case' 0 C--O 1.24 0.596 0 N-CA-C 108.904 -0.776 . . . . 72.13 108.904 -177.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -95.19 149.99 20.7 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.626 0.77 . . . . 71.02 110.35 -176.363 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 23.5 m -77.32 -44.41 29.66 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.2 1.0 . . . . 71.23 111.455 -178.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -156.39 158.0 36.59 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.189 0.596 . . . . 72.43 110.473 -174.08 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.52 -44.15 89.44 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 124.599 1.16 . . . . 74.33 112.984 -176.353 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -75.6 -22.26 57.07 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 122.9 0.48 . . . . 72.13 110.892 178.085 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -84.6 -17.38 38.92 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 118.894 -0.574 . . . . 74.24 112.034 178.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -57.35 -44.01 83.94 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.096 0.558 . . . . 63.43 111.785 -179.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.75 -33.98 76.28 Favored 'General case' 0 N--CA 1.479 1.018 0 O-C-N 124.001 0.813 . . . . 73.23 111.17 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -70.55 -59.42 2.85 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 109.524 -0.547 . . . . 51.31 109.524 176.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -63.4 -30.21 71.37 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.055 1.342 . . . . 64.12 112.784 -173.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.34 -55.63 15.02 Favored 'General case' 0 C--O 1.213 -0.841 0 N-CA-C 109.313 -0.625 . . . . 73.32 109.313 179.041 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 5.5 tmtm? -62.24 -43.8 98.0 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 125.241 1.416 . . . . 64.24 110.711 179.265 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 60.3 tttm -64.1 -55.44 21.97 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.427 1.491 . . . . 73.45 111.637 -175.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -75.04 -19.12 60.18 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 115.207 -0.906 . . . . 42.32 110.603 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.15 -43.18 99.03 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 122.887 0.475 . . . . 73.44 110.89 172.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.463 ' O ' ' HG2' ' A' ' 83' ' ' LYS . . . -60.1 -41.92 93.58 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 124.0 0.812 . . . . 60.2 110.482 176.22 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.568 HG23 ' HG2' ' A' ' 34' ' ' LYS . 42.8 mm -63.09 -50.64 78.58 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 124.385 1.074 . . . . 64.32 111.604 178.549 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.438 HD23 HD13 ' A' ' 37' ' ' LEU . 34.1 mt -64.35 -43.36 94.8 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.279 0.632 . . . . 72.32 110.315 -179.198 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 60.8 t30 -59.5 -40.08 85.91 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 124.505 1.122 . . . . 73.5 110.854 -177.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.463 ' HG2' ' O ' ' A' ' 79' ' ' ALA . 74.7 mmtt -69.26 -41.86 76.36 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 115.588 -0.733 . . . . 73.14 111.213 176.237 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.55 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 37.4 t -62.11 -50.64 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 123.343 0.657 . . . . 72.24 109.884 -178.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.471 ' CE2' HG21 ' A' ' 104' ' ' VAL . 28.3 m-85 -61.28 -36.19 79.37 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.099 0.96 . . . . 72.41 111.544 178.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -62.83 -31.91 73.01 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.426 0.691 . . . . 73.42 111.449 175.242 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -85.39 -12.86 51.1 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.139 0.976 . . . . 65.21 111.117 178.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 54.6 mt -98.69 0.24 44.23 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 122.783 0.433 . . . . 75.55 110.11 -178.535 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 96.13 -1.62 62.97 Favored Glycine 0 C--N 1.35 1.355 0 O-C-N 123.443 0.464 . . . . 35.42 113.374 177.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -82.25 140.34 33.71 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 109.603 -0.517 . . . . 72.15 109.603 178.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -70.36 147.33 49.71 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.062 0.545 . . . . 72.31 110.093 178.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -50.67 -55.99 13.97 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 125.288 1.435 . . . . 73.41 111.515 178.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 11.6 t -59.37 -19.92 50.67 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 124.287 1.035 . . . . 72.14 113.543 -174.035 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -74.09 -19.07 60.71 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.104 0.561 . . . . 72.14 112.139 -179.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.502 ' HA ' HG22 ' A' ' 104' ' ' VAL . 49.0 t -74.29 101.2 1.69 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 N-CA-C 107.058 -1.46 . . . . 75.01 107.058 175.62 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 8.1 m -111.43 94.16 4.83 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 109.496 -0.557 . . . . 65.24 109.496 -172.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 65.7 m95 -72.04 107.43 4.74 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 109.003 -0.74 . . . . 73.23 109.003 174.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -101.63 75.57 1.59 Allowed 'General case' 0 C--O 1.238 0.478 0 C-N-CA 124.556 1.143 . . . . 74.42 108.402 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 64.9 -88.14 0.08 OUTLIER Glycine 0 C--N 1.346 1.092 0 CA-C-N 114.988 -1.005 . . . . 72.01 112.789 -178.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -82.97 -61.3 1.9 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.461 1.105 . . . . 34.11 109.779 -178.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 11.5 m -102.5 144.26 31.17 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 114.947 -1.024 . . . . 55.1 110.302 -167.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 6.3 p -103.44 120.05 52.87 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 C-N-CA 123.032 0.533 . . . . 74.41 110.255 -178.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.512 HG23 ' HG3' ' A' ' 57' ' ' ARG . 52.5 m -99.72 110.61 23.0 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.453 1.101 . . . . 73.33 108.812 177.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.502 HG22 ' HA ' ' A' ' 95' ' ' VAL . 46.2 t -112.41 112.66 41.43 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 124.266 1.026 . . . . 64.41 108.381 -176.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -92.38 114.34 26.87 Favored 'General case' 0 C--O 1.24 0.599 0 N-CA-C 109.206 -0.664 . . . . 73.24 109.206 -179.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -107.79 137.96 14.32 Favored Glycine 0 C--N 1.342 0.872 0 CA-C-N 115.972 -0.558 . . . . 64.42 112.981 -176.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 23.6 tm0? -85.59 117.48 24.51 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 107.98 -1.118 . . . . 73.23 107.98 171.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.638 HD21 ' HA ' ' A' ' 49' ' ' LYS . 8.6 tt -118.58 140.56 49.7 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.841 1.256 . . . . 51.3 107.806 -179.252 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -142.55 120.87 12.32 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 121.047 0.451 . . . . 74.42 111.652 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -111.91 78.74 0.25 Allowed Glycine 0 C--N 1.343 0.927 0 N-CA-C 110.531 -1.028 . . . . 73.14 110.531 174.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 82.9 t -53.78 -35.63 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 C-N-CA 124.458 1.103 . . . . 73.42 111.621 -176.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -126.8 99.83 5.92 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 108.016 -1.105 . . . . 64.43 108.016 174.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 79.6 mt -82.3 106.95 14.6 Favored 'General case' 0 C--O 1.242 0.71 0 C-N-CA 123.093 0.557 . . . . 74.21 110.001 178.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.81 166.82 22.46 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 115.081 -0.963 . . . . 72.12 110.789 178.671 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 43.1 p-80 -158.78 71.69 0.55 Allowed 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 121.773 0.797 . . . . 63.41 109.951 177.386 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 56.0 p-80 -68.85 122.14 18.01 Favored 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 107.571 -1.27 . . . . 73.11 107.571 170.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -47.98 83.73 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 125.52 1.528 . . . . 75.34 114.828 -159.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 67.2 m-70 -147.36 -162.14 1.48 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 126.157 1.783 . . . . 72.53 107.917 176.126 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 16.3 p-80 -152.61 54.45 0.79 Allowed 'General case' 0 N--CA 1.479 0.989 0 CA-C-O 121.874 0.845 . . . . 62.0 110.089 173.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 . . . . . 0 N--CA 1.484 1.231 0 C-N-CA 123.84 0.856 . . . . 72.13 109.302 178.257 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 mmt . . . . . 0 N--CA 1.483 1.187 0 CA-C-O 120.738 0.304 . . . . 42.03 110.553 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.6 m -71.7 -25.63 62.17 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 123.672 0.789 . . . . 73.12 110.301 174.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -99.16 132.04 10.78 Favored Glycine 0 C--N 1.34 0.781 0 CA-C-N 115.582 -0.736 . . . . 55.41 111.422 172.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.4 tmtm? -124.49 131.63 53.49 Favored 'General case' 0 C--O 1.243 0.716 0 N-CA-C 107.18 -1.415 . . . . 74.2 107.18 -178.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -71.96 101.39 2.68 Favored 'General case' 0 C--N 1.351 0.657 0 CA-C-O 121.192 0.52 . . . . 52.1 109.612 178.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.3 p -100.35 150.23 5.64 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 124.129 0.972 . . . . 75.24 109.805 -178.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -100.5 113.61 26.53 Favored 'General case' 0 C--O 1.239 0.536 0 N-CA-C 108.463 -0.94 . . . . 71.34 108.463 172.101 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.413 HG21 HD12 ' A' ' 25' ' ' LEU . 88.8 t -101.39 107.49 21.54 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 124.833 1.253 . . . . 43.1 108.688 -177.21 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -94.93 101.08 12.83 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 107.862 -1.162 . . . . 75.21 107.862 -177.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 92.2 t -96.14 111.07 25.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 N-CA-C 108.907 -0.775 . . . . 51.52 108.907 -177.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.3 ttmm -107.49 102.92 12.15 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.265 1.026 . . . . 44.13 108.329 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.418 HD11 HG21 ' A' ' 48' ' ' ILE . 15.2 tt -111.11 121.52 63.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 CA-C-O 121.3 0.571 . . . . 70.31 110.515 -177.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 30.2 m -95.16 119.78 34.25 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.031 0.933 . . . . 73.21 109.364 178.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.675 ' SG ' HG23 ' A' ' 48' ' ' ILE . 21.7 t -150.72 134.98 16.97 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.926 1.29 . . . . 64.44 108.835 -175.405 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.572 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 4.0 t30 65.56 29.87 10.85 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 125.014 1.326 . . . . 73.23 110.473 177.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.19 0.03 75.63 Favored Glycine 0 C--N 1.353 1.52 0 CA-C-N 115.487 -0.779 . . . . 74.24 113.879 -178.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -112.71 164.54 13.24 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.918 0.887 . . . . 74.4 110.645 -177.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 82.3 m -115.84 119.86 37.37 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.569 0.748 . . . . 62.45 110.487 176.581 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -109.93 120.75 43.45 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 107.115 -1.439 . . . . 73.33 107.115 176.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -143.36 156.46 44.69 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 118.433 0.56 . . . . 74.31 111.994 -177.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 39.3 ttp180 -166.49 134.9 2.85 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-N 114.9 -1.045 . . . . 73.22 108.721 -174.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 57.4 m -91.62 118.6 30.77 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.729 0.812 . . . . 73.11 109.813 178.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 67.7 m-85 -100.41 137.57 38.65 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.203 1.001 . . . . 73.01 109.041 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -100.18 107.89 19.87 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 106.776 -1.565 . . . . 73.12 106.776 173.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.413 HD12 HG21 ' A' ' 8' ' ' VAL . 67.3 mt -111.23 98.28 7.39 Favored 'General case' 0 C--O 1.239 0.513 0 C-N-CA 123.514 0.726 . . . . 65.51 109.304 -175.225 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 68.5 t80 -92.36 140.59 29.44 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 115.568 -0.742 . . . . 73.11 109.464 172.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.553 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -141.5 171.62 13.81 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.883 0.873 . . . . 71.32 109.498 178.078 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 48.1 t -101.81 -28.65 3.14 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 C-N-CA 123.255 0.622 . . . . 73.04 109.455 173.349 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.587 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 95.2 mtt180 -130.86 174.24 10.17 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.941 0.897 . . . . 74.11 109.745 176.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.454 ' HB3' ' HE3' ' A' ' 76' ' ' LYS . 14.0 p-10 -72.46 -39.18 67.95 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.549 0.74 . . . . 74.34 109.91 173.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -64.11 -26.72 68.66 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.089 0.956 . . . . 72.44 111.455 -178.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.587 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 38.2 mm-40 -67.84 -32.74 73.48 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.642 0.777 . . . . 71.43 111.293 178.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.404 ' HA ' ' HD2' ' A' ' 36' ' ' LYS . 0.1 OUTLIER -67.67 -20.08 65.26 Favored 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 123.759 0.824 . . . . 64.01 110.689 -177.391 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.434 ' HE2' ' HB3' ' A' ' 34' ' ' LYS . 36.2 mtpt -56.83 -61.22 2.59 Favored 'General case' 0 C--N 1.362 1.15 0 C-N-CA 123.2 0.6 . . . . 64.13 112.344 179.577 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -57.46 -31.84 66.34 Favored 'General case' 0 N--CA 1.481 1.122 0 O-C-N 124.0 0.812 . . . . 55.41 111.657 -176.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.404 ' HD2' ' HA ' ' A' ' 33' ' ' LEU . 65.9 mttm -67.13 -47.31 71.47 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.907 0.883 . . . . 75.54 110.29 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.533 HD13 HD23 ' A' ' 81' ' ' LEU . 97.2 mt -63.9 -48.17 77.68 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.72 0.808 . . . . 70.43 111.916 177.242 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -60.25 -41.14 92.56 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.605 0.762 . . . . 73.21 111.514 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.426 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 30.2 mmmt -66.93 -51.89 49.7 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 122.611 0.365 . . . . 64.24 111.195 175.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 20.6 t -56.02 -44.11 77.42 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 C-N-CA 123.381 0.672 . . . . 70.12 111.578 -179.078 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 82.4 mt -69.69 -52.62 24.06 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.051 0.541 . . . . 75.02 110.993 -179.009 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -63.97 -42.74 97.15 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 113.196 0.813 . . . . 71.3 113.196 -177.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 23.2 mm-40 -67.44 -46.14 73.97 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 122.223 0.209 . . . . 72.43 110.59 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 36.1 tpt85 -70.08 -35.15 73.98 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 122.647 0.379 . . . . 65.25 111.518 -176.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.42 ' SD ' HD11 ' A' ' 58' ' ' ILE . 60.4 mtp -86.93 -7.79 57.85 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 113.11 0.782 . . . . 71.2 113.11 -176.342 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.4 ' HA ' ' HD3' ' A' ' 49' ' ' LYS . 24.2 t70 -61.49 -48.13 91.43 Favored Pre-proline 0 CA--C 1.569 1.683 0 CA-C-O 118.843 -0.599 . . . . 60.13 111.608 177.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -68.92 -19.17 40.55 Favored 'Trans proline' 0 C--N 1.391 2.811 0 C-N-CA 122.182 1.922 . . . . 71.35 113.554 170.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.675 HG23 ' SG ' ' A' ' 14' ' ' CYS . 46.8 mm -74.68 -34.29 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 C-N-CA 123.624 0.77 . . . . 71.13 110.466 177.135 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.44 ' HG2' HD11 ' A' ' 108' ' ' LEU . 5.2 mtpm? -72.85 -32.71 65.65 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.924 0.889 . . . . 71.44 109.626 173.359 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.34 -27.72 68.79 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.549 1.14 . . . . 73.13 110.718 172.641 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.521 HD12 ' SG ' ' A' ' 14' ' ' CYS . 68.3 mt -76.18 -35.09 59.29 Favored 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 109.712 -0.477 . . . . 75.01 109.712 171.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 79.11 35.95 29.07 Favored Glycine 0 C--N 1.345 1.069 0 O-C-N 123.822 0.701 . . . . 22.54 112.374 177.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.572 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 80.8 m -69.99 99.3 1.41 Allowed 'General case' 0 C--N 1.345 0.411 0 N-CA-C 109.285 -0.635 . . . . 61.2 109.285 176.614 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 44.0 mtmt -55.16 -32.84 62.44 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.954 1.301 . . . . 64.12 112.203 -169.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -125.28 136.63 53.71 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 108.01 -1.107 . . . . 74.24 108.01 168.011 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.426 ' O ' ' HA ' ' A' ' 105' ' ' GLU . 17.1 m -121.16 134.89 63.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 123.603 0.761 . . . . 44.24 109.058 174.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -100.55 107.53 19.23 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 108.716 -0.846 . . . . 74.31 108.716 172.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.42 HD11 ' SD ' ' A' ' 45' ' ' MET . 35.7 mt -104.18 103.42 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 N-CA-C 108.904 -0.776 . . . . 71.5 108.904 177.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 51.4 m -99.91 102.73 14.21 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 108.3 -1.0 . . . . 72.42 108.3 176.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 73.8 mt -97.24 109.54 23.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 C-N-CA 124.021 0.928 . . . . 75.51 108.73 179.242 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -92.07 134.7 34.59 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 107.952 -1.129 . . . . 73.15 107.952 171.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.8 p -94.02 146.96 5.94 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 N-CA-C 106.813 -1.551 . . . . 55.54 106.813 174.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 7.5 tmtm? -80.43 125.29 29.74 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 107.934 -1.135 . . . . 63.51 107.934 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 14.7 m170 -92.21 106.09 18.17 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 114.874 -1.057 . . . . 54.21 108.312 -178.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 13.6 p -63.85 -43.7 95.35 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.084 0.954 . . . . 73.53 111.35 -178.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -163.83 157.26 18.65 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.551 1.141 . . . . 74.2 108.766 -179.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.43 -26.77 68.08 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.553 0.741 . . . . 74.24 112.844 -174.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -86.38 -45.84 10.82 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.406 0.682 . . . . 64.34 110.44 176.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -68.66 -29.36 67.82 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.838 0.855 . . . . 74.24 112.095 -173.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -67.06 -27.27 67.24 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.412 0.685 . . . . 74.41 111.071 -177.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 71.0 mmtt -67.61 -33.09 74.29 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.82 0.448 . . . . 73.41 109.91 -177.14 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -74.16 -58.08 3.53 Favored 'General case' 0 C--N 1.347 0.469 0 CA-C-N 115.674 -0.694 . . . . 54.34 109.74 172.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 48.9 mm-40 -67.06 -31.42 71.91 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 113.735 1.013 . . . . 63.22 113.735 -167.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -78.85 -42.49 27.39 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 118.082 0.401 . . . . 33.13 110.949 -177.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 53.8 tptt -68.74 -38.63 80.28 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.61 0.764 . . . . 74.52 111.128 177.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.454 ' HE3' ' HB3' ' A' ' 30' ' ' ASP . 76.6 tttt -59.18 -50.04 75.56 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 125.483 1.513 . . . . 55.13 110.387 172.51 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -70.12 -29.08 65.93 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 114.934 -1.03 . . . . 74.03 110.48 -177.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.87 -43.71 87.54 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.925 0.89 . . . . 41.14 110.521 178.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.82 -41.95 99.53 Favored 'General case' 0 C--N 1.354 0.798 0 O-C-N 123.987 0.805 . . . . 31.43 110.903 176.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.402 HG22 HD12 ' A' ' 37' ' ' LEU . 50.0 mm -62.78 -41.83 93.95 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 C-N-CA 123.66 0.784 . . . . 45.13 110.894 175.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.533 HD23 HD13 ' A' ' 37' ' ' LEU . 47.1 mt -64.76 -37.92 89.23 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.764 0.826 . . . . 75.14 110.921 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -57.25 -45.14 84.25 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.771 0.828 . . . . 72.31 110.49 178.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 9.7 mmpt? -66.97 -41.26 87.13 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 114.892 -1.049 . . . . 64.44 110.495 -178.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.494 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 54.6 t -65.69 -56.71 13.82 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 C-N-CA 124.071 0.949 . . . . 63.21 110.571 -177.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.518 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 22.0 m-85 -60.13 -38.1 82.05 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 124.098 0.959 . . . . 64.45 111.569 -177.345 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.74 -30.04 71.18 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.577 0.751 . . . . 71.14 111.835 177.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -87.59 -9.03 55.5 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.491 0.716 . . . . 62.21 111.949 177.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 59.8 mt -105.0 -15.32 15.14 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 122.724 0.409 . . . . 62.32 110.543 -178.695 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 95.11 13.83 51.07 Favored Glycine 0 C--N 1.348 1.213 0 CA-C-N 116.257 -0.429 . . . . 54.11 113.484 178.535 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.518 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 14.3 m-85 -87.5 124.32 33.34 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 108.518 -0.919 . . . . 61.32 108.518 173.699 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 38.6 t-20 -81.87 146.84 29.63 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.708 0.803 . . . . 74.22 110.008 -171.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -53.15 -36.15 60.53 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 125.257 1.423 . . . . 75.2 111.425 173.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 17.2 m -57.15 -21.23 31.24 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 124.706 1.202 . . . . 75.43 113.378 178.572 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -105.89 -10.48 16.63 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.425 1.09 . . . . 70.54 111.896 -173.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.404 HG13 HG22 ' A' ' 104' ' ' VAL . 60.9 t -87.43 103.43 13.37 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 C-N-CA 123.628 0.771 . . . . 74.5 109.696 -175.196 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 30.8 m -108.89 115.49 30.18 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.015 0.926 . . . . 64.14 110.798 -172.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 55.5 m95 -97.81 144.1 27.76 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.007 0.523 . . . . 73.32 111.314 177.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -132.41 66.54 1.55 Allowed 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 108.172 -1.047 . . . . 73.32 108.172 170.033 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 42.06 22.7 0.12 Allowed Glycine 0 N--CA 1.488 2.135 0 N-CA-C 118.023 1.969 . . . . 61.42 118.023 174.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -175.04 -52.73 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.418 0 CA-C-N 118.148 0.974 . . . . 64.35 110.615 -168.149 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 52.7 m -117.58 151.8 36.42 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.393 1.077 . . . . 73.15 109.483 -177.402 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 6.5 p -126.05 113.47 34.31 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.198 0 C-N-CA 123.275 0.63 . . . . 74.04 111.074 176.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 53.6 m -92.8 101.21 13.59 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.693 1.197 . . . . 75.35 109.082 175.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.479 HG21 ' CE2' ' A' ' 85' ' ' PHE . 55.8 t -104.9 112.33 38.09 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 C-N-CA 124.623 1.169 . . . . 74.44 108.419 177.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.426 ' HA ' ' O ' ' A' ' 56' ' ' VAL . 47.4 mt-10 -96.12 156.67 16.24 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.048 -0.723 . . . . 75.22 109.048 175.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -154.05 142.37 9.06 Favored Glycine 0 C--O 1.241 0.541 0 C-N-CA 121.387 -0.435 . . . . 72.24 112.332 176.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 23.0 tp60 -74.45 99.77 3.64 Favored 'General case' 0 C--N 1.351 0.644 0 N-CA-C 106.897 -1.52 . . . . 64.33 106.897 171.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.44 HD11 ' HG2' ' A' ' 49' ' ' LYS . 20.5 tp -85.57 160.75 19.56 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.768 0.827 . . . . 62.31 110.185 -176.752 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -68.3 -179.1 1.2 Allowed 'General case' 0 CA--C 1.547 0.861 0 CA-C-O 122.288 1.042 . . . . 75.1 112.313 175.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 154.07 -106.1 0.29 Allowed Glycine 0 N--CA 1.449 -0.473 0 CA-C-N 113.647 -1.615 . . . . 64.53 109.368 -177.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 17.6 m -126.33 169.79 17.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 124.251 1.02 . . . . 64.04 110.519 -179.227 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 37.3 t70 78.46 -32.74 0.16 Allowed 'General case' 0 N--CA 1.5 2.049 0 C-N-CA 125.602 1.561 . . . . 74.33 114.439 170.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 70.9 mt -65.59 140.78 58.55 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 124.285 1.034 . . . . 60.41 111.171 -174.133 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.88 -26.82 68.78 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 113.996 1.11 . . . . 73.42 113.996 -168.649 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -69.01 164.86 21.39 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.356 0.662 . . . . 75.15 111.555 -179.333 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 28.7 p-80 -61.16 124.95 22.0 Favored 'General case' 0 N--CA 1.485 1.288 0 O-C-N 123.883 0.74 . . . . 75.51 111.453 -170.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 10.8 p80 -142.04 142.32 32.87 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.859 0.864 . . . . 72.53 109.936 -176.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 23.7 m170 -111.66 178.86 4.19 Favored 'General case' 0 C--O 1.241 0.652 0 C-N-CA 124.453 1.101 . . . . 60.41 108.269 172.086 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 -77.79 81.27 4.22 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 107.803 -1.184 . . . . 74.05 107.803 167.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 44.8 t-80 . . . . . 0 C--O 1.251 1.151 0 C-N-CA 125.1 1.36 . . . . 74.1 110.033 -178.208 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mpt? . . . . . 0 N--CA 1.478 0.943 0 N-CA-C 108.857 -0.794 . . . . 71.11 108.857 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.3 m -77.27 70.51 3.67 Favored 'General case' 0 N--CA 1.481 1.075 0 CA-C-O 121.775 0.798 . . . . 75.3 109.816 178.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 131.72 159.85 9.57 Favored Glycine 0 C--N 1.341 0.826 0 CA-C-N 114.805 -1.089 . . . . 73.42 112.448 -171.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.17 150.02 36.01 Favored 'General case' 0 C--O 1.244 0.807 0 C-N-CA 123.315 0.646 . . . . 74.42 110.674 177.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -97.06 101.95 13.63 Favored 'General case' 0 C--O 1.239 0.513 0 N-CA-C 106.659 -1.608 . . . . 75.11 106.659 167.168 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.2 p -100.23 134.42 39.93 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 C-N-CA 124.148 0.979 . . . . 63.21 108.642 -178.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.443 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 34.6 mt-10 -106.29 113.51 27.08 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 108.058 -1.09 . . . . 74.52 108.058 175.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 77.6 t -97.25 107.74 20.46 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 114.827 -1.079 . . . . 65.34 108.331 -176.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -94.52 99.75 11.85 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 107.26 -1.385 . . . . 74.12 107.26 -177.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 97.2 t -94.56 103.31 14.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 N-CA-C 108.113 -1.069 . . . . 74.12 108.113 -177.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.442 ' HG3' ' HB3' ' A' ' 20' ' ' GLU . 34.7 ttmt -115.0 101.21 8.79 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 107.732 -1.21 . . . . 75.24 107.732 -176.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.445 HD13 HG13 ' A' ' 48' ' ' ILE . 11.3 tt -116.24 125.95 73.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 C-N-CA 123.376 0.67 . . . . 74.53 110.373 -169.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 55.5 m -92.07 122.47 34.61 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 109.944 -0.391 . . . . 72.42 109.944 176.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.523 ' SG ' HG23 ' A' ' 48' ' ' ILE . 14.6 t -155.86 147.99 23.45 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.462 1.505 . . . . 52.44 108.644 -178.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.448 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 11.6 t30 67.17 18.51 10.39 Favored 'General case' 0 N--CA 1.499 1.994 0 CA-C-O 121.791 0.805 . . . . 54.03 110.682 174.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.5 7.11 88.73 Favored Glycine 0 C--N 1.358 1.772 0 CA-C-N 115.495 -0.775 . . . . 73.14 113.586 -176.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.9 mtpm? -124.98 169.2 12.34 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.114 0.965 . . . . 72.24 110.397 -178.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.4 m -120.05 115.0 22.84 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 109.923 -0.399 . . . . 72.34 109.923 -178.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.409 ' HB3' ' NH2' ' A' ' 44' ' ' ARG . 61.9 m-85 -104.45 102.97 12.6 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.717 1.207 . . . . 75.33 108.996 -175.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.442 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -105.57 161.25 14.53 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 122.84 0.456 . . . . 75.44 111.282 -179.261 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 20.2 ttt180 -169.15 130.11 1.13 Allowed 'General case' 0 N--CA 1.477 0.888 0 O-C-N 123.893 0.746 . . . . 72.04 109.778 174.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 26.0 m -93.16 111.82 23.57 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.006 0.923 . . . . 74.22 109.692 178.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.428 ' O ' ' HA ' ' A' ' 7' ' ' GLU . 87.5 m-85 -98.69 122.49 41.98 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.646 0.778 . . . . 74.14 110.363 -177.394 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 24.9 mp0 -88.69 111.07 21.52 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 107.972 -1.122 . . . . 72.24 107.972 174.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.532 HD11 HG21 ' A' ' 40' ' ' VAL . 80.9 mt -124.77 119.26 28.39 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.215 1.006 . . . . 75.04 108.459 -177.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 87.2 t80 -113.74 138.87 49.64 Favored 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 109.751 -0.462 . . . . 53.35 109.751 179.139 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -156.7 149.79 24.04 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.125 0.57 . . . . 73.24 110.187 175.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 26.7 t -68.48 -26.94 34.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 124.627 1.171 . . . . 64.13 110.417 175.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.543 ' HB3' ' HG2' ' A' ' 31' ' ' GLU . 74.4 mtt180 -135.35 137.71 42.65 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.111 0.964 . . . . 71.33 110.017 178.254 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -71.82 -17.78 62.13 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 123.269 0.628 . . . . 63.2 111.717 176.385 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.543 ' HG2' ' HB3' ' A' ' 29' ' ' ARG . 13.5 pt-20 -70.74 -27.68 64.14 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 122.621 0.368 . . . . 73.23 110.876 172.116 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.474 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 31.5 mm-40 -83.47 -23.04 32.39 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.22 0.608 . . . . 74.2 110.476 177.323 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.01 -21.29 65.95 Favored 'General case' 0 CA--C 1.56 1.364 0 C-N-CA 124.168 0.987 . . . . 71.34 110.106 178.031 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -48.29 -56.56 7.73 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 124.289 1.036 . . . . 74.12 112.505 178.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.419 ' HA ' ' HD3' ' A' ' 38' ' ' LYS . 1.9 pp20? -60.33 -31.87 70.71 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.215 0.606 . . . . 74.33 112.08 -176.711 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -70.59 -40.6 73.14 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.378 0.671 . . . . 73.34 110.59 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.47 HD13 HD23 ' A' ' 81' ' ' LEU . 77.6 mt -63.33 -33.65 75.99 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.717 0.807 . . . . 71.02 111.067 174.625 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.531 ' HA ' HD11 ' A' ' 88' ' ' LEU . 57.3 mtpt -65.3 -41.85 93.67 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.383 0.673 . . . . 63.41 110.93 175.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.405 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 42.7 mmtm -61.5 -51.51 68.35 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 109.392 -0.596 . . . . 74.4 109.392 175.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.532 HG21 HD11 ' A' ' 25' ' ' LEU . 38.7 t -54.05 -50.86 51.47 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 C-N-CA 124.781 1.232 . . . . 71.43 111.863 -178.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 80.1 mt -67.41 -51.53 50.65 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.165 0.586 . . . . 53.33 111.534 -177.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -66.1 -38.9 89.37 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.088 0.555 . . . . 71.44 112.296 -174.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -70.72 -42.54 70.46 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.022 0.529 . . . . 72.31 110.736 176.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.409 ' NH2' ' HB3' ' A' ' 19' ' ' TYR . 18.6 tpt180 -69.93 -34.49 73.53 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 122.658 0.383 . . . . 72.13 111.743 -178.23 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 62.0 mtp -91.88 -8.24 46.98 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.532 0.567 . . . . 73.03 112.532 -177.141 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -59.05 -49.29 94.04 Favored Pre-proline 0 CA--C 1.569 1.674 0 CA-C-O 118.9 -0.572 . . . . 73.34 111.673 174.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -67.54 -25.53 40.99 Favored 'Trans proline' 0 C--N 1.394 2.967 0 C-N-CA 122.035 1.824 . . . . 61.01 112.571 174.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.523 HG23 ' SG ' ' A' ' 14' ' ' CYS . 50.9 mm -72.64 -33.89 45.96 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.114 0 C-N-CA 124.169 0.988 . . . . 70.22 110.918 -177.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -71.09 -31.98 68.5 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.753 0.821 . . . . 75.02 110.073 176.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.7 tmmm? -71.7 -33.11 68.51 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 115.112 -0.949 . . . . 71.5 110.699 172.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 91.2 mt -69.43 -30.68 68.66 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 109.345 -0.613 . . . . 73.55 109.345 177.009 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 93.28 19.19 36.52 Favored Glycine 0 C--N 1.345 1.067 0 CA-C-N 115.446 -0.797 . . . . 75.4 113.787 172.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.448 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 71.6 m -71.35 102.82 2.7 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.837 0.319 . . . . 73.14 111.055 -177.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -55.67 -56.62 18.31 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.87 1.268 . . . . 72.34 110.016 176.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 14.1 tpp85 -103.23 125.54 49.95 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 114.781 -1.1 . . . . 73.34 109.366 176.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 26.8 m -122.09 142.97 36.31 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.03 0.932 . . . . 74.11 109.212 172.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.3 ttm105 -111.17 106.11 15.02 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 108.006 -1.109 . . . . 63.32 108.006 172.174 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 24.5 mt -101.57 112.46 34.7 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 N-CA-C 108.203 -1.036 . . . . 73.22 108.203 -179.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 46.5 m -100.73 104.61 15.89 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 107.859 -1.163 . . . . 75.13 107.859 176.302 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 75.8 mt -100.38 115.31 41.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 N-CA-C 109.081 -0.711 . . . . 74.0 109.081 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -101.66 123.97 46.54 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 108.518 -0.919 . . . . 75.42 108.518 172.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 7.8 p -93.19 130.5 42.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 N-CA-C 107.683 -1.229 . . . . 73.55 107.683 178.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.443 ' HB3' ' H ' ' A' ' 7' ' ' GLU . 12.2 tmtt? -81.76 118.79 23.15 Favored 'General case' 0 C--O 1.243 0.713 0 N-CA-C 107.11 -1.441 . . . . 55.11 107.11 179.429 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 23.1 m170 -72.5 131.65 42.82 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 115.328 -0.851 . . . . 73.2 108.989 -177.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 40.6 t -59.81 -45.05 93.57 Favored 'General case' 0 CA--C 1.55 0.963 0 O-C-N 123.948 0.78 . . . . 52.14 110.933 -179.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -154.97 163.83 39.75 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 123.523 0.729 . . . . 73.11 110.672 -178.488 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -56.66 -47.69 79.22 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.397 1.479 . . . . 43.1 112.817 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.43 -31.31 68.44 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 122.642 0.377 . . . . 74.52 111.015 177.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -76.79 -15.98 59.59 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 115.36 -0.837 . . . . 64.21 112.747 -179.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -54.0 -54.84 33.51 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.901 0.48 . . . . 63.11 112.197 -174.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -66.85 -44.72 80.28 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.442 0.697 . . . . 53.05 111.196 -174.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 24.4 ttmm -63.62 -59.54 4.48 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 115.47 -0.786 . . . . 73.3 110.529 -178.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -74.14 -20.66 60.16 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 113.301 0.852 . . . . 71.04 113.301 -172.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.16 -43.34 64.74 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-N 119.386 0.994 . . . . 50.52 109.559 175.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -65.44 -37.91 88.28 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.115 0.966 . . . . 73.02 111.681 176.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -71.11 -44.24 66.05 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.048 0.539 . . . . 64.43 110.65 177.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -76.88 -18.73 58.15 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.253 0.621 . . . . 75.44 109.784 -176.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.12 -45.96 92.53 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.346 0.659 . . . . 75.43 109.904 169.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -73.03 -32.9 65.39 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 124.047 0.842 . . . . 54.03 111.391 178.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.459 ' O ' HG23 ' A' ' 84' ' ' VAL . 46.3 mm -62.81 -54.24 36.37 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 C-N-CA 123.095 0.558 . . . . 74.02 109.825 174.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.47 HD23 HD13 ' A' ' 37' ' ' LEU . 32.2 mt -60.41 -44.99 95.17 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.8 0.84 . . . . 52.1 110.339 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 57.5 t30 -64.27 -33.7 76.41 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.602 0.761 . . . . 73.43 110.721 -175.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.473 ' O ' ' HG2' ' A' ' 87' ' ' GLU . 27.7 mmtp -73.04 -35.16 66.69 Favored 'General case' 0 C--O 1.213 -0.843 0 CA-C-O 119.007 -0.52 . . . . 71.23 111.485 174.15 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 80' ' ' ILE . 69.0 t -66.81 -36.44 77.22 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 CA-C-O 121.388 0.614 . . . . 73.42 110.604 177.286 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.562 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 24.2 m-85 -62.38 -43.24 99.28 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 114.9 -1.045 . . . . 65.22 109.623 173.33 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -69.45 -28.53 66.19 Favored 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 122.851 0.46 . . . . 74.34 111.461 175.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.473 ' HG2' ' O ' ' A' ' 83' ' ' LYS . 58.0 mm-40 -65.11 -34.75 79.14 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 124.084 0.954 . . . . 73.11 110.84 177.65 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.531 HD11 ' HA ' ' A' ' 38' ' ' LYS . 70.9 mt -107.27 -6.6 17.14 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 122.994 0.518 . . . . 74.11 112.204 -170.188 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 93.28 54.9 1.65 Allowed Glycine 0 C--N 1.346 1.09 0 CA-C-O 121.331 0.406 . . . . 52.42 113.267 176.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.562 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 72.9 m-85 -118.16 145.96 44.55 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 106.816 -1.55 . . . . 73.24 106.816 169.236 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -76.83 158.44 30.82 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 122.949 0.5 . . . . 63.23 110.273 178.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -64.82 -35.94 82.74 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.333 0.653 . . . . 71.03 110.359 176.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 18.1 m -51.11 -35.38 35.02 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 124.938 1.295 . . . . 72.12 112.975 174.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . 0.433 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 3.2 m-20 -58.96 -37.88 77.79 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 124.057 0.943 . . . . 75.53 110.973 179.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 17.6 t -83.73 110.24 18.23 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 C-N-CA 124.183 0.993 . . . . 54.35 109.502 -169.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 51.8 m -139.26 113.98 9.24 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 122.867 0.467 . . . . 42.33 109.972 174.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.443 ' HA ' ' HA ' ' A' ' 102' ' ' VAL . 60.7 m95 -79.04 121.77 25.38 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.197 0.599 . . . . 72.33 110.597 176.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -101.07 87.9 3.38 Favored 'General case' 0 C--O 1.242 0.678 0 C-N-CA 124.79 1.236 . . . . 75.3 107.71 168.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 65.87 -103.1 0.78 Allowed Glycine 0 C--N 1.343 0.956 0 CA-C-N 115.82 -0.627 . . . . 64.42 112.196 -174.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -106.4 -8.51 17.13 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.405 0.682 . . . . 70.24 111.645 -176.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 37.3 m -109.71 127.21 54.44 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 108.881 -0.785 . . . . 51.42 108.881 178.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.443 ' HA ' ' HA ' ' A' ' 97' ' ' TRP . 8.1 p -95.32 118.4 41.43 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 N-CA-C 108.841 -0.8 . . . . 71.42 108.841 176.458 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 39.4 m -92.72 100.41 12.91 Favored 'General case' 0 C--O 1.242 0.67 0 N-CA-C 107.576 -1.268 . . . . 64.31 107.576 176.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.451 HG21 ' CZ ' ' A' ' 85' ' ' PHE . 60.8 t -103.69 110.3 29.66 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 N-CA-C 108.301 -1.0 . . . . 72.35 108.301 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -101.71 111.46 23.71 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 108.526 -0.916 . . . . 71.24 108.526 176.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -116.57 155.16 16.37 Favored Glycine 0 C--N 1.342 0.876 0 CA-C-N 115.421 -0.809 . . . . 70.42 112.594 -172.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -105.47 150.73 25.04 Favored 'General case' 0 C--O 1.243 0.75 0 C-N-CA 123.475 0.71 . . . . 60.32 109.217 170.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.32 169.7 20.76 Favored 'General case' 0 C--O 1.244 0.795 0 C-N-CA 124.004 0.922 . . . . 63.05 109.353 178.716 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -79.09 80.03 5.46 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 108.854 -0.795 . . . . 72.22 108.854 176.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -85.53 101.43 2.55 Favored Glycine 0 C--N 1.338 0.664 0 CA-C-N 114.785 -1.098 . . . . 63.23 111.98 -178.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 46.4 t -68.86 114.34 5.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 N-CA-C 109.078 -0.712 . . . . 72.53 109.078 178.081 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -71.62 108.61 5.06 Favored 'General case' 0 C--O 1.238 0.464 0 O-C-N 123.863 0.727 . . . . 43.13 109.748 -176.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 75.8 mt -99.33 11.09 40.08 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.396 0.678 . . . . 73.22 110.552 175.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -81.57 105.67 12.91 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 121.225 0.535 . . . . 64.02 109.951 -177.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 30.2 m170 -72.06 170.43 13.91 Favored 'General case' 0 C--O 1.243 0.715 0 CA-C-N 114.892 -1.049 . . . . 64.1 110.026 171.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 47.4 m-70 65.04 36.92 7.07 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 124.154 0.982 . . . . 73.41 108.496 -165.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 54.4 t60 -70.26 -8.36 49.55 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 114.481 -1.236 . . . . 74.52 113.024 -167.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 58.1 m-70 -63.03 -18.79 63.72 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 122.603 0.361 . . . . 63.42 111.37 175.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 22.0 p80 -115.55 157.67 23.75 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.559 0.744 . . . . 74.34 109.757 169.552 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 . . . . . 0 CA--C 1.557 1.217 0 N-CA-C 107.872 -1.159 . . . . 62.54 107.872 168.299 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mpt? . . . . . 0 N--CA 1.477 0.885 0 N-CA-C 109.466 -0.568 . . . . 64.54 109.466 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.4 m -70.99 103.54 2.71 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 108.097 -1.075 . . . . 63.25 108.097 169.3 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 162.44 47.14 0.02 OUTLIER Glycine 0 C--N 1.339 0.714 0 N-CA-C 110.216 -1.153 . . . . 52.33 110.216 -179.186 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 57.2 mttm -100.61 154.92 18.18 Favored 'General case' 0 C--O 1.245 0.858 0 C-N-CA 123.624 0.77 . . . . 71.51 110.61 -169.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -80.35 102.67 9.71 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 105.432 -2.062 . . . . 65.21 105.432 160.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.1 p -102.42 134.29 43.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 124.373 1.069 . . . . 53.04 108.44 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.569 ' HB2' ' HG3' ' A' ' 63' ' ' LYS . 46.8 mt-10 -107.96 115.2 29.69 Favored 'General case' 0 C--O 1.243 0.728 0 N-CA-C 107.876 -1.157 . . . . 71.42 107.876 175.9 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 99.1 t -95.72 109.27 22.33 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 CA-C-N 114.025 -1.443 . . . . 64.12 108.333 -174.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.46 ' HG2' HG23 ' A' ' 22' ' ' THR . 36.5 mt-30 -94.21 100.97 12.95 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 107.933 -1.136 . . . . 74.15 107.933 -176.151 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 98.5 t -95.77 104.2 15.56 Favored 'Isoleucine or valine' 0 C--O 1.243 0.753 0 N-CA-C 108.779 -0.823 . . . . 51.23 108.779 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.491 ' HG3' ' HB3' ' A' ' 20' ' ' GLU . 39.0 ttpt -108.64 102.54 11.59 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 108.042 -1.095 . . . . 73.43 108.042 -179.261 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.5 HD13 HG13 ' A' ' 48' ' ' ILE . 15.8 tt -111.48 120.19 61.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 C-N-CA 123.364 0.666 . . . . 75.52 110.29 -176.142 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 7.0 m -92.28 108.46 19.97 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 108.605 -0.887 . . . . 62.43 108.605 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.669 ' SG ' HG23 ' A' ' 48' ' ' ILE . 52.5 t -128.7 119.34 24.46 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.947 0.899 . . . . 75.54 108.986 -175.157 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.496 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 22.1 t-20 77.3 -8.61 1.65 Allowed 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 126.327 1.851 . . . . 74.34 112.602 173.619 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 124.17 -4.43 8.96 Favored Glycine 0 C--N 1.341 0.857 0 CA-C-O 119.861 -0.41 . . . . 44.04 112.588 -175.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -106.25 144.97 32.19 Favored 'General case' 0 C--O 1.241 0.642 0 C-N-CA 123.084 0.554 . . . . 74.14 109.672 179.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 47.2 m -94.32 108.32 20.22 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.809 0.844 . . . . 75.42 108.731 177.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 70.6 m-85 -101.65 101.35 11.86 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 107.843 -1.169 . . . . 75.11 107.843 177.191 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.491 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 0.2 OUTLIER -123.23 141.84 51.56 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 122.846 0.458 . . . . 75.51 111.049 -178.146 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 41.1 ttm180 -154.94 135.8 13.69 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.374 -0.83 . . . . 72.21 108.94 177.055 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.46 HG23 ' HG2' ' A' ' 9' ' ' GLN . 29.8 m -94.6 117.13 29.65 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.377 1.071 . . . . 75.35 108.31 177.668 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -99.17 120.28 39.24 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.111 0.964 . . . . 71.21 110.034 -176.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -83.33 109.24 17.11 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 108.204 -1.036 . . . . 73.3 108.204 178.104 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 96.6 mt -119.49 148.36 43.36 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.02 0.928 . . . . 75.34 109.101 179.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 54.0 t80 -136.39 139.86 42.79 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 108.42 -0.955 . . . . 72.3 108.42 174.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.58 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -162.72 151.81 15.12 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 123.683 0.793 . . . . 73.34 109.377 174.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 43.5 t -76.0 -71.14 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 N-CA-C 108.633 -0.877 . . . . 72.53 108.633 175.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.488 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 57.1 mtp85 -82.18 155.36 25.0 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.352 0.596 . . . . 73.54 110.977 -179.52 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -68.63 -28.65 67.09 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 114.952 -1.022 . . . . 70.14 110.955 175.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 60.8 mm-40 -58.61 -36.07 73.47 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.529 0.732 . . . . 73.53 111.644 171.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.58 ' HB2' ' HB1' ' A' ' 27' ' ' ALA . 9.2 mm-40 -67.58 -34.09 76.34 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 123.717 0.807 . . . . 74.32 110.822 -179.443 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.424 HD23 ' HB3' ' A' ' 27' ' ' ALA . 0.2 OUTLIER -73.07 -25.26 60.84 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.554 0.742 . . . . 70.55 110.871 -177.633 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -53.94 -59.73 4.25 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.766 0.826 . . . . 65.31 112.252 -178.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -57.65 -33.46 68.32 Favored 'General case' 0 N--CA 1.479 0.987 0 O-C-N 124.088 0.868 . . . . 63.44 111.894 -178.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.407 ' O ' HG23 ' A' ' 40' ' ' VAL . 64.6 mttm -68.66 -44.9 73.12 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 123.418 0.687 . . . . 74.53 109.912 -179.467 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 89.6 mt -65.08 -36.84 85.61 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.767 0.827 . . . . 64.32 111.482 178.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.541 ' HA ' HD11 ' A' ' 88' ' ' LEU . 59.2 mtpt -63.58 -43.22 97.61 Favored 'General case' 0 C--N 1.357 0.897 0 C-N-CA 122.778 0.431 . . . . 71.35 110.138 177.18 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -66.92 -47.91 70.27 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 123.467 0.479 . . . . 72.11 111.623 176.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.412 ' O ' ' HB2' ' A' ' 44' ' ' ARG . 54.8 t -57.86 -41.87 80.88 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.227 0 C-N-CA 123.57 0.748 . . . . 64.01 110.747 -178.552 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.574 HD21 HD11 ' A' ' 60' ' ' ILE . 74.6 mt -72.21 -51.12 22.53 Favored 'General case' 0 C--O 1.217 -0.633 0 CA-C-O 118.755 -0.64 . . . . 75.0 111.425 178.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -55.69 -50.21 70.88 Favored 'General case' 0 N--CA 1.496 1.851 0 C-N-CA 122.901 0.48 . . . . 64.51 112.027 -179.027 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 56.3 mm-40 -63.01 -34.77 78.27 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 115.966 -0.561 . . . . 63.41 110.827 178.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.412 ' HB2' ' O ' ' A' ' 40' ' ' VAL . 20.5 tpt180 -65.7 -45.52 82.48 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.296 0.638 . . . . 75.12 110.954 176.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.471 ' HG2' ' O ' ' A' ' 41' ' ' LEU . 94.6 mmm -80.57 -21.83 41.33 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.698 0.799 . . . . 63.42 112.379 -170.13 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -57.38 -55.73 41.38 Favored Pre-proline 0 CA--C 1.565 1.531 0 O-C-N 123.721 0.638 . . . . 63.34 111.521 -178.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.418 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 60.8 Cg_endo -69.27 -24.71 31.61 Favored 'Trans proline' 0 C--N 1.389 2.689 0 C-N-CA 121.623 1.549 . . . . 62.12 112.334 177.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.669 HG23 ' SG ' ' A' ' 14' ' ' CYS . 44.7 mm -69.99 -34.42 59.7 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.015 0 C-N-CA 123.938 0.895 . . . . 61.43 111.506 -177.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 58.4 mtpt -67.14 -35.6 80.07 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 109.998 -0.371 . . . . 55.23 109.998 173.591 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.32 -35.65 79.85 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 123.772 0.829 . . . . 73.21 109.376 176.088 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.452 HD12 HD13 ' A' ' 48' ' ' ILE . 91.7 mt -70.79 -23.29 62.35 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 122.86 0.464 . . . . 72.25 110.008 175.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 71.88 39.63 59.0 Favored Glycine 0 C--N 1.343 0.97 0 CA-C-N 115.667 -0.697 . . . . 75.1 113.968 168.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.496 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 72.8 m -79.03 111.76 15.55 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 122.498 0.319 . . . . 64.05 111.03 -178.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -46.74 -37.22 8.16 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 126.177 1.791 . . . . 71.31 112.864 178.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.472 ' HD2' ' N ' ' A' ' 56' ' ' VAL . 0.0 OUTLIER -146.2 136.86 24.16 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 107.469 -1.308 . . . . 75.31 107.469 175.096 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.472 ' N ' ' HD2' ' A' ' 55' ' ' ARG . 31.0 m -124.66 142.14 42.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 124.472 1.109 . . . . 71.25 109.879 177.075 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 -111.01 105.5 14.28 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 109.056 -0.72 . . . . 72.13 109.056 176.357 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.44 HD11 ' SD ' ' A' ' 45' ' ' MET . 52.0 mt -94.79 109.59 22.51 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 125.312 1.445 . . . . 71.14 108.184 176.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 27.4 m -107.19 105.48 15.48 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 108.229 -1.026 . . . . 73.0 108.229 177.069 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.574 HD11 HD21 ' A' ' 41' ' ' LEU . 79.8 mt -97.6 122.83 49.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 123.564 0.746 . . . . 75.15 109.341 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 79.6 mtt-85 -110.68 138.01 47.62 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.515 0.726 . . . . 73.11 109.604 174.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.5 p -99.39 139.64 20.62 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 N-CA-C 108.21 -1.033 . . . . 73.55 108.21 170.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.569 ' HG3' ' HB2' ' A' ' 7' ' ' GLU . 10.6 mmpt? -81.97 127.48 33.09 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 122.641 0.376 . . . . 75.35 110.438 178.81 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 20.2 p80 -147.16 154.16 40.74 Favored 'General case' 0 C--O 1.24 0.564 0 C-N-CA 123.896 0.878 . . . . 55.24 110.598 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 71.8 p -164.91 32.66 0.06 Allowed 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.981 0.912 . . . . 62.24 109.056 174.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -135.85 82.11 1.93 Allowed 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 107.509 -1.293 . . . . 53.42 107.509 -175.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.61 -6.23 5.04 Favored 'General case' 0 N--CA 1.483 1.181 0 N-CA-C 113.911 1.078 . . . . 44.53 113.911 -166.08 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -78.48 -66.99 0.78 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.231 0.612 . . . . 74.51 110.205 170.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.414 ' O ' ' HG2' ' A' ' 73' ' ' GLU . 44.5 mm-40 -84.35 -27.65 27.58 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 113.384 0.883 . . . . 75.35 113.384 -168.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -59.73 -29.39 68.11 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 112.943 0.72 . . . . 71.31 112.943 -172.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -76.36 -30.23 57.51 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.029 0.932 . . . . 73.33 110.496 -178.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -72.94 -41.72 64.2 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.417 1.087 . . . . 61.03 109.884 172.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.414 ' HG2' ' O ' ' A' ' 69' ' ' GLU . 10.7 mm-40 -79.92 -23.0 42.06 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 115.781 -0.645 . . . . 72.12 111.946 -173.345 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -76.48 -40.3 50.71 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 122.824 0.449 . . . . 44.14 109.947 174.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.3 ttmm -57.26 -41.71 80.19 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 124.238 1.015 . . . . 74.24 110.587 170.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -66.75 -45.02 79.88 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 114.423 -1.262 . . . . 50.52 110.712 178.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -72.7 -22.35 60.91 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.411 1.084 . . . . 74.12 110.089 -176.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.423 ' HA ' ' CZ2' ' A' ' 97' ' ' TRP . . . -63.87 -46.51 84.6 Favored 'General case' 0 C--N 1.354 0.761 0 C-N-CA 123.812 0.845 . . . . 33.25 110.472 173.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.38 -34.96 73.18 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 115.372 -0.831 . . . . 63.01 111.533 178.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.402 ' O ' HG23 ' A' ' 84' ' ' VAL . 31.9 mm -62.13 -54.76 30.1 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 123.636 0.775 . . . . 72.22 111.224 177.096 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 16.2 mt -67.78 -26.97 66.37 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 122.564 0.345 . . . . 75.23 111.535 178.076 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -61.63 -37.54 84.34 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.045 0.538 . . . . 63.05 110.074 174.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.1 mmmp? -69.07 -47.37 65.45 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 115.9 -0.591 . . . . 53.01 110.931 172.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.43 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 71.8 t -61.01 -55.96 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 123.745 0.818 . . . . 70.01 111.083 -172.314 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.458 ' CZ ' HG21 ' A' ' 104' ' ' VAL . 35.0 m-85 -56.6 -44.26 80.93 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 124.218 0.949 . . . . 74.35 111.607 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.41 -32.06 73.39 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.19 0.596 . . . . 75.32 111.633 -179.268 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -86.15 -12.34 50.19 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.858 0.863 . . . . 43.33 111.77 -179.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.541 HD11 ' HA ' ' A' ' 38' ' ' LYS . 41.7 mt -106.64 8.97 31.42 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.126 0.57 . . . . 70.54 111.253 -179.213 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 86.54 14.8 65.05 Favored Glycine 0 C--N 1.347 1.172 0 N-CA-C 114.221 0.448 . . . . 55.13 114.221 174.082 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.434 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 63.4 m-85 -94.94 134.66 37.35 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.285 0.634 . . . . 72.45 110.304 174.636 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -88.47 162.03 16.69 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.001 0.92 . . . . 73.4 108.957 178.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -60.94 -28.29 68.85 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.635 0.774 . . . . 64.0 111.9 177.137 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 35.9 t -59.56 -31.36 69.35 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.087 0.955 . . . . 74.03 111.466 177.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . 0.574 HD22 ' HA2' ' A' ' 106' ' ' GLY . 18.7 m120 -76.04 -32.89 59.55 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 122.902 0.481 . . . . 71.05 111.019 178.196 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 44.5 t -106.42 116.21 49.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 123.515 0.726 . . . . 60.32 111.287 -165.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 10.6 t -126.07 122.93 37.21 Favored 'General case' 0 CA--C 1.556 1.199 0 C-N-CA 123.06 0.544 . . . . 74.31 110.065 173.388 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.423 ' CZ2' ' HA ' ' A' ' 78' ' ' ALA . 37.8 m95 -91.12 146.05 24.17 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.567 0.747 . . . . 64.35 112.086 -177.795 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -152.31 73.93 1.06 Allowed 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 115.303 -0.862 . . . . 51.53 109.129 172.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 61.47 -93.41 0.08 OUTLIER Glycine 0 C--N 1.352 1.444 0 CA-C-N 114.443 -1.253 . . . . 32.34 114.656 173.425 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -69.23 -43.99 72.93 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.831 1.253 . . . . 75.52 111.251 -176.587 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 16.8 m -121.37 139.73 53.05 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.354 -0.839 . . . . 71.43 110.053 -171.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 6.7 p -107.04 126.67 63.09 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.703 0 N-CA-C 108.593 -0.891 . . . . 60.55 108.593 166.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 33.5 m -96.23 104.03 15.96 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 107.947 -1.131 . . . . 72.11 107.947 177.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.458 HG21 ' CZ ' ' A' ' 85' ' ' PHE . 58.9 t -105.38 110.6 31.61 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.516 0 N-CA-C 107.623 -1.251 . . . . 75.04 107.623 178.327 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.409 ' HB3' ' HD3' ' A' ' 55' ' ' ARG . 46.3 mt-10 -109.96 110.03 20.83 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 107.728 -1.212 . . . . 73.34 107.728 173.433 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.574 ' HA2' HD22 ' A' ' 94' ' ' ASN . . . -118.78 135.22 11.32 Favored Glycine 0 C--N 1.342 0.909 0 N-CA-C 111.437 -0.665 . . . . 71.52 111.437 -179.286 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 4.3 pm0 -78.92 140.35 38.09 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 108.047 -1.094 . . . . 65.33 108.047 172.167 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 83.6 mt -117.35 147.5 42.57 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.063 0.458 . . . . 75.15 110.561 178.101 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -59.92 -34.77 73.67 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 114.385 -1.28 . . . . 63.12 110.562 169.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 65.47 -135.17 36.1 Favored Glycine 0 C--N 1.355 1.637 0 CA-C-N 115.563 -0.744 . . . . 71.3 111.854 -178.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 12.0 t -91.75 56.88 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.989 0 N-CA-C 107.987 -1.116 . . . . 55.02 107.987 172.555 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 31.8 t70 60.17 23.91 13.24 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 124.568 1.147 . . . . 72.43 111.374 -176.182 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 80.2 mt -75.0 130.27 39.07 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.28 0.632 . . . . 61.1 110.025 -175.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -71.09 115.42 10.21 Favored 'General case' 0 C--O 1.24 0.586 0 C-N-CA 123.203 0.601 . . . . 72.24 109.814 -179.6 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -70.36 92.42 0.8 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 123.646 0.778 . . . . 61.1 109.728 176.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 -103.41 153.72 20.18 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.241 1.016 . . . . 73.4 109.677 174.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 57.8 t-80 -154.37 104.5 2.59 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 108.739 -0.837 . . . . 75.42 108.739 176.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 55.9 m-70 -84.84 159.03 20.47 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.805 0.842 . . . . 73.41 110.78 178.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 14.1 t-80 -143.06 -13.52 0.72 Allowed 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.896 0.878 . . . . 74.41 110.831 175.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 34.3 m170 . . . . . 0 CA--C 1.557 1.228 0 C-N-CA 122.839 0.455 . . . . 75.41 110.387 176.462 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.6 ttm . . . . . 0 N--CA 1.478 0.965 0 N-CA-C 109.914 -0.402 . . . . 72.02 109.914 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.7 m -99.4 36.59 1.72 Allowed 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.979 0.912 . . . . 72.05 110.174 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -69.45 80.97 0.29 Allowed Glycine 0 C--N 1.354 1.573 0 CA-C-N 115.482 -0.781 . . . . 73.34 112.379 -178.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.72 144.75 29.65 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.167 0.587 . . . . 74.35 109.847 -172.349 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.486 ' HA ' ' HA ' ' A' ' 26' ' ' TYR . 5.8 ttpm? -86.71 113.1 22.28 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 108.931 -0.766 . . . . 71.55 108.931 173.398 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.462 HG21 HG23 ' A' ' 62' ' ' VAL . 1.6 p -100.35 138.09 25.75 Favored 'Isoleucine or valine' 0 C--O 1.241 0.636 0 N-CA-C 107.544 -1.28 . . . . 65.54 107.544 170.165 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.514 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 40.2 mt-10 -100.16 113.12 25.54 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 107.445 -1.317 . . . . 60.01 107.445 176.024 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.414 HG13 HG23 ' A' ' 60' ' ' ILE . 90.0 t -95.38 107.25 19.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 N-CA-C 108.033 -1.099 . . . . 74.12 108.033 -176.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -95.08 100.1 11.98 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 108.294 -1.002 . . . . 74.22 108.294 -175.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 64.1 t -95.09 107.98 20.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 N-CA-C 108.968 -0.753 . . . . 60.43 108.968 -177.28 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.0 ttmm -109.82 103.65 12.49 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 108.356 -0.979 . . . . 71.0 108.356 -179.48 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.496 HD13 HG13 ' A' ' 48' ' ' ILE . 15.0 tt -112.29 123.35 67.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 CA-C-O 121.22 0.534 . . . . 74.41 110.618 -176.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 17.4 m -100.16 103.3 14.77 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 108.726 -0.842 . . . . 75.42 108.726 -179.033 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 35.1 t -113.73 129.17 56.61 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.784 0.833 . . . . 73.24 110.004 -178.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 72.08 -72.64 0.11 Allowed 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 125.584 1.553 . . . . 61.14 110.934 176.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -163.93 16.54 0.11 Allowed Glycine 0 C--N 1.34 0.793 0 CA-C-O 119.924 -0.375 . . . . 61.42 112.21 176.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -127.92 156.05 43.24 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.741 0.816 . . . . 73.32 110.638 -179.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 62.2 m -104.23 121.72 43.88 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.166 0.986 . . . . 62.12 109.814 179.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 39.6 m-85 -116.11 105.28 12.43 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 108.084 -1.08 . . . . 70.02 108.084 178.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -135.76 154.61 51.18 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 112.291 0.478 . . . . 70.22 112.291 -173.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 75.4 ttt180 -161.52 140.81 10.06 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 114.942 -1.026 . . . . 61.1 109.65 177.116 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 88.4 m -90.86 114.52 26.97 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 123.818 0.847 . . . . 73.35 109.208 174.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 -98.17 129.77 44.94 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.549 0.74 . . . . 74.53 109.871 -178.162 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -89.95 108.31 19.64 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 108.104 -1.073 . . . . 71.04 108.104 178.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 82.9 mt -122.96 100.95 7.15 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.326 0.65 . . . . 62.51 109.83 -173.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.486 ' HA ' ' HA ' ' A' ' 5' ' ' LYS . 80.0 t80 -84.18 131.95 34.71 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 109.637 -0.505 . . . . 75.22 109.637 172.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.567 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -132.63 149.89 52.24 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.399 0.68 . . . . 74.14 109.445 175.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 60.6 t -87.76 -36.66 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-O 122.035 0.921 . . . . 75.34 109.442 176.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.42 ' O ' ' HB1' ' A' ' 27' ' ' ALA . 84.0 mtt180 -121.31 155.93 33.65 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 107.217 -1.401 . . . . 72.23 107.217 170.121 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.474 ' HB3' ' HZ3' ' A' ' 76' ' ' LYS . 8.3 p-10 -56.51 -30.28 62.84 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.265 0.626 . . . . 74.54 110.602 166.561 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -65.3 -28.95 69.68 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.646 1.178 . . . . 65.43 112.086 176.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.567 ' HB2' ' HB1' ' A' ' 27' ' ' ALA . 19.9 mm-40 -67.98 -32.78 73.44 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 110.511 -0.181 . . . . 65.31 110.511 176.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.722 HD22 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -71.34 -16.81 62.45 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.585 0.754 . . . . 72.42 111.334 -177.08 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -53.51 -64.89 0.68 Allowed 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.554 0.741 . . . . 65.32 111.949 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -59.67 -30.16 68.56 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 124.218 0.949 . . . . 62.13 112.383 -178.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.722 ' HD2' HD22 ' A' ' 33' ' ' LEU . 50.4 mttm -66.1 -47.09 75.35 Favored 'General case' 0 C--N 1.355 0.814 0 C-N-CA 123.099 0.56 . . . . 75.23 110.06 178.31 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.581 HD13 HD23 ' A' ' 81' ' ' LEU . 85.1 mt -59.54 -43.74 93.43 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 124.128 0.893 . . . . 72.45 110.993 177.456 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.599 ' HA ' HD11 ' A' ' 88' ' ' LEU . 54.3 mtpt -58.3 -50.95 71.8 Favored 'General case' 0 C--N 1.358 0.939 0 O-C-N 123.999 0.812 . . . . 73.31 111.1 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -66.18 -47.0 75.38 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 123.537 0.523 . . . . 64.44 111.328 -178.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 40.3 t -54.68 -43.73 67.18 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 C-N-CA 123.73 0.812 . . . . 64.31 111.542 179.269 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.65 HD21 HD11 ' A' ' 60' ' ' ILE . 46.7 mt -66.15 -48.51 70.54 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.206 0.603 . . . . 73.43 111.246 179.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -58.61 -49.21 78.3 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.229 0.611 . . . . 74.25 111.439 179.389 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -66.8 -40.02 87.94 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.407 1.083 . . . . 71.31 111.565 -176.203 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -66.09 -41.14 91.05 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 123.452 0.47 . . . . 75.41 110.714 176.325 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.473 ' SD ' ' OH ' ' A' ' 90' ' ' TYR . 48.1 mtp -92.49 -7.98 45.88 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 113.905 1.076 . . . . 62.43 113.905 -172.072 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -67.24 -44.8 49.34 Favored Pre-proline 0 CA--C 1.564 1.494 0 CA-C-O 118.995 -0.526 . . . . 73.02 111.581 -179.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.409 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 59.5 Cg_endo -71.2 -22.93 25.07 Favored 'Trans proline' 0 C--N 1.386 2.536 0 C-N-CA 121.692 1.595 . . . . 60.13 113.139 169.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.521 HD13 HD12 ' A' ' 51' ' ' LEU . 43.5 mm -66.64 -32.67 59.09 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 C-N-CA 123.494 0.717 . . . . 74.23 110.487 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.435 ' HG3' ' O ' ' A' ' 45' ' ' MET . 90.2 mttt -55.97 -50.45 70.76 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-O 121.512 0.672 . . . . 65.11 109.268 172.882 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.568 ' HG3' ' HG3' ' A' ' 114' ' ' GLU . 37.5 ttpt -65.55 -29.34 69.94 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 114.044 -1.434 . . . . 64.51 111.48 -177.383 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.521 HD12 HD13 ' A' ' 48' ' ' ILE . 87.8 mt -71.76 -29.5 64.57 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 122.588 0.355 . . . . 72.24 110.759 175.605 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 72.13 84.25 0.23 Allowed Glycine 0 C--N 1.35 1.336 0 O-C-N 123.763 0.664 . . . . 53.22 113.082 170.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 1.2 p -131.64 134.08 45.6 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.322 0.649 . . . . 61.43 111.234 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -72.3 -37.07 69.07 Favored 'General case' 0 C--N 1.356 0.869 0 C-N-CA 124.302 1.041 . . . . 71.14 110.586 -178.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 41.8 ttm180 -127.42 131.96 50.17 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 109.627 -0.509 . . . . 72.25 109.627 175.642 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 31.5 m -120.37 137.66 53.44 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 124.961 1.304 . . . . 73.54 108.385 171.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.422 ' O ' ' HA ' ' A' ' 12' ' ' ILE . 24.9 ttm180 -108.26 106.61 16.85 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 108.304 -0.999 . . . . 75.35 108.304 173.191 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.432 HD11 ' SD ' ' A' ' 45' ' ' MET . 30.9 mt -96.72 105.38 17.03 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 N-CA-C 108.187 -1.042 . . . . 71.03 108.187 178.062 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 27.7 t -105.13 103.21 12.71 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 107.844 -1.169 . . . . 72.33 107.844 -179.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.65 HD11 HD21 ' A' ' 41' ' ' LEU . 66.6 mt -101.2 121.67 52.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 123.625 0.77 . . . . 75.55 109.829 -176.809 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 64.2 mtp180 -102.14 134.72 44.93 Favored 'General case' 0 C--O 1.241 0.611 0 N-CA-C 109.35 -0.611 . . . . 55.25 109.35 175.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.462 HG23 HG21 ' A' ' 6' ' ' VAL . 7.3 p -95.93 116.44 37.72 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.047 0 N-CA-C 106.975 -1.491 . . . . 74.32 106.975 173.147 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.514 ' HB3' ' H ' ' A' ' 7' ' ' GLU . 24.2 tptm -90.57 110.36 21.5 Favored 'General case' 0 C--O 1.239 0.529 0 O-C-N 121.366 -0.834 . . . . 75.22 108.903 -176.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 18.7 p80 -110.56 111.5 22.77 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 124.356 1.063 . . . . 63.1 108.558 178.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 27.7 t -70.9 -30.72 67.16 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 122.979 0.512 . . . . 70.14 110.425 177.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -85.64 155.44 21.12 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.009 0.924 . . . . 62.12 110.276 177.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -117.05 -8.65 11.19 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.143 0.977 . . . . 23.22 112.375 -176.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -86.22 -68.67 0.72 Allowed 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.068 0.547 . . . . 64.15 111.652 -175.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -76.1 -17.63 59.52 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.385 1.074 . . . . 75.21 112.685 -174.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -58.12 -26.07 62.18 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 114.14 1.163 . . . . 72.53 114.14 -170.785 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.5 pttp -66.56 -38.42 87.05 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 123.409 0.684 . . . . 74.51 110.943 174.246 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -70.5 -44.8 66.89 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.794 0.838 . . . . 51.32 109.322 173.031 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.504 ' HA ' ' HB3' ' A' ' 76' ' ' LYS . 24.3 mm-40 -68.52 -17.89 64.26 Favored 'General case' 0 C--N 1.353 0.746 0 O-C-N 124.389 1.055 . . . . 71.12 111.97 -176.018 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.14 -54.77 18.15 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 122.766 0.426 . . . . 64.32 110.538 174.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 50.3 mtpt -63.77 -41.14 98.03 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 124.265 0.978 . . . . 74.32 111.178 177.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.504 ' HB3' ' HA ' ' A' ' 73' ' ' GLU . 50.2 tttm -65.93 -42.16 90.43 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.257 1.423 . . . . 73.22 111.232 -178.03 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -79.1 -21.85 46.06 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.485 0.714 . . . . 74.51 110.815 176.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.2 -42.73 99.37 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 122.664 0.386 . . . . 60.03 110.418 176.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.64 -35.39 77.79 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.359 0.664 . . . . 64.14 111.259 176.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 49.3 mm -64.57 -46.31 92.95 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.801 0 C-N-CA 124.212 1.005 . . . . 74.42 110.297 174.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.581 HD23 HD13 ' A' ' 37' ' ' LEU . 48.1 mt -64.67 -48.1 76.0 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.683 0.793 . . . . 72.14 111.52 -178.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 61.9 m-80 -62.35 -34.14 76.08 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 123.669 0.606 . . . . 72.43 111.446 -173.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.8 mmmm -72.64 -37.28 68.05 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 123.261 0.351 . . . . 75.24 111.785 176.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.496 HG13 ' HG2' ' A' ' 38' ' ' LYS . 40.4 t -66.61 -52.54 44.69 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.121 0 C-N-CA 123.474 0.71 . . . . 73.31 110.168 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.572 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 29.9 m-85 -56.25 -42.98 78.25 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 124.36 1.038 . . . . 74.32 111.229 176.746 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -59.87 -34.0 72.56 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.788 0.835 . . . . 52.31 112.4 179.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -86.37 -15.44 40.44 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.353 0.661 . . . . 55.42 112.429 -176.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.599 HD11 ' HA ' ' A' ' 38' ' ' LYS . 78.2 mt -106.57 -9.51 16.56 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 112.474 0.546 . . . . 72.43 112.474 -171.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 118.51 14.4 6.36 Favored Glycine 0 N--CA 1.478 1.44 0 N-CA-C 113.918 0.327 . . . . 62.31 113.918 174.388 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.572 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 12.6 m-85 -109.2 150.08 28.43 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 108.745 -0.835 . . . . 74.21 108.745 174.651 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -86.12 166.89 15.43 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 109.697 -0.483 . . . . 75.25 109.697 171.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -88.48 32.38 0.78 Allowed 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 121.541 0.686 . . . . 31.31 110.062 174.359 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 79.2 p -110.46 -28.36 8.57 Favored 'General case' 0 C--N 1.343 0.325 0 C-N-CA 125.065 1.346 . . . . 43.22 108.112 176.018 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -76.97 -9.54 58.76 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.122 -0.944 . . . . 73.51 110.957 178.342 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 23.3 t -89.34 99.26 9.05 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.796 0 N-CA-C 108.751 -0.833 . . . . 73.33 108.751 -175.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 59.5 m -126.22 106.14 9.33 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.609 0.763 . . . . 60.35 109.636 -176.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 56.1 m95 -77.04 111.88 13.08 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.318 0.647 . . . . 73.12 110.461 177.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -108.44 95.17 5.48 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 105.437 -2.06 . . . . 73.12 105.437 170.053 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 64.95 -121.87 22.76 Favored Glycine 0 C--N 1.345 1.035 0 O-C-N 123.741 0.65 . . . . 61.24 112.106 -172.3 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -90.89 0.33 57.52 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.763 0.825 . . . . 52.32 111.444 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 63.5 m -119.48 118.95 32.46 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.543 0.737 . . . . 45.2 110.362 -169.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.476 HG11 HD13 ' A' ' 81' ' ' LEU . 7.2 p -91.9 128.02 43.82 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.184 0 N-CA-C 109.052 -0.722 . . . . 64.04 109.052 173.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 40.5 m -105.08 112.24 25.29 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.567 0.747 . . . . 64.44 109.129 178.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 78.7 t -114.91 113.01 42.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 125.262 1.425 . . . . 75.34 108.112 179.54 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.4 145.65 46.98 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 109.217 -0.66 . . . . 72.44 109.217 -179.614 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 161.77 -147.91 14.78 Favored Glycine 0 C--N 1.332 0.35 0 N-CA-C 110.917 -0.873 . . . . 31.21 110.917 -173.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 5.0 pm0 -142.1 165.07 28.45 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 117.226 0.513 . . . . 62.13 110.103 177.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.61 HD13 ' H ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -100.78 159.61 15.04 Favored 'General case' 0 C--O 1.243 0.729 0 C-N-CA 123.819 0.848 . . . . 72.42 109.436 173.109 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -97.29 113.49 25.12 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 109.151 -0.685 . . . . 72.52 109.151 170.238 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -143.35 104.59 0.35 Allowed Glycine 0 C--N 1.335 0.492 0 N-CA-C 109.981 -1.247 . . . . 75.11 109.981 176.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 28.6 m -70.87 -31.52 45.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 CA-C-O 120.857 0.361 . . . . 70.44 110.422 177.326 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -104.44 104.3 14.15 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 108.331 -0.988 . . . . 73.54 108.331 176.196 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.413 HD22 ' O ' ' A' ' 49' ' ' LYS . 33.0 mt -98.51 -65.35 0.97 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 106.925 -1.509 . . . . 75.45 106.925 170.114 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.568 ' HG3' ' HG3' ' A' ' 50' ' ' LYS . 24.4 mt-10 -152.99 133.63 13.79 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.267 1.427 . . . . 74.15 108.46 167.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 68.0 m-70 -76.82 164.97 25.33 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 108.597 -0.89 . . . . 73.12 108.597 167.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 29.4 t-80 -88.33 34.44 0.75 Allowed 'General case' 0 N--CA 1.486 1.337 0 CA-C-O 122.075 0.94 . . . . 73.1 110.005 176.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 82.2 t60 -71.63 -25.71 62.26 Favored 'General case' 0 C--N 1.347 0.482 0 C-N-CA 124.427 1.091 . . . . 63.05 111.263 179.423 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 45.2 t60 -61.74 98.11 0.09 Allowed 'General case' 0 C--N 1.354 0.788 0 CA-C-O 121.823 0.821 . . . . 70.13 111.104 -177.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 64.8 m80 -116.73 -41.78 3.03 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 106.187 -1.783 . . . . 73.54 106.187 165.181 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 56.9 t-80 . . . . . 0 C--O 1.253 1.279 0 CA-C-N 113.962 -1.472 . . . . 73.31 107.471 172.825 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.7 mmm . . . . . 0 N--CA 1.477 0.898 0 N-CA-C 109.792 -0.447 . . . . 62.13 109.792 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.8 p -100.35 100.39 11.17 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.044 0.937 . . . . 71.14 108.504 173.206 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 168.4 72.28 0.03 OUTLIER Glycine 0 C--N 1.341 0.82 0 N-CA-C 110.399 -1.08 . . . . 74.21 110.399 -177.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 63.4 mttm -103.96 127.88 51.49 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.617 0.767 . . . . 51.35 111.397 -174.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.437 ' HE3' ' HB3' ' A' ' 5' ' ' LYS . 1.0 OUTLIER -101.13 105.25 16.38 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 106.635 -1.617 . . . . 75.1 106.635 169.664 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.3 p -98.79 144.77 11.22 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 N-CA-C 109.083 -0.71 . . . . 72.41 109.083 176.341 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.485 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 41.0 mt-10 -100.46 110.6 22.79 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 107.49 -1.3 . . . . 73.52 107.49 170.03 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.454 HG21 HD12 ' A' ' 25' ' ' LEU . 77.2 t -99.54 106.68 19.41 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 125.072 1.349 . . . . 63.45 108.282 -179.372 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.444 ' NE2' ' HB3' ' A' ' 61' ' ' ARG . 39.6 mt-30 -98.73 100.28 11.48 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 107.824 -1.176 . . . . 72.32 107.824 -176.404 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.443 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 95.8 t -93.69 103.08 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 N-CA-C 108.605 -0.887 . . . . 74.42 108.605 -176.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.432 ' HA ' ' HB3' ' A' ' 20' ' ' GLU . 22.5 ttmm -109.61 102.85 11.65 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 108.021 -1.103 . . . . 74.11 108.021 -178.111 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.528 HD13 HG13 ' A' ' 48' ' ' ILE . 13.7 tt -112.82 141.83 27.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 109.46 -0.57 . . . . 71.52 109.46 -179.332 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 45.0 m -121.22 133.05 55.15 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.591 0.756 . . . . 75.24 110.031 -178.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.522 ' SG ' ' ND2' ' A' ' 15' ' ' ASN . 19.6 t -160.31 133.88 6.95 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.599 1.16 . . . . 40.21 110.015 176.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.522 ' ND2' ' SG ' ' A' ' 14' ' ' CYS . 63.6 m-80 63.92 23.45 13.34 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 124.705 1.202 . . . . 75.33 112.17 -178.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 74.72 16.21 80.37 Favored Glycine 0 C--N 1.35 1.333 0 CA-C-N 116.307 -0.406 . . . . 70.42 113.013 -174.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.3 mmpt? -118.71 122.26 42.06 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.977 0.911 . . . . 74.01 109.859 178.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 89.9 m -98.46 121.5 40.47 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 123.15 0.58 . . . . 75.24 110.122 178.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.1 m-85 -106.17 111.11 23.59 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 107.364 -1.347 . . . . 63.14 107.364 176.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.443 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 0.8 OUTLIER -140.51 155.47 46.63 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 112.393 0.516 . . . . 54.21 112.393 -173.575 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 40.8 ttm180 -168.32 145.06 3.93 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.003 0.921 . . . . 74.2 109.549 175.108 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 53.5 m -85.47 112.29 20.76 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.669 0.787 . . . . 71.34 109.05 172.047 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -98.88 138.85 35.41 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.761 0.824 . . . . 72.54 109.111 178.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 26.2 mp0 -104.89 109.43 21.4 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 107.616 -1.253 . . . . 75.13 107.616 -178.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.454 HD12 HG21 ' A' ' 8' ' ' VAL . 81.6 mt -117.02 102.6 9.47 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.865 0.866 . . . . 64.12 109.322 -175.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.427 ' O ' ' HE3' ' A' ' 36' ' ' LYS . 72.5 t80 -94.67 126.27 39.86 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.308 0.643 . . . . 73.22 109.612 176.741 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.502 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -139.95 153.21 46.85 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.808 0.843 . . . . 72.4 109.5 175.171 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 47.2 t -74.86 -58.68 4.26 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 N-CA-C 108.664 -0.865 . . . . 72.13 108.664 174.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.505 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 79.2 mtt180 -101.42 168.21 9.66 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 115.571 -0.74 . . . . 54.53 111.223 -178.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.8 -46.15 76.11 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.448 1.499 . . . . 75.11 110.038 -178.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -60.22 -30.15 69.2 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 113.774 -1.557 . . . . 75.22 111.766 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.505 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 37.4 mm-40 -71.34 -24.58 62.13 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.49 0.716 . . . . 65.21 111.645 -178.738 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.68 -28.31 61.68 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 122.917 0.487 . . . . 74.24 110.034 178.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.433 ' HE2' ' HB3' ' A' ' 34' ' ' LYS . 39.5 mtpt -52.59 -56.85 12.43 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 123.351 0.66 . . . . 74.42 112.477 -176.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.461 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 2.8 pp20? -59.65 -32.62 70.63 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 123.993 0.808 . . . . 73.33 112.153 -175.511 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.427 ' HE3' ' O ' ' A' ' 26' ' ' TYR . 55.3 mttm -67.85 -46.49 71.62 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.296 0.639 . . . . 74.04 110.206 177.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 72.5 mt -58.38 -42.42 87.0 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.168 0.987 . . . . 73.51 110.844 177.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -62.41 -40.98 98.29 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.095 0.958 . . . . 61.15 111.266 178.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 74.3 mmtt -63.46 -51.68 64.65 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 123.434 0.459 . . . . 73.34 110.837 175.707 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 92.3 t -60.36 -37.95 76.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 124.171 0.988 . . . . 73.23 111.629 -177.473 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.472 HD21 HD11 ' A' ' 60' ' ' ILE . 65.2 mt -68.46 -51.15 46.75 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 122.901 0.48 . . . . 55.24 110.257 178.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -61.76 -30.51 70.83 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.169 0.588 . . . . 71.41 111.725 178.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -67.56 -53.13 30.98 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.243 0.617 . . . . 72.43 110.721 175.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.417 ' NE ' ' HA ' ' A' ' 44' ' ' ARG . 0.0 OUTLIER -74.97 -26.92 59.93 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 123.324 0.39 . . . . 64.22 111.763 -173.073 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.578 ' HB3' ' HE3' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -82.04 -27.92 32.75 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.594 0.758 . . . . 64.1 112.014 -179.405 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -56.99 -52.48 73.77 Favored Pre-proline 0 CA--C 1.562 1.438 0 N-CA-C 113.025 0.75 . . . . 63.45 113.025 -173.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.426 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 41.9 Cg_endo -64.24 -30.99 64.31 Favored 'Trans proline' 0 C--N 1.385 2.453 0 C-N-CA 121.775 1.65 . . . . 44.44 111.793 176.191 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.528 HG13 HD13 ' A' ' 12' ' ' ILE . 44.8 mm -74.9 -33.34 29.77 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.046 0 C-N-CA 123.999 0.919 . . . . 65.42 111.003 -174.408 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.578 ' HE3' ' HB3' ' A' ' 45' ' ' MET . 98.9 mttt -70.17 -34.36 72.89 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.39 0.676 . . . . 73.51 109.743 175.429 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -72.87 -29.22 63.01 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.884 0.874 . . . . 73.34 110.901 175.371 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 73.6 mt -71.81 -29.74 64.76 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 109.317 -0.623 . . . . 72.02 109.317 173.642 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 71.52 54.11 9.14 Favored Glycine 0 C--N 1.351 1.4 0 O-C-N 123.791 0.682 . . . . 73.44 111.982 176.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.492 ' SG ' HG23 ' A' ' 48' ' ' ILE . 12.7 m -73.35 122.0 21.34 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 122.98 0.512 . . . . 72.52 110.391 -179.321 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -67.4 -25.1 65.78 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.763 0.825 . . . . 75.13 110.807 177.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 16.8 tpp180 -140.38 129.15 23.11 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.132 0.973 . . . . 72.14 108.931 175.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 19.7 m -118.22 143.53 28.78 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 123.298 0.639 . . . . 70.02 109.601 170.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.491 ' HG3' ' HG2' ' A' ' 105' ' ' GLU . 52.0 ttt-85 -131.52 106.43 8.21 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 108.814 -0.81 . . . . 71.25 108.814 172.381 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.418 ' HB ' ' HB ' ' A' ' 104' ' ' VAL . 39.3 mt -99.6 129.42 50.18 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 C-N-CA 124.922 1.289 . . . . 62.45 107.539 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.2 m -120.68 103.3 9.02 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 107.464 -1.309 . . . . 70.32 107.464 179.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.472 HD11 HD21 ' A' ' 41' ' ' LEU . 73.2 mt -98.77 104.95 16.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 N-CA-C 108.884 -0.784 . . . . 72.33 108.884 -177.409 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.444 ' HB3' ' NE2' ' A' ' 9' ' ' GLN . 0.0 OUTLIER -96.23 109.99 22.36 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 108.4 -0.963 . . . . 73.11 108.4 -176.339 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 21.9 t -95.03 127.0 47.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 C-N-CA 124.468 1.107 . . . . 61.42 110.089 -174.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.485 ' HB3' ' H ' ' A' ' 7' ' ' GLU . 3.9 tppp? -87.6 102.52 14.69 Favored 'General case' 0 C--O 1.24 0.565 0 N-CA-C 108.717 -0.845 . . . . 72.43 108.717 177.627 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 36.7 m80 -71.61 140.92 49.96 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 123.402 0.439 . . . . 75.31 110.114 178.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 17.2 m -62.39 -46.57 88.01 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.698 1.199 . . . . 71.02 112.532 -166.339 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -141.71 153.24 44.51 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 122.723 0.409 . . . . 62.05 110.992 -172.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -74.57 -15.44 60.84 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 124.196 0.999 . . . . 74.44 112.803 -175.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -86.14 -44.93 11.82 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 122.763 0.425 . . . . 64.32 109.887 171.43 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -66.28 -35.14 79.63 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-N 115.575 -0.738 . . . . 75.22 112.551 -177.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -43.59 -38.43 2.99 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 115.038 1.496 . . . . 54.14 115.038 -167.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -67.11 -41.97 85.31 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.412 0.685 . . . . 71.41 111.039 -177.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 18.2 tppt? -77.53 -35.74 53.04 Favored 'General case' 0 C--O 1.241 0.642 0 C-N-CA 123.72 0.808 . . . . 75.22 109.837 174.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.676 ' HG3' ' HD2' ' A' ' 76' ' ' LYS . 34.9 tt0 -74.29 -15.19 60.97 Favored 'General case' 0 C--N 1.351 0.673 0 CA-C-N 115.533 -0.758 . . . . 73.33 111.345 -175.124 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.77 -62.2 1.64 Allowed 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 108.685 -0.857 . . . . 63.03 108.685 171.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 57.8 tttm -65.1 -24.56 67.47 Favored 'General case' 0 N--CA 1.481 1.1 0 O-C-N 123.514 0.508 . . . . 72.43 111.715 -179.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.676 ' HD2' ' HG3' ' A' ' 73' ' ' GLU . 3.4 ttmp? -59.54 -60.45 3.83 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.93 0.892 . . . . 65.55 110.685 172.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -77.31 -21.73 53.05 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 115.549 -0.75 . . . . 73.04 109.961 -174.565 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.42 ' HA ' ' CE2' ' A' ' 97' ' ' TRP . . . -64.11 -43.47 95.24 Favored 'General case' 0 C--N 1.345 0.406 0 C-N-CA 123.488 0.715 . . . . 62.02 110.142 172.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.88 -48.26 79.75 Favored 'General case' 0 C--N 1.349 0.561 0 O-C-N 124.142 0.901 . . . . 42.22 110.752 175.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.419 ' O ' HG23 ' A' ' 84' ' ' VAL . 38.1 mm -62.54 -50.59 79.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 O-C-N 123.944 0.778 . . . . 71.43 111.41 -175.204 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 10.7 mt -67.03 -39.11 86.92 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-O 119.253 -0.403 . . . . 74.11 111.035 -179.312 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -61.09 -36.87 80.81 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 122.967 0.507 . . . . 73.01 110.65 -179.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.494 ' O ' ' HG2' ' A' ' 87' ' ' GLU . 33.2 mmtp -71.31 -37.33 71.81 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 115.482 -0.781 . . . . 44.25 111.04 175.907 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 80' ' ' ILE . 53.8 t -64.64 -38.57 83.01 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 123.539 0.736 . . . . 61.32 110.402 178.576 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.565 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 22.0 m-85 -64.34 -36.02 82.78 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 114.955 -1.021 . . . . 73.42 110.431 174.907 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -73.77 -23.5 59.72 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 123.683 0.793 . . . . 75.32 111.652 175.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 83' ' ' LYS . 37.6 mm-40 -74.71 -29.72 61.29 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.024 0.53 . . . . 64.4 111.718 176.35 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 82.1 mt -108.35 -18.87 13.64 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.174 0.59 . . . . 74.23 111.781 -168.44 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 107.18 11.44 25.81 Favored Glycine 0 C--N 1.347 1.174 0 N-CA-C 114.6 0.6 . . . . 50.54 114.6 174.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.565 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 87.7 m-85 -72.1 120.21 17.39 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 108.807 -0.812 . . . . 74.43 108.807 171.682 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.411 ' O ' HG23 ' A' ' 95' ' ' VAL . 35.2 m-80 -77.6 165.07 24.75 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.671 0.788 . . . . 61.4 110.329 -173.532 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -53.06 -44.42 67.46 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.771 0.828 . . . . 51.1 111.701 173.023 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 34.5 t -66.56 -8.51 27.4 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.231 1.012 . . . . 62.44 112.215 179.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . 0.435 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 12.8 m120 -104.26 -11.03 17.44 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.409 0.684 . . . . 73.41 111.176 178.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 91' ' ' ASN . 57.6 t -109.87 113.46 44.28 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 C-N-CA 123.483 0.713 . . . . 64.34 109.925 -175.236 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 7.9 m -123.13 97.58 5.49 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.303 0.641 . . . . 71.25 110.159 175.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.42 ' CE2' ' HA ' ' A' ' 78' ' ' ALA . 5.1 m95 -74.17 150.08 40.59 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 122.892 0.477 . . . . 75.22 110.967 178.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -159.4 81.76 0.75 Allowed 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.361 0.664 . . . . 73.22 110.29 -178.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 70.08 -101.06 0.83 Allowed Glycine 0 CA--C 1.533 1.194 0 CA-C-N 115.237 -0.892 . . . . 72.25 113.581 174.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -90.77 -20.97 21.78 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.678 0.791 . . . . 62.5 111.093 177.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 17.0 m -114.64 128.81 56.52 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.198 0.599 . . . . 73.02 110.74 -169.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.411 HG12 ' HB ' ' A' ' 60' ' ' ILE . 10.3 p -99.91 130.87 48.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 N-CA-C 108.048 -1.093 . . . . 73.4 108.048 166.476 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 15.1 m -108.1 102.54 11.69 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.495 -0.928 . . . . 73.51 108.495 179.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.435 ' HA ' ' O ' ' A' ' 94' ' ' ASN . 41.0 t -92.91 109.01 21.06 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 N-CA-C 108.008 -1.108 . . . . 71.44 108.008 -179.184 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.491 ' HG2' ' HG3' ' A' ' 57' ' ' ARG . 42.1 mt-10 -121.55 112.43 18.47 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 107.21 -1.404 . . . . 72.34 107.21 -176.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -164.75 -167.23 24.99 Favored Glycine 0 C--O 1.246 0.88 0 C-N-CA 120.93 -0.652 . . . . 54.52 113.254 -173.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 27.4 pt20 -103.47 146.5 28.42 Favored 'General case' 0 C--O 1.24 0.575 0 C-N-CA 124.499 1.12 . . . . 74.12 109.833 -178.545 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.566 HD13 ' HA ' ' A' ' 49' ' ' LYS . 64.6 mt -79.5 158.89 27.14 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 115.459 -0.791 . . . . 64.11 110.865 172.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -77.42 75.3 3.98 Favored 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 125.324 1.45 . . . . 53.4 110.502 173.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -125.38 -58.81 0.17 Allowed Glycine 0 N--CA 1.471 1.032 0 CA-C-N 116.101 -0.499 . . . . 62.24 111.959 -175.687 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.6 t -67.23 -45.34 86.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 N-CA-C 108.853 -0.795 . . . . 64.11 108.853 177.611 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -81.02 116.74 21.12 Favored 'General case' 0 C--O 1.242 0.691 0 CA-C-N 114.567 -1.197 . . . . 75.25 108.683 175.065 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 67.3 mt -86.43 -14.04 44.47 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.659 0.784 . . . . 73.4 111.655 -174.392 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -85.22 64.46 8.69 Favored 'General case' 0 C--O 1.241 0.618 0 CA-C-O 121.659 0.742 . . . . 74.22 110.726 -175.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 16.4 t-160 -65.74 133.19 50.52 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 107.828 -1.175 . . . . 75.13 107.828 167.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 45.6 m80 -63.62 94.73 0.09 Allowed 'General case' 0 CA--C 1.54 0.588 0 O-C-N 123.728 0.643 . . . . 70.54 111.057 -177.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 55.7 m80 -78.29 148.47 33.84 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 114.621 -1.172 . . . . 72.44 108.245 173.13 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 47.3 p-80 -78.03 160.79 27.92 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 109.593 -0.521 . . . . 71.3 109.593 179.4 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 54.7 t60 -52.89 120.25 5.58 Favored 'General case' 0 N--CA 1.48 1.041 0 O-C-N 124.289 0.993 . . . . 63.14 112.316 -171.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 58.4 m-70 . . . . . 0 C--O 1.248 1.021 0 C-N-CA 124.157 0.983 . . . . 62.33 108.874 173.088 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.2 mtt . . . . . 0 N--CA 1.477 0.885 0 N-CA-C 109.291 -0.633 . . . . 62.53 109.291 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.8 t -77.81 -51.2 10.87 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 123.398 0.679 . . . . 61.34 110.934 -177.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -81.87 97.15 1.84 Allowed Glycine 0 C--N 1.347 1.178 0 N-CA-C 111.488 -0.645 . . . . 74.32 111.488 -179.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.546 ' HA ' ' HE2' ' A' ' 4' ' ' LYS . 8.1 mmpt? -115.15 170.33 8.44 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.689 0.795 . . . . 73.41 111.503 -175.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -88.35 98.43 11.6 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 108.163 -1.051 . . . . 53.21 108.163 178.075 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.448 HG23 HG23 ' A' ' 62' ' ' VAL . 0.2 OUTLIER -98.42 137.4 26.04 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 CA-C-N 114.104 -1.407 . . . . 74.12 107.516 177.69 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -107.29 114.06 27.85 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 108.412 -0.958 . . . . 75.52 108.412 176.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.447 HG13 HG23 ' A' ' 60' ' ' ILE . 93.5 t -98.98 107.73 21.04 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 C-N-CA 125.628 1.571 . . . . 70.32 108.987 -171.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.53 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 63.6 mt-30 -95.27 100.89 12.61 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 108.277 -1.008 . . . . 72.4 108.277 -174.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.529 HG13 HG23 ' A' ' 58' ' ' ILE . 88.4 t -93.02 104.66 15.95 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 C-N-CA 123.579 0.751 . . . . 62.24 109.382 -175.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.4 ttmm -102.91 102.27 12.34 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 107.714 -1.217 . . . . 55.32 107.714 178.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.519 HD11 HG21 ' A' ' 48' ' ' ILE . 12.4 tt -115.9 118.5 58.99 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 CA-C-O 121.157 0.503 . . . . 65.23 110.889 -174.606 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 19.8 m -97.09 102.97 14.86 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 108.879 -0.785 . . . . 75.45 108.879 178.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.616 ' SG ' HG23 ' A' ' 48' ' ' ILE . 42.2 t -120.0 125.75 49.13 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.876 1.27 . . . . 75.31 109.46 178.81 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.533 HD21 ' HB3' ' A' ' 51' ' ' LEU . 88.1 m-20 61.43 25.56 15.48 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 125.051 1.341 . . . . 71.41 112.115 -177.008 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.98 10.96 85.7 Favored Glycine 0 C--N 1.348 1.195 0 CA-C-N 115.718 -0.674 . . . . 72.45 113.467 -177.777 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -108.23 133.33 52.61 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.245 1.018 . . . . 64.44 108.982 176.041 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 49.6 m -106.24 118.03 35.58 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.072 0.549 . . . . 54.52 110.032 -173.503 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -111.56 101.96 10.33 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 107.243 -1.391 . . . . 75.25 107.243 179.279 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.416 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 14.1 pt-20 -116.95 134.51 54.66 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 122.038 -0.414 . . . . 74.32 110.46 179.249 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.8 ttt180 -155.35 141.05 18.02 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.657 -0.701 . . . . 74.13 110.075 -178.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 42.9 m -92.28 118.55 31.0 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 124.555 1.142 . . . . 63.01 110.151 178.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 89.6 m-85 -103.91 131.98 50.61 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.937 0.895 . . . . 64.43 110.332 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -91.49 110.13 21.44 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 108.814 -0.81 . . . . 71.14 108.814 -179.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 80.6 mt -118.98 112.89 20.16 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.674 0.79 . . . . 72.11 109.843 -179.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 88.0 t80 -110.2 138.79 46.1 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.619 0.767 . . . . 73.2 109.133 172.248 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.514 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -135.96 172.08 13.53 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.726 0.81 . . . . 70.51 110.075 177.644 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 24.0 t -98.01 -44.14 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 N-CA-C 108.749 -0.834 . . . . 72.13 108.749 168.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.592 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 92.9 mtt180 -116.71 158.3 24.05 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 115.464 -0.789 . . . . 72.02 110.501 178.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.437 ' HB2' HD11 ' A' ' 80' ' ' ILE . 15.9 p-10 -68.6 -29.14 67.59 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.909 0.883 . . . . 53.32 110.772 178.357 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.552 ' HA ' ' HD3' ' A' ' 34' ' ' LYS . 60.5 mm-40 -60.37 -40.87 92.35 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.488 0.715 . . . . 75.12 110.925 170.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.592 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 34.6 mm-40 -65.81 -28.16 68.79 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 116.082 -0.508 . . . . 75.11 110.601 178.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.43 -33.16 60.89 Favored 'General case' 0 CA--C 1.56 1.341 0 C-N-CA 122.917 0.487 . . . . 65.03 110.272 -179.108 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.552 ' HD3' ' HA ' ' A' ' 31' ' ' GLU . 53.3 mtpt -54.08 -55.47 27.18 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.924 0.89 . . . . 52.53 111.867 179.614 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.504 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 11.6 pt-20 -60.85 -35.98 77.98 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 115.293 -0.867 . . . . 73.3 111.384 -179.418 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.41 ' HG3' ' O ' ' A' ' 32' ' ' GLU . 64.7 mttm -66.64 -41.05 88.91 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.259 0.624 . . . . 72.41 111.127 -178.314 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.542 HD13 HD23 ' A' ' 81' ' ' LEU . 94.3 mt -62.81 -40.93 98.91 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 123.746 0.654 . . . . 61.33 110.767 174.55 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -62.12 -41.71 98.5 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 122.765 0.426 . . . . 40.05 111.02 175.304 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.504 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 72.8 mmtt -63.94 -55.45 22.46 Favored 'General case' 0 N--CA 1.478 0.961 0 O-C-N 123.415 0.447 . . . . 75.3 110.275 178.607 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 51.7 t -54.56 -46.66 72.12 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.391 0 C-N-CA 124.541 1.136 . . . . 63.12 111.524 -178.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.431 ' O ' ' HG2' ' A' ' 45' ' ' MET . 67.1 mt -68.34 -41.0 81.36 Favored 'General case' 0 C--O 1.207 -1.14 0 CA-C-O 118.751 -0.643 . . . . 74.35 110.926 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -61.91 -43.02 99.7 Favored 'General case' 0 N--CA 1.492 1.662 0 CA-C-N 118.531 0.605 . . . . 35.44 111.857 176.171 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.493 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 21.6 mm-40 -61.32 -46.32 90.75 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 109.526 -0.546 . . . . 60.35 109.526 177.586 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -67.66 -41.1 84.3 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 114.989 -1.005 . . . . 74.14 111.481 -176.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.634 ' SD ' HD11 ' A' ' 58' ' ' ILE . 92.1 mmm -79.02 -21.36 47.07 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.025 0.53 . . . . 74.23 111.183 -175.715 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.501 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 13.9 t70 -57.67 -52.4 74.65 Favored Pre-proline 0 CA--C 1.565 1.556 0 N-CA-C 112.929 0.715 . . . . 73.41 112.929 -171.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.433 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 73.3 Cg_endo -71.75 -22.97 23.16 Favored 'Trans proline' 0 C--N 1.39 2.712 0 C-N-CA 121.805 1.67 . . . . 72.34 112.204 175.089 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.616 HG23 ' SG ' ' A' ' 14' ' ' CYS . 46.9 mm -74.21 -31.67 29.87 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 C-N-CA 124.58 1.152 . . . . 74.21 110.784 -175.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.58 ' HG2' HD11 ' A' ' 108' ' ' LEU . 49.2 mtmt -73.77 -34.58 64.75 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.216 0.606 . . . . 75.13 110.021 175.003 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -65.83 -27.21 68.08 Favored 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 124.343 1.057 . . . . 53.22 109.575 174.024 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.533 ' HB3' HD21 ' A' ' 15' ' ' ASN . 83.7 mt -75.27 -39.5 59.69 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 109.617 -0.512 . . . . 54.33 109.617 173.183 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 77.63 36.49 33.23 Favored Glycine 0 C--N 1.346 1.135 0 CA-C-N 115.237 -0.892 . . . . 65.12 114.076 174.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.411 ' O ' ' HB3' ' A' ' 108' ' ' LEU . 2.0 p -71.65 119.69 16.17 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 109.55 -0.537 . . . . 75.45 109.55 171.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.404 ' HD2' ' H ' ' A' ' 54' ' ' LYS . 8.9 mptt -70.36 -25.02 63.08 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 124.105 0.962 . . . . 74.5 110.804 -170.437 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 33.0 ttp-105 -129.07 125.74 37.9 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.173 0.989 . . . . 74.21 108.354 178.148 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 15.3 m -122.17 137.08 56.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 123.419 0.687 . . . . 60.22 109.44 177.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.486 ' O ' ' HA ' ' A' ' 12' ' ' ILE . 18.3 ttm180 -111.19 104.1 12.58 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 108.532 -0.914 . . . . 53.52 108.532 172.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.634 HD11 ' SD ' ' A' ' 45' ' ' MET . 59.4 mt -98.45 105.2 16.96 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 N-CA-C 108.029 -1.1 . . . . 71.25 108.029 174.259 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 27.1 m -101.85 104.34 15.07 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 107.713 -1.217 . . . . 61.22 107.713 179.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.447 HG23 HG13 ' A' ' 8' ' ' VAL . 50.7 mt -95.14 116.03 35.53 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 C-N-CA 123.641 0.776 . . . . 72.34 109.369 -177.13 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.53 ' HB2' ' HB2' ' A' ' 9' ' ' GLN . 33.1 mtm180 -100.87 113.94 27.34 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 107.395 -1.335 . . . . 71.43 107.395 174.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.448 HG23 HG23 ' A' ' 6' ' ' VAL . 3.2 p -92.43 126.92 44.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 N-CA-C 108.129 -1.063 . . . . 75.44 108.129 -178.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 15.8 ttpp -81.94 109.36 16.22 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 109.021 -0.733 . . . . 73.1 109.021 -177.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . 0.484 ' ND1' ' HB2' ' A' ' 70' ' ' GLU . 31.6 m170 -86.0 108.52 18.26 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 124.073 0.949 . . . . 63.32 109.055 -178.629 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 13.4 m -74.98 -25.87 59.16 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.181 0.992 . . . . 63.44 112.798 -169.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -146.15 128.01 15.39 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.041 0.536 . . . . 63.05 109.695 -175.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.29 -27.51 68.67 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 113.813 1.042 . . . . 65.35 113.813 -172.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -84.86 -36.58 21.46 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 122.658 0.383 . . . . 52.23 110.822 -179.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -77.51 -28.08 51.97 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 116.093 -0.503 . . . . 63.23 112.061 -178.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.624 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 0.1 OUTLIER -70.27 -13.11 62.02 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 113.865 1.061 . . . . 64.51 113.865 -169.301 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 49.0 mtmt -67.68 -51.75 46.01 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-O 121.735 0.779 . . . . 75.23 109.162 171.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -74.9 -31.36 61.54 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.414 1.486 . . . . 75.2 110.857 -179.011 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.624 ' HB3' ' HA ' ' A' ' 70' ' ' GLU . 0.1 OUTLIER -73.65 -49.23 27.01 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.77 0.828 . . . . 73.21 110.435 -177.678 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.417 ' HB2' ' CE1' ' A' ' 64' ' ' HIS . . . -64.61 -34.24 77.8 Favored 'General case' 0 N--CA 1.483 1.223 0 O-C-N 123.591 0.557 . . . . 73.11 111.571 177.525 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 54.8 tptt -58.79 -50.9 72.21 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 124.37 1.044 . . . . 73.24 109.346 174.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.503 ' O ' HG12 ' A' ' 80' ' ' ILE . 39.3 ttmt -68.28 -39.68 82.05 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 114.377 -1.283 . . . . 70.23 110.838 -178.68 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -75.02 -22.39 58.51 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.314 1.045 . . . . 74.43 110.071 -171.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -67.13 -43.3 82.73 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 123.483 0.713 . . . . 52.54 110.616 172.423 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.15 -37.35 85.46 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 115.667 -0.697 . . . . 74.33 110.763 175.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.503 HG12 ' O ' ' A' ' 76' ' ' LYS . 43.4 mm -62.7 -47.86 90.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 123.893 0.877 . . . . 72.4 110.188 177.481 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.542 HD23 HD13 ' A' ' 37' ' ' LEU . 39.8 mt -67.71 -33.78 75.58 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.692 0.797 . . . . 74.01 111.618 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -60.88 -40.84 94.51 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.01 0.524 . . . . 74.42 110.155 -178.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 49.0 mmtm -64.95 -45.02 87.48 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.672 -0.694 . . . . 65.24 110.957 176.229 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.511 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 77.4 t -64.81 -59.75 3.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.656 0 C-N-CA 123.342 0.657 . . . . 74.44 110.302 -172.459 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.541 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 30.4 m-85 -57.79 -42.67 84.64 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.116 0.967 . . . . 64.35 112.342 -177.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -63.02 -34.61 77.94 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.21 0.604 . . . . 55.01 111.323 179.36 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -89.1 1.14 56.04 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.05 0.94 . . . . 70.14 111.672 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 37.8 mt -106.11 -26.08 11.76 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.226 0.611 . . . . 74.34 110.73 175.043 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 124.49 -9.99 8.16 Favored Glycine 0 C--N 1.345 1.072 0 CA-C-O 119.913 -0.382 . . . . 62.3 112.989 -179.253 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.541 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 70.9 m-85 -79.12 127.8 32.47 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 122.774 0.43 . . . . 71.24 110.011 177.062 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.444 HD22 ' N ' ' A' ' 91' ' ' ASN . 0.8 OUTLIER -84.36 171.02 13.02 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.796 0.838 . . . . 72.44 109.877 -179.502 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -56.77 -42.54 79.56 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.031 0.932 . . . . 74.35 111.642 178.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 30.9 t -56.23 -31.64 63.71 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.277 1.031 . . . . 54.34 112.949 178.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . 0.458 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 14.1 m120 -65.24 -32.21 73.76 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 122.662 0.385 . . . . 71.33 111.653 179.492 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 58.9 t -88.86 127.35 41.7 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 C-N-CA 124.02 0.928 . . . . 70.22 110.427 -172.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 63.5 m -143.72 122.38 12.56 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.468 0.707 . . . . 74.45 110.665 172.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 75.2 m95 -87.89 124.47 33.71 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 123.522 0.729 . . . . 72.35 111.349 177.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -120.81 91.89 3.64 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 107.955 -1.128 . . . . 71.51 107.955 169.195 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 70.69 -125.81 13.89 Favored Glycine 0 C--N 1.346 1.086 0 CA-C-N 115.79 -0.641 . . . . 64.4 112.095 -177.72 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -81.96 -6.73 59.36 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.76 0.824 . . . . 72.02 111.389 178.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 76.6 m -103.07 149.73 24.3 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.816 0.846 . . . . 73.51 109.564 -179.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.8 p -130.38 116.73 37.07 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.942 0 C-N-CA 123.975 0.91 . . . . 64.21 108.604 169.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 57.0 m -93.71 117.3 29.92 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 108.219 -1.03 . . . . 72.42 108.219 176.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.458 ' HA ' ' O ' ' A' ' 94' ' ' ASN . 89.9 t -114.57 110.97 33.99 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 C-N-CA 124.258 1.023 . . . . 71.12 108.261 177.615 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -123.59 116.16 22.68 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 109.118 -0.697 . . . . 72.13 109.118 178.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -141.15 173.74 23.14 Favored Glycine 0 C--N 1.342 0.873 0 O-C-N 123.477 0.485 . . . . 42.44 112.425 -177.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -78.84 118.69 21.12 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 122.592 0.357 . . . . 71.22 110.101 177.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.58 HD11 ' HG2' ' A' ' 49' ' ' LYS . 41.2 tp -90.44 149.25 22.32 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 108.683 -0.858 . . . . 75.52 108.683 167.062 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 70.71 9.88 6.95 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 124.701 1.2 . . . . 63.22 111.705 177.145 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -78.08 -52.29 5.37 Favored Glycine 0 C--N 1.347 1.177 0 CA-C-N 116.145 -0.48 . . . . 73.11 111.904 177.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 28.3 m -82.8 -14.37 11.97 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 C-N-CA 123.215 0.606 . . . . 62.45 111.522 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -142.65 98.05 3.22 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.933 0.893 . . . . 63.11 108.66 -174.777 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 66.6 mt -76.55 -54.19 7.04 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 123.362 0.665 . . . . 63.21 110.993 -171.526 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -79.76 96.68 6.34 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.317 0.647 . . . . 74.24 112.634 -170.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 32.9 m170 -106.98 -13.74 15.12 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.951 0.9 . . . . 75.02 110.713 172.497 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -71.38 -59.56 2.7 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 108.945 -0.761 . . . . 65.34 108.945 172.706 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 16.7 m-70 -80.81 84.88 6.23 Favored 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 108.258 -1.016 . . . . 74.13 108.258 172.24 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 54.4 t-80 -148.63 86.66 1.53 Allowed 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.347 -0.842 . . . . 72.41 109.161 178.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 35.0 m80 -146.08 33.33 1.0 Allowed 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 124.092 0.957 . . . . 52.23 109.627 173.19 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 61.2 t60 . . . . . 0 C--O 1.254 1.307 0 N-CA-C 108.85 -0.796 . . . . 74.31 108.85 176.2 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.0 mtt . . . . . 0 N--CA 1.484 1.27 0 CA-C-O 120.402 0.144 . . . . 72.23 110.9 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.5 m -82.21 113.07 19.79 Favored 'General case' 0 C--N 1.355 0.811 0 C-N-CA 123.347 0.659 . . . . 75.14 109.962 176.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 172.44 112.31 0.28 Allowed Glycine 0 C--N 1.343 0.917 0 N-CA-C 111.57 -0.612 . . . . 74.23 111.57 -179.582 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -108.54 128.59 54.94 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.738 0.815 . . . . 62.31 110.741 178.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.404 ' HA ' ' HA ' ' A' ' 26' ' ' TYR . 0.9 OUTLIER -90.42 103.32 16.02 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 107.598 -1.26 . . . . 71.44 107.598 167.06 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.5 p -99.68 142.09 15.81 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 123.987 0.915 . . . . 72.14 109.238 177.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.561 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 34.1 mt-10 -109.67 113.85 26.96 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 108.034 -1.099 . . . . 74.33 108.034 176.043 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 90.1 t -99.25 110.6 26.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 C-N-CA 124.516 1.126 . . . . 52.11 109.998 -171.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.531 ' O ' ' HA ' ' A' ' 60' ' ' ILE . 77.8 mt-30 -82.43 99.74 9.61 Favored 'General case' 0 C--N 1.347 0.474 0 N-CA-C 107.67 -1.233 . . . . 72.04 107.67 178.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 64.0 t -93.38 114.48 30.18 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 N-CA-C 107.237 -1.394 . . . . 52.2 107.237 173.787 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.7 ttpm? -122.35 103.89 9.04 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 107.818 -1.178 . . . . 74.42 107.818 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 14.1 tt -122.33 125.69 73.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 122.759 0.424 . . . . 73.31 110.542 -174.333 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 51.4 m -102.2 116.54 32.87 Favored 'General case' 0 C--O 1.241 0.657 0 C-N-CA 123.83 0.852 . . . . 75.15 109.569 176.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 54.1 t -138.89 135.15 34.17 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 124.16 0.984 . . . . 74.43 109.5 175.654 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.488 ' HB2' ' HB3' ' A' ' 51' ' ' LEU . 67.0 t30 70.22 30.29 3.46 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 124.836 1.254 . . . . 72.23 110.959 175.079 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 83.65 -7.27 69.98 Favored Glycine 0 C--N 1.353 1.487 0 CA-C-N 115.588 -0.733 . . . . 71.02 113.231 -178.053 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 44.9 mtpt -105.4 131.08 53.28 Favored 'General case' 0 C--N 1.348 0.516 0 C-N-CA 123.954 0.902 . . . . 72.52 110.252 -173.085 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 85.8 m -95.34 131.45 41.42 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 108.696 -0.853 . . . . 71.23 108.696 174.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -115.93 144.58 43.86 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 107.046 -1.465 . . . . 75.31 107.046 171.739 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -148.81 130.89 15.36 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 123.105 0.562 . . . . 75.51 109.798 175.358 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 69.9 ttt180 -154.33 134.85 13.46 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 108.471 -0.936 . . . . 72.41 108.471 178.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.411 HG22 ' HB3' ' A' ' 7' ' ' GLU . 16.6 m -101.47 116.82 33.64 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 123.66 0.784 . . . . 74.12 109.808 179.109 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 -97.65 128.71 44.55 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.22 1.008 . . . . 72.41 110.477 -173.362 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.498 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 25.2 mp0 -90.12 108.35 19.68 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 108.029 -1.1 . . . . 73.42 108.029 -178.136 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.471 HD11 HG21 ' A' ' 40' ' ' VAL . 89.8 mt -121.92 110.11 15.45 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.623 1.169 . . . . 74.43 108.921 -174.104 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.433 ' O ' ' HE3' ' A' ' 36' ' ' LYS . 82.3 t80 -92.53 134.58 34.84 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 122.732 0.413 . . . . 72.32 109.977 173.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.554 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -146.65 148.66 32.29 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.415 0.686 . . . . 75.11 110.65 177.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 88.5 t -76.38 -56.83 7.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 123.884 0.873 . . . . 75.3 109.56 175.346 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.554 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 94.5 mtt180 -102.32 164.97 11.38 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 115.534 -0.757 . . . . 72.41 110.012 175.618 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -69.72 -27.07 64.67 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 123.147 0.579 . . . . 53.01 110.636 170.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -62.34 -35.2 78.37 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.242 1.017 . . . . 53.22 111.147 176.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.554 ' HB2' ' HB1' ' A' ' 27' ' ' ALA . 13.5 mm-40 -70.51 -29.92 66.56 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.358 -0.837 . . . . 71.13 110.135 -178.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.75 HD22 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -75.69 -22.01 57.05 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.107 0.563 . . . . 72.45 110.741 -178.032 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.513 ' HG2' HG23 ' A' ' 80' ' ' ILE . 53.8 mtpt -57.19 -55.83 29.64 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 122.979 0.512 . . . . 64.13 111.13 179.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.503 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 2.4 pp20? -61.96 -30.11 70.7 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 115.648 -0.705 . . . . 74.12 112.14 179.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.75 ' HD2' HD22 ' A' ' 33' ' ' LEU . 64.3 mttm -70.39 -40.35 74.0 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.197 0.599 . . . . 75.33 110.857 179.454 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.564 HD13 HD23 ' A' ' 81' ' ' LEU . 95.7 mt -62.11 -39.69 93.37 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 123.73 0.643 . . . . 53.33 110.803 174.157 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -64.26 -37.68 88.36 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 122.997 0.519 . . . . 62.24 111.479 175.238 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.503 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 45.0 mmtm -62.88 -55.66 24.18 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 110.054 -0.35 . . . . 73.05 110.054 174.69 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.471 HG21 HD11 ' A' ' 25' ' ' LEU . 55.2 t -54.66 -49.22 69.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 124.808 1.243 . . . . 75.03 111.711 -178.542 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 40.5 mt -66.32 -45.59 79.78 Favored 'General case' 0 C--O 1.215 -0.712 0 C-N-CA 123.293 0.637 . . . . 73.11 111.601 -176.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -65.91 -42.16 90.54 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 112.247 0.462 . . . . 72.43 112.247 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.7 mm-40 -63.13 -50.82 68.94 Favored 'General case' 0 N--CA 1.486 1.344 0 CA-C-O 121.28 0.562 . . . . 52.44 110.634 177.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 15.4 tpt180 -63.7 -41.84 98.06 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.512 1.125 . . . . 73.3 111.37 -177.796 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.501 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 58.0 mtp -92.23 8.21 39.18 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.682 0.623 . . . . 74.41 112.682 -174.733 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -73.42 -51.2 5.76 Favored Pre-proline 0 CA--C 1.559 1.295 0 CA-C-O 118.447 -0.787 . . . . 75.44 111.565 174.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -69.4 -16.6 39.19 Favored 'Trans proline' 0 C--N 1.389 2.674 0 C-N-CA 121.452 1.435 . . . . 75.11 111.894 174.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.536 HG22 HD11 ' A' ' 108' ' ' LEU . 48.7 mm -72.58 -32.69 42.35 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.132 0 C-N-CA 124.42 1.088 . . . . 73.11 110.309 176.087 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.501 ' HG3' ' O ' ' A' ' 45' ' ' MET . 55.1 mttp -62.3 -41.33 98.41 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 109.387 -0.597 . . . . 73.14 109.387 171.304 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.7 tmmm? -65.58 -32.55 74.2 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.175 0.99 . . . . 43.51 110.993 178.254 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.488 ' HB3' ' HB2' ' A' ' 15' ' ' ASN . 83.6 mt -70.47 -30.73 67.61 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 110.106 -0.331 . . . . 74.12 110.106 175.352 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 71.81 56.75 6.31 Favored Glycine 0 C--N 1.348 1.24 0 O-C-N 124.014 0.821 . . . . 52.1 113.448 170.055 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.435 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 89.4 m -88.72 125.54 34.91 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 122.674 0.39 . . . . 62.02 111.303 177.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 53.5 tptt -59.91 -39.38 85.23 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.475 1.11 . . . . 72.2 110.256 170.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 25.3 ttm180 -139.85 136.44 33.98 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 109.303 -0.629 . . . . 75.0 109.303 174.306 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 15.5 m -114.3 144.2 22.39 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 C-N-CA 124.087 0.955 . . . . 63.2 109.241 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.533 ' NH1' ' HG2' ' A' ' 105' ' ' GLU . 23.3 tpp180 -100.25 103.64 15.09 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 107.52 -1.289 . . . . 74.23 107.52 175.04 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 59.6 mt -100.06 133.26 43.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 N-CA-C 107.718 -1.215 . . . . 74.23 107.718 177.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 36.5 t -137.5 102.72 4.85 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 107.529 -1.285 . . . . 72.13 107.529 -176.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.531 ' HA ' ' O ' ' A' ' 9' ' ' GLN . 45.0 mt -115.86 114.28 45.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 C-N-CA 123.214 0.606 . . . . 72.32 111.061 -172.299 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 80.0 ttt180 -105.74 140.44 38.79 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 109.079 -0.712 . . . . 65.12 109.079 176.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.1 p -94.86 141.41 15.07 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 N-CA-C 109.227 -0.657 . . . . 60.25 109.227 178.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.561 ' HB3' ' H ' ' A' ' 7' ' ' GLU . 5.3 tppp? -90.09 123.57 34.07 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 107.045 -1.465 . . . . 74.55 107.045 165.781 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 16.4 p80 -92.02 146.01 24.08 Favored 'General case' 0 C--O 1.238 0.498 0 O-C-N 123.722 0.639 . . . . 64.11 110.963 -179.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 27.7 m -84.49 -50.03 8.11 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 115.346 -0.843 . . . . 74.24 110.955 -176.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -93.06 -175.75 3.96 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.308 0.643 . . . . 73.51 111.266 179.28 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -114.56 -35.19 4.97 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.07 0.948 . . . . 54.02 111.086 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -89.0 -55.53 3.65 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.134 0.573 . . . . 72.32 111.146 174.15 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.0 mp0 -64.49 -17.88 64.27 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 125.072 1.349 . . . . 72.43 112.436 -171.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.569 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 0.6 OUTLIER -69.41 -22.34 63.69 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.272 1.029 . . . . 75.12 113.744 -174.701 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -69.01 -30.84 69.31 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.582 0.753 . . . . 72.14 109.513 177.432 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -83.14 -40.32 19.9 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.27 1.028 . . . . 62.14 110.102 172.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.569 ' HB3' ' HA ' ' A' ' 70' ' ' GLU . 44.2 tt0 -65.77 -30.26 70.88 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.955 0.902 . . . . 74.13 111.853 -176.164 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.56 -45.3 75.99 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.041 0.536 . . . . 75.34 110.314 176.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.91 -30.27 67.64 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 123.907 0.754 . . . . 72.1 111.958 176.386 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.419 ' O ' HG12 ' A' ' 80' ' ' ILE . 34.9 ttmt -65.88 -47.14 75.88 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.693 0.797 . . . . 72.12 109.383 174.624 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -73.66 -21.91 60.13 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 114.633 -1.167 . . . . 73.44 109.914 -179.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -66.55 -42.93 86.39 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 123.928 0.891 . . . . 72.31 110.639 173.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.18 -38.43 91.02 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 123.798 0.686 . . . . 72.4 110.382 175.454 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.513 HG23 ' HG2' ' A' ' 34' ' ' LYS . 36.7 mm -65.5 -44.14 94.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 124.272 1.029 . . . . 71.4 111.055 177.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.564 HD23 HD13 ' A' ' 37' ' ' LEU . 35.9 mt -64.54 -45.0 89.04 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.181 0.592 . . . . 74.4 110.088 177.399 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -59.88 -42.29 93.42 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.681 0.792 . . . . 74.23 110.694 -176.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -61.02 -49.57 76.88 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 124.081 0.863 . . . . 71.04 111.073 176.419 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 55.9 t -61.69 -51.01 77.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 123.539 0.736 . . . . 75.41 110.916 -175.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.458 ' HZ ' HD12 ' A' ' 60' ' ' ILE . 35.4 m-85 -59.04 -44.04 91.73 Favored 'General case' 0 N--CA 1.477 0.882 0 O-C-N 124.021 0.825 . . . . 73.5 111.217 179.171 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.53 -32.56 74.26 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.049 0.54 . . . . 75.34 111.681 179.162 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -85.04 -6.46 59.32 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.748 0.819 . . . . 73.52 111.755 -179.313 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 86.1 mt -104.03 -15.54 15.56 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.388 0.675 . . . . 72.45 110.517 176.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 106.98 20.9 8.44 Favored Glycine 0 C--N 1.345 1.052 0 CA-C-N 116.111 -0.495 . . . . 30.43 113.676 175.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.452 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 95.8 m-85 -88.37 129.05 35.5 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 109.277 -0.638 . . . . 62.15 109.277 169.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -77.23 161.29 28.26 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.435 1.094 . . . . 74.14 109.653 -178.048 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -59.06 -38.95 80.62 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 124.18 0.992 . . . . 72.03 111.458 175.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 8.1 t -77.87 9.36 3.62 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 124.089 0.956 . . . . 72.14 112.503 176.531 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -101.94 -23.33 14.15 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.275 0.63 . . . . 64.21 110.701 168.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 59.6 t -108.78 121.37 61.74 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 C-N-CA 124.038 0.935 . . . . 70.21 110.433 -172.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.9 m -146.06 128.85 16.29 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.996 0.918 . . . . 74.25 109.552 171.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.418 ' HA ' ' HA ' ' A' ' 102' ' ' VAL . 33.7 m95 -73.09 152.73 41.1 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-O 121.468 0.651 . . . . 73.43 111.804 177.214 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -139.45 78.31 1.66 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.953 1.301 . . . . 71.45 107.555 176.241 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 63.92 -98.98 0.27 Allowed Glycine 0 C--N 1.345 1.074 0 CA-C-N 114.974 -1.012 . . . . 32.44 113.602 179.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -84.24 -25.72 29.22 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.648 0.779 . . . . 72.33 112.006 -177.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 28.7 m -125.33 138.04 54.06 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.504 0.722 . . . . 73.02 110.282 -168.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.418 ' HA ' ' HA ' ' A' ' 97' ' ' TRP . 12.2 p -91.59 137.04 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.009 0 N-CA-C 109.489 -0.56 . . . . 52.35 109.489 176.676 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 27.1 m -102.18 106.45 17.29 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.616 1.166 . . . . 74.31 108.266 177.227 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 70.2 t -118.08 112.23 37.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 N-CA-C 108.323 -0.992 . . . . 62.04 108.323 -179.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.533 ' HG2' ' NH1' ' A' ' 57' ' ' ARG . 0.1 OUTLIER -140.92 140.11 34.43 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 122.695 0.398 . . . . 75.24 110.087 178.82 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 160.88 -150.07 19.66 Favored Glycine 0 C--O 1.241 0.59 0 N-CA-C 111.098 -0.801 . . . . 71.14 111.098 -172.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -64.98 143.2 58.11 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 123.587 0.755 . . . . 63.13 112.262 -175.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.536 HD11 HG22 ' A' ' 48' ' ' ILE . 2.0 tt -92.17 128.15 37.91 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 107.427 -1.323 . . . . 74.23 107.427 174.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.466 ' O ' ' HE3' ' A' ' 49' ' ' LYS . 10.5 tp10 -73.58 92.1 1.9 Allowed 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 107.922 -1.14 . . . . 61.4 107.922 167.608 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . 0.468 ' HA2' HD12 ' A' ' 113' ' ' LEU . . . 145.23 34.25 0.07 OUTLIER Glycine 0 C--N 1.339 0.735 0 CA-C-N 115.404 -0.816 . . . . 54.23 112.216 -176.739 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 44.7 t -73.34 99.56 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 N-CA-C 109.253 -0.647 . . . . 73.44 109.253 178.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 34.2 t70 62.7 17.3 9.66 Favored 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 124.769 1.228 . . . . 63.33 112.065 172.362 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.468 HD12 ' HA2' ' A' ' 110' ' ' GLY . 87.3 mt -73.82 130.7 40.46 Favored 'General case' 0 C--N 1.353 0.749 0 C-N-CA 122.984 0.513 . . . . 73.53 110.081 -179.472 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.16 167.74 13.58 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 123.476 0.711 . . . . 71.12 110.863 172.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 31.4 m170 73.55 0.03 3.52 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 125.483 1.513 . . . . 70.2 113.824 176.03 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 6.5 p-80 -67.91 -32.08 72.31 Favored 'General case' 0 N--CA 1.493 1.713 0 N-CA-C 108.944 -0.762 . . . . 72.02 108.944 170.058 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 31.0 t60 -73.45 82.43 1.45 Allowed 'General case' 0 C--N 1.357 0.903 0 N-CA-C 106.602 -1.629 . . . . 72.33 106.602 168.039 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 14.7 p-80 -83.15 144.53 29.77 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 114.435 -1.257 . . . . 63.12 111.46 -171.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 15.6 p80 -98.23 9.47 42.91 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.697 0.799 . . . . 74.43 110.105 172.218 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 46.8 t-80 . . . . . 0 CA--C 1.556 1.185 0 C-N-CA 124.372 1.069 . . . . 73.04 109.789 171.596 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.8 mmm . . . . . 0 N--CA 1.478 0.944 0 N-CA-C 109.477 -0.564 . . . . 72.23 109.477 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.1 t -153.8 74.83 1.01 Allowed 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 107.31 -1.367 . . . . 73.44 107.31 178.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -166.46 64.07 0.21 Allowed Glycine 0 C--N 1.334 0.455 0 N-CA-C 109.077 -1.609 . . . . 73.1 109.077 178.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 33.6 tptt -90.54 148.24 22.84 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.499 0.72 . . . . 64.32 111.378 -166.04 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.439 ' HB2' ' HD1' ' A' ' 26' ' ' TYR . 34.8 ttpt -127.27 107.32 9.89 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 109.072 -0.714 . . . . 51.42 109.072 174.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.1 p -100.69 143.97 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 N-CA-C 108.993 -0.743 . . . . 53.12 108.993 173.363 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.409 ' H ' ' HB3' ' A' ' 63' ' ' LYS . 42.3 mt-10 -113.63 115.09 27.35 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 109.332 -0.618 . . . . 71.42 109.332 177.738 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 73.1 t -105.59 115.71 47.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 124.944 1.298 . . . . 73.32 110.062 -168.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.412 ' O ' ' HA ' ' A' ' 60' ' ' ILE . 38.7 mt-30 -97.08 99.59 11.09 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 108.576 -0.898 . . . . 62.33 108.576 -177.043 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.424 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 67.1 t -95.48 109.08 21.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 N-CA-C 109.092 -0.707 . . . . 61.41 109.092 -177.594 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.518 ' HE2' ' HB2' ' A' ' 59' ' ' SER . 35.6 ttpt -110.15 105.28 14.3 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 108.436 -0.95 . . . . 74.14 108.436 177.732 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.412 HD11 HG21 ' A' ' 48' ' ' ILE . 10.9 tt -118.15 123.71 72.03 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 122.983 0.513 . . . . 70.14 111.015 -174.61 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 41.8 m -95.99 110.82 22.98 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 123.259 0.624 . . . . 63.45 109.425 176.216 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.644 ' SG ' HG23 ' A' ' 48' ' ' ILE . 8.9 t -145.78 132.63 20.1 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.504 1.122 . . . . 75.41 110.185 179.655 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 62.78 35.22 13.96 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 124.479 1.111 . . . . 73.54 110.499 174.024 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.88 12.12 78.6 Favored Glycine 0 C--N 1.351 1.37 0 CA-C-N 115.255 -0.884 . . . . 60.14 114.234 177.089 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.51 ' HE2' ' HA ' ' A' ' 17' ' ' LYS . 8.0 mmpt? -125.23 142.23 51.62 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.567 0.747 . . . . 64.11 109.847 175.096 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 88.3 m -110.89 118.53 36.37 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 109.007 -0.738 . . . . 61.44 109.007 178.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.415 ' HB3' ' NH1' ' A' ' 44' ' ' ARG . 13.5 m-85 -108.06 109.76 21.28 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.525 1.13 . . . . 73.42 108.026 -172.681 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.478 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 1.7 pp20? -127.52 142.02 51.5 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 122.455 0.302 . . . . 64.15 111.46 -178.8 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 58.2 ttt180 -168.32 143.17 3.48 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.868 0.867 . . . . 70.24 109.553 178.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 23.9 m -89.79 118.16 29.18 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.347 1.059 . . . . 63.03 109.391 173.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -101.87 135.49 43.33 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.813 0.845 . . . . 65.21 109.729 -179.043 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -91.68 107.63 19.35 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 107.514 -1.291 . . . . 74.33 107.514 179.233 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.508 HD21 HG21 ' A' ' 40' ' ' VAL . 70.6 mt -111.14 99.4 8.25 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 109.076 -0.713 . . . . 73.34 109.076 -178.789 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.439 ' HD1' ' HB2' ' A' ' 5' ' ' LYS . 52.7 t80 -93.28 144.3 25.44 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.652 0.781 . . . . 54.22 109.571 177.343 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.571 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -158.26 160.62 37.28 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.186 0.995 . . . . 70.31 109.316 -179.012 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 56.4 t -75.85 -65.78 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 N-CA-C 108.308 -0.997 . . . . 72.14 108.308 170.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.527 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 97.8 mtt180 -96.03 162.18 13.66 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-O 121.064 0.459 . . . . 74.13 110.556 175.258 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 18.6 p-10 -69.96 -26.74 64.25 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.114 0.966 . . . . 60.04 111.222 174.229 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -69.1 -25.22 64.3 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 122.915 0.486 . . . . 71.41 111.438 175.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.571 ' HB2' ' HB1' ' A' ' 27' ' ' ALA . 11.5 mm-40 -70.77 -30.84 67.43 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.226 0.611 . . . . 75.54 109.997 177.319 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.465 HD22 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -66.19 -23.84 66.52 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 124.388 1.075 . . . . 75.04 110.97 -178.887 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -54.95 -58.66 6.7 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.661 0.784 . . . . 65.31 111.906 -178.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.8 pp20? -65.69 -25.94 67.55 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 122.52 0.328 . . . . 71.53 111.783 -178.122 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.465 ' HD2' HD22 ' A' ' 33' ' ' LEU . 59.5 mttm -69.42 -41.91 75.73 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.331 0.652 . . . . 71.43 110.637 177.175 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.521 HD13 HD23 ' A' ' 81' ' ' LEU . 84.8 mt -61.79 -44.07 97.6 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 123.909 0.755 . . . . 74.12 110.578 173.443 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -56.79 -42.14 78.95 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 122.931 0.493 . . . . 72.43 110.822 176.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -62.78 -61.78 2.17 Favored 'General case' 0 C--O 1.218 -0.593 0 O-C-N 123.98 0.8 . . . . 74.22 110.743 177.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.508 HG21 HD21 ' A' ' 25' ' ' LEU . 99.1 t -60.04 -37.84 74.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 123.363 0.665 . . . . 64.44 111.763 -173.416 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.457 HD21 HD11 ' A' ' 60' ' ' ILE . 48.9 mt -71.63 -47.71 52.7 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.326 0.65 . . . . 73.55 111.362 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -70.01 -32.24 70.31 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 122.906 0.482 . . . . 74.34 110.923 -177.18 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -82.38 -34.58 28.32 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.112 0.965 . . . . 74.32 110.686 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.415 ' NH1' ' HB3' ' A' ' 19' ' ' TYR . 5.4 tpm_? -60.09 -44.52 94.75 Favored 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 108.956 -0.757 . . . . 71.15 108.956 169.276 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.494 ' HA ' ' HB ' ' A' ' 48' ' ' ILE . 68.7 mtp -88.67 1.04 55.8 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-N 114.465 -1.243 . . . . 75.34 112.531 -178.469 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -65.54 -50.5 56.51 Favored Pre-proline 0 N--CA 1.483 1.199 0 CA-C-N 119.191 0.905 . . . . 71.21 111.15 178.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.53 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 57.5 Cg_endo -68.28 -23.15 39.02 Favored 'Trans proline' 0 C--N 1.388 2.613 0 C-N-CA 121.634 1.556 . . . . 54.52 111.707 172.198 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.644 HG23 ' SG ' ' A' ' 14' ' ' CYS . 47.5 mm -75.5 -34.92 30.87 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.034 0 C-N-CA 124.379 1.072 . . . . 70.13 110.509 -177.03 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' A' ' 45' ' ' MET . 35.7 mtmm -82.8 -12.17 57.69 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.494 0.717 . . . . 71.44 109.951 177.59 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -80.57 -33.06 36.41 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.24 1.016 . . . . 73.35 109.586 164.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 95.7 mt -73.26 -28.45 62.14 Favored 'General case' 0 N--CA 1.484 1.245 0 N-CA-C 109.759 -0.46 . . . . 52.43 109.759 178.566 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 67.65 32.58 78.67 Favored Glycine 0 C--N 1.354 1.529 0 CA-C-N 115.645 -0.707 . . . . 71.34 113.514 173.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.421 ' SG ' HG23 ' A' ' 48' ' ' ILE . 1.6 p -67.8 110.32 3.75 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 109.471 -0.566 . . . . 74.31 109.471 176.137 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.692 ' HE2' ' HG3' ' A' ' 109' ' ' GLU . 6.9 mtpm? -62.38 -20.42 64.4 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.527 1.131 . . . . 72.21 112.788 -171.758 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 43.4 ttp180 -136.4 131.08 33.7 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 108.585 -0.894 . . . . 74.22 108.585 173.033 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 35.6 m -124.49 136.88 59.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 109.11 -0.7 . . . . 71.41 109.11 173.222 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 54.9 ttt180 -106.69 105.38 15.38 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 108.184 -1.043 . . . . 73.31 108.184 177.057 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.41 HG22 HG13 ' A' ' 60' ' ' ILE . 32.8 mt -107.43 104.15 16.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 123.259 0.623 . . . . 40.11 109.435 -175.791 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.518 ' HB2' ' HE2' ' A' ' 11' ' ' LYS . 20.3 m -97.78 104.6 16.64 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 108.347 -0.983 . . . . 64.22 108.347 175.545 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.493 ' HB ' HG13 ' A' ' 102' ' ' VAL . 85.8 mt -97.71 110.24 25.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 123.831 0.852 . . . . 52.33 109.719 -179.782 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 27.7 mtm105 -98.38 107.72 20.25 Favored 'General case' 0 C--O 1.237 0.442 0 N-CA-C 107.05 -1.463 . . . . 74.13 107.05 175.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 9.1 p -94.61 137.18 23.76 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 N-CA-C 109.125 -0.695 . . . . 72.13 109.125 -171.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.409 ' HB3' ' H ' ' A' ' 7' ' ' GLU . 34.5 ttmt -82.37 118.74 23.4 Favored 'General case' 0 C--N 1.35 0.624 0 N-CA-C 109.527 -0.546 . . . . 71.22 109.527 -176.216 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 50.9 m80 -83.74 150.49 25.78 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 124.634 1.174 . . . . 73.45 108.922 177.497 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 29.7 t -65.68 -52.66 49.79 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 123.525 0.516 . . . . 74.32 112.05 -172.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.608 ' H ' ' HB2' ' A' ' 69' ' ' GLU . 15.2 m-20 -140.84 -175.9 4.47 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 124.242 1.017 . . . . 71.33 108.949 -174.11 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.8 -54.13 15.03 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.646 0.778 . . . . 73.32 111.687 -178.044 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.21 -23.36 62.0 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 122.926 0.49 . . . . 51.11 110.406 175.086 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.608 ' HB2' ' H ' ' A' ' 66' ' ' ASP . 24.9 mm-40 -76.56 -11.02 59.8 Favored 'General case' 0 C--O 1.211 -0.922 0 CA-C-O 118.755 -0.641 . . . . 71.5 112.51 174.49 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -57.17 -51.63 68.54 Favored 'General case' 0 N--CA 1.488 1.46 0 CA-C-N 119.241 0.928 . . . . 74.14 110.971 173.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -71.89 -30.74 65.71 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.087 0.555 . . . . 73.44 111.244 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 4.5 tppp? -67.32 -60.61 2.45 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.324 0.65 . . . . 64.23 109.581 178.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -67.0 -15.2 63.58 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.573 1.149 . . . . 73.31 112.164 178.557 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.36 -62.45 1.67 Allowed 'General case' 0 C--N 1.351 0.671 0 CA-C-N 118.882 0.764 . . . . 74.02 109.856 172.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -69.04 -40.11 78.78 Favored 'General case' 0 CA--C 1.55 0.963 0 O-C-N 124.171 0.919 . . . . 63.43 111.68 -179.318 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 48.3 tttm -67.29 -50.8 58.88 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.907 0.883 . . . . 73.13 111.95 -176.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -75.45 -20.27 58.94 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 110.127 -0.323 . . . . 74.35 110.127 177.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.92 -37.93 74.98 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 122.588 0.355 . . . . 62.34 111.168 171.44 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.489 ' O ' ' HG2' ' A' ' 83' ' ' LYS . . . -63.77 -45.87 87.84 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.227 0.611 . . . . 53.01 110.665 175.762 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.468 ' O ' HG23 ' A' ' 84' ' ' VAL . 49.4 mm -61.35 -45.61 98.26 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 C-N-CA 123.914 0.885 . . . . 61.11 110.325 -178.748 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.547 HD13 HG11 ' A' ' 102' ' ' VAL . 35.8 mt -69.58 -41.82 75.32 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.66 0.784 . . . . 75.25 111.39 178.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -56.31 -43.22 78.74 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 124.331 1.052 . . . . 61.41 110.624 -176.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.489 ' HG2' ' O ' ' A' ' 79' ' ' ALA . 33.6 mmtp -68.14 -42.23 80.47 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 114.67 -1.15 . . . . 73.31 110.758 179.734 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 80' ' ' ILE . 51.1 t -64.34 -47.95 87.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 C-N-CA 123.544 0.738 . . . . 73.12 110.468 -176.097 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.55 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 25.6 m-85 -61.13 -41.36 96.58 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.28 -0.873 . . . . 74.04 110.437 177.224 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.66 -25.39 66.54 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.494 0.718 . . . . 70.43 111.825 176.397 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -86.11 -9.69 56.22 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 124.018 0.927 . . . . 75.35 111.2 176.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 94.5 mt -106.1 -25.17 12.15 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.221 0.608 . . . . 63.43 111.023 -178.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 116.34 17.09 6.29 Favored Glycine 0 N--CA 1.475 1.29 0 C-N-CA 122.945 0.307 . . . . 53.13 113.696 177.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.55 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 10.3 m-85 -104.14 125.72 50.68 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 107.986 -1.116 . . . . 74.21 107.986 173.159 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -123.71 97.89 5.58 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 122.929 0.491 . . . . 62.21 110.833 -170.308 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 64.19 -72.09 0.06 Allowed 'General case' 0 N--CA 1.494 1.765 0 C-N-CA 125.254 1.422 . . . . 55.33 114.176 164.51 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 14.6 m -57.08 -30.45 64.32 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 125.068 1.347 . . . . 64.32 112.502 -178.051 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . 0.412 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 10.7 m120 -66.1 -39.73 90.2 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.483 0.713 . . . . 75.22 111.008 176.476 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.416 ' HA ' HG22 ' A' ' 104' ' ' VAL . 47.6 t -93.02 106.99 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 124.999 1.32 . . . . 75.03 110.276 -167.619 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 44.5 m -123.93 126.66 46.73 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 122.996 0.518 . . . . 65.54 110.22 178.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 55.1 m95 -89.84 147.16 23.94 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 122.968 0.507 . . . . 74.15 110.491 174.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -156.86 98.15 1.75 Allowed 'General case' 0 CA--C 1.554 1.109 0 C-N-CA 124.658 1.183 . . . . 65.03 109.166 -177.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 77.54 -99.78 1.5 Allowed Glycine 0 C--N 1.35 1.324 0 CA-C-N 115.36 -0.836 . . . . 64.15 112.979 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -110.86 -7.3 14.6 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 124.409 1.084 . . . . 71.31 110.153 177.052 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 22.0 m -103.45 153.68 20.25 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.188 1.395 . . . . 74.42 110.659 -168.417 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.547 HG11 HD13 ' A' ' 81' ' ' LEU . 2.7 p -128.9 104.62 11.63 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.877 0 C-N-CA 124.323 1.049 . . . . 75.52 108.627 167.238 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 24.3 m -91.97 104.92 17.28 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.646 0.778 . . . . 73.34 108.937 -178.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.416 HG22 ' HA ' ' A' ' 95' ' ' VAL . 53.1 t -102.01 121.99 53.68 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 C-N-CA 124.825 1.25 . . . . 74.15 109.485 179.573 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -89.03 126.27 35.36 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 108.77 -0.826 . . . . 63.52 108.77 172.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -106.27 154.83 16.81 Favored Glycine 0 N--CA 1.468 0.789 0 N-CA-C 111.131 -0.788 . . . . 65.45 111.131 173.612 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -136.28 120.38 17.71 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.431 0.692 . . . . 75.42 109.584 178.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.464 ' O ' ' HA ' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -157.19 132.87 9.31 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.459 0.704 . . . . 50.44 109.647 172.404 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.692 ' HG3' ' HE2' ' A' ' 54' ' ' LYS . 2.3 mp0 -74.95 -47.48 29.34 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.777 0.831 . . . . 73.02 108.907 176.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 172.73 90.52 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.55 0 CA-C-N 114.316 -1.311 . . . . 62.23 110.07 178.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 30.8 m -66.31 156.76 6.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 122.977 0.511 . . . . 74.31 110.789 -178.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -75.51 91.45 2.8 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 115.935 -0.575 . . . . 75.21 109.978 -178.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 67.5 mt -71.2 92.99 1.04 Allowed 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 107.932 -1.136 . . . . 75.34 107.932 171.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.09 -60.59 3.51 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.772 1.229 . . . . 62.45 112.119 -173.425 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 66.7 m80 -161.39 143.2 11.75 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.032 1.333 . . . . 73.42 107.978 -174.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 42.5 m80 -95.39 143.35 26.82 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 108.561 -0.903 . . . . 75.52 108.561 172.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 62.9 t60 -127.42 153.72 45.92 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.201 0.601 . . . . 73.23 109.891 -175.067 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 45.8 m170 -56.45 107.39 0.37 Allowed 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.947 0.899 . . . . 73.01 110.155 175.48 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 28.4 p-80 -65.57 141.25 58.5 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 123.828 0.705 . . . . 61.12 110.136 -179.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 21.9 m80 . . . . . 0 CA--C 1.549 0.937 0 N-CA-C 108.668 -0.864 . . . . 73.23 108.668 178.338 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.877 0 N-CA-C 107.842 -1.17 . . . . 72.33 107.842 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.2 t -85.96 -9.11 57.43 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.934 0.894 . . . . 54.22 112.089 -174.758 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -76.83 74.91 1.75 Allowed Glycine 0 C--N 1.348 1.218 0 O-C-N 123.288 0.368 . . . . 72.54 113.435 -177.259 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.06 173.73 6.2 Favored 'General case' 0 C--O 1.243 0.737 0 C-N-CA 123.925 0.89 . . . . 71.15 108.698 171.428 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.41 ' HD2' ' HB3' ' A' ' 24' ' ' GLN . 38.4 ttpt -89.78 111.88 23.02 Favored 'General case' 0 C--O 1.241 0.655 0 N-CA-C 109.406 -0.59 . . . . 75.14 109.406 179.321 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.68 HG21 HG13 ' A' ' 62' ' ' VAL . 3.9 p -98.34 142.87 13.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 N-CA-C 107.927 -1.138 . . . . 74.21 107.927 174.149 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.42 ' HG2' ' HG3' ' A' ' 24' ' ' GLN . 44.6 mt-10 -105.52 109.95 22.1 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 107.427 -1.323 . . . . 73.14 107.427 176.265 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 73.2 t -99.16 113.26 33.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 114.355 -1.293 . . . . 70.43 108.705 -173.708 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.454 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 46.8 mt-30 -104.35 99.92 9.63 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 108.57 -0.9 . . . . 52.1 108.57 -176.159 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.441 HG22 HG12 ' A' ' 60' ' ' ILE . 74.9 t -95.18 108.48 20.97 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 N-CA-C 108.591 -0.892 . . . . 63.25 108.591 -178.227 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.44 ' HE2' ' HB2' ' A' ' 59' ' ' SER . 36.2 ttpt -109.9 107.27 17.15 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.278 -0.874 . . . . 74.4 108.984 -174.17 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.445 HD13 HG13 ' A' ' 48' ' ' ILE . 14.8 tt -123.55 116.52 48.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 123.086 0.554 . . . . 75.01 110.126 -177.136 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 93.1 m -94.15 124.28 38.07 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 109.568 -0.53 . . . . 72.0 109.568 178.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.436 ' SG ' HG23 ' A' ' 48' ' ' ILE . 47.6 t -150.6 151.56 32.75 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.626 1.17 . . . . 52.12 109.138 -178.171 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 36.1 t30 69.97 -78.23 0.05 OUTLIER 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 124.89 1.276 . . . . 74.55 109.798 -176.674 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -165.19 11.69 0.08 OUTLIER Glycine 0 N--CA 1.462 0.431 0 CA-C-N 115.487 -0.779 . . . . 51.11 111.293 174.176 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -123.19 156.79 34.39 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.231 1.012 . . . . 74.2 110.45 -173.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 93.6 m -103.22 111.9 24.5 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.318 1.047 . . . . 62.23 109.023 175.101 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 52.8 m-85 -100.46 101.14 12.01 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 108.078 -1.082 . . . . 71.25 108.078 -177.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -134.32 156.16 48.96 Favored 'General case' 0 C--O 1.239 0.519 0 C-N-CA 123.276 0.63 . . . . 74.31 110.695 -177.267 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.3 ttm180 -159.76 146.8 16.53 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.401 -0.818 . . . . 73.5 108.866 175.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 31.8 m -89.09 105.75 17.99 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 108.265 -1.013 . . . . 64.14 108.265 171.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 81.9 m-85 -95.9 119.77 34.97 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.8 0.84 . . . . 64.01 108.859 -177.003 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.42 ' HG3' ' HG2' ' A' ' 7' ' ' GLU . 26.6 mp0 -88.2 108.08 19.11 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 107.987 -1.116 . . . . 75.1 107.987 -179.676 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.455 HD22 ' HB3' ' A' ' 36' ' ' LYS . 78.6 mt -115.17 99.63 7.56 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.745 0.818 . . . . 74.34 109.189 -175.058 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.407 ' O ' ' HE3' ' A' ' 36' ' ' LYS . 87.8 t80 -94.11 133.61 37.42 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 108.932 -0.766 . . . . 75.14 108.932 172.614 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.522 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -130.47 171.81 12.58 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.479 0.711 . . . . 73.44 109.663 175.785 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 26.4 t -95.66 -32.27 4.37 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 N-CA-C 109.319 -0.623 . . . . 74.41 109.319 172.477 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.486 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 35.1 mtt180 -132.39 169.57 16.34 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.903 0.881 . . . . 64.43 109.465 179.369 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -66.59 -41.3 88.7 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.871 0.868 . . . . 74.34 110.976 175.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -65.49 -22.01 66.69 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.514 1.126 . . . . 75.51 111.885 -178.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.522 ' HB2' ' HB1' ' A' ' 27' ' ' ALA . 28.5 mm-40 -78.8 -26.5 44.33 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.377 0.671 . . . . 63.24 111.039 -179.543 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.507 HD22 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -71.4 -23.43 61.87 Favored 'General case' 0 CA--C 1.557 1.24 0 C-N-CA 123.821 0.848 . . . . 55.42 110.434 -176.344 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.535 ' HG2' HG23 ' A' ' 80' ' ' ILE . 7.8 mtmp? -57.42 -54.19 49.68 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.303 0.641 . . . . 73.35 111.713 -175.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.569 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 1.9 pp20? -60.6 -31.52 70.68 Favored 'General case' 0 C--N 1.354 0.8 0 CA-C-N 115.814 -0.63 . . . . 74.13 111.115 -176.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.507 ' HD2' HD22 ' A' ' 33' ' ' LEU . 58.4 mttm -67.31 -43.58 81.29 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.797 0.839 . . . . 55.14 110.417 178.87 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.428 HD13 HD23 ' A' ' 81' ' ' LEU . 75.5 mt -61.05 -39.43 89.8 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.902 0.881 . . . . 73.45 110.687 175.625 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.402 ' HD3' ' HA ' ' A' ' 35' ' ' GLU . 57.3 mtpt -63.87 -42.61 97.47 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.466 0.707 . . . . 74.22 111.042 175.794 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.569 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 31.7 mmtp -61.03 -48.12 83.26 Favored 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 109.698 -0.482 . . . . 65.15 109.698 177.492 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 52.9 t -57.13 -50.4 76.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 124.847 1.259 . . . . 54.33 112.032 178.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 70.3 mt -70.75 -49.24 48.93 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.256 0.622 . . . . 53.23 111.12 -173.383 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.402 ' O ' ' HB2' ' A' ' 46' ' ' ASP . 92.3 m-20 -60.92 -39.05 87.94 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 122.887 0.475 . . . . 74.13 111.162 177.221 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -63.54 -55.01 27.28 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.662 0.785 . . . . 73.43 110.951 179.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 5.4 tpm_? -71.0 -33.19 70.15 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 115.573 -0.74 . . . . 72.52 110.92 -173.242 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 59.6 mtp -89.02 -6.65 57.02 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 112.773 0.657 . . . . 71.32 112.773 -178.19 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.402 ' HB2' ' O ' ' A' ' 42' ' ' ASN . 29.5 t70 -61.61 -50.31 82.89 Favored Pre-proline 0 CA--C 1.569 1.683 0 CA-C-O 118.739 -0.648 . . . . 74.42 111.855 178.633 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -71.95 -21.32 24.55 Favored 'Trans proline' 0 C--N 1.391 2.767 0 C-N-CA 121.87 1.713 . . . . 62.45 112.631 174.245 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.445 HG13 HD13 ' A' ' 12' ' ' ILE . 49.3 mm -68.99 -31.46 50.54 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.262 0 C-N-CA 123.549 0.74 . . . . 65.01 109.91 -178.278 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 60.1 mttm -63.32 -39.93 95.91 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.243 -0.889 . . . . 75.24 110.412 174.131 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.48 -28.99 62.23 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 123.429 0.691 . . . . 75.43 109.798 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 94.6 mt -69.85 -33.13 71.86 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 109.703 -0.481 . . . . 63.2 109.703 176.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 69.94 47.98 43.55 Favored Glycine 0 C--N 1.344 0.999 0 CA-C-N 115.097 -0.956 . . . . 51.34 113.246 173.242 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 99.3 m -75.98 120.98 22.05 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 109.9 -0.408 . . . . 72.04 109.9 174.05 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 6.6 ptpp? -60.07 -23.19 63.57 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.435 1.094 . . . . 65.51 112.082 177.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 14.3 ttp180 -159.66 139.54 11.61 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.778 0.831 . . . . 53.02 109.182 175.048 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 17.3 m -129.32 150.57 34.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 124.229 1.012 . . . . 64.15 109.944 177.286 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 26.6 ttt180 -101.84 115.48 30.63 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 108.353 -0.98 . . . . 73.33 108.353 170.209 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 21.1 mt -108.58 102.31 13.8 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 N-CA-C 108.424 -0.954 . . . . 75.13 108.424 177.431 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.44 ' HB2' ' HE2' ' A' ' 11' ' ' LYS . 57.2 m -102.67 104.97 15.35 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 108.551 -0.907 . . . . 64.14 108.551 178.559 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.473 ' HB ' HG13 ' A' ' 102' ' ' VAL . 63.3 mt -99.13 111.66 29.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 124.227 1.011 . . . . 74.11 109.537 -176.085 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.454 ' HB2' ' HB2' ' A' ' 9' ' ' GLN . 2.6 mpt_? -90.88 133.8 34.95 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 108.481 -0.933 . . . . 75.41 108.481 177.044 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.68 HG13 HG21 ' A' ' 6' ' ' VAL . 39.0 t -107.32 110.78 33.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 N-CA-C 107.581 -1.266 . . . . 65.11 107.581 173.048 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.12 101.96 9.96 Favored 'General case' 0 C--N 1.353 0.751 0 N-CA-C 107.095 -1.446 . . . . 65.01 107.095 -176.018 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . 0.492 ' HD2' HG12 ' A' ' 62' ' ' VAL . 65.0 m170 -68.13 108.73 3.23 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 114.796 -1.093 . . . . 72.25 110.369 -175.204 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 47.8 t -60.22 -58.34 8.92 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 124.147 0.905 . . . . 74.33 111.379 -173.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -106.93 143.17 35.41 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.513 0.725 . . . . 75.41 110.718 -176.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.445 ' O ' ' HG2' ' A' ' 70' ' ' GLU . . . -72.59 -46.41 54.37 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.833 0.853 . . . . 71.0 111.563 -175.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -67.81 -31.75 71.83 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.02 0.528 . . . . 75.42 112.004 -179.735 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -80.51 -32.78 36.84 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 112.47 0.544 . . . . 74.13 112.47 -174.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.604 ' HA ' ' HB3' ' A' ' 73' ' ' GLU . 12.8 pt-20 -66.31 -17.63 64.87 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 114.556 1.317 . . . . 62.2 114.556 -165.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -70.59 -44.46 67.3 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 108.899 -0.778 . . . . 72.35 108.899 176.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 16.6 tppt? -71.5 -44.33 64.9 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 114.945 -1.025 . . . . 70.1 110.277 174.598 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.604 ' HB3' ' HA ' ' A' ' 70' ' ' GLU . 0.3 OUTLIER -63.84 -52.49 59.88 Favored 'General case' 0 C--O 1.209 -1.076 0 CA-C-N 114.603 -1.181 . . . . 73.11 110.982 -170.365 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.78 -49.58 74.87 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.526 0.73 . . . . 41.43 112.186 -175.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -56.36 -47.39 78.95 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 114.945 -1.025 . . . . 31.21 111.678 177.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -78.85 -22.53 45.96 Favored 'General case' 0 CA--C 1.556 1.207 0 C-N-CA 123.355 0.662 . . . . 61.52 111.317 -177.095 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -81.79 -21.76 37.53 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.939 0.896 . . . . 72.23 109.204 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -59.73 -36.17 76.05 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.087 0.555 . . . . 73.2 110.006 169.416 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -74.7 -37.02 62.73 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.895 0.878 . . . . 53.01 111.324 176.169 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.535 HG23 ' HG2' ' A' ' 34' ' ' LYS . 31.8 mm -62.42 -43.73 98.53 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 C-N-CA 123.853 0.861 . . . . 54.31 110.456 175.814 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.543 HD13 HG11 ' A' ' 102' ' ' VAL . 47.5 mt -67.34 -39.33 85.76 Favored 'General case' 0 C--O 1.22 -0.486 0 C-N-CA 124.243 1.017 . . . . 72.0 110.289 176.649 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -62.89 -34.9 78.38 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.725 0.81 . . . . 73.51 110.996 179.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 41.6 mmtm -61.56 -51.29 69.19 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 123.511 0.507 . . . . 73.02 110.306 172.007 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.472 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 73.9 t -61.31 -46.9 95.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 124.174 0.99 . . . . 61.11 110.73 -173.789 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.512 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 21.1 m-85 -61.5 -35.46 77.74 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 115.267 -0.879 . . . . 75.32 110.54 179.581 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -76.02 -29.53 58.14 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.999 0.519 . . . . 73.13 111.366 176.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -78.58 -13.7 59.69 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 122.997 0.519 . . . . 72.22 110.249 178.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 84' ' ' VAL . 57.7 mt -108.86 -25.14 10.93 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.791 0.836 . . . . 61.11 110.725 178.22 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 119.77 -17.63 10.08 Favored Glycine 0 C--N 1.349 1.278 0 N-CA-C 115.207 0.843 . . . . 51.02 115.207 176.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.512 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 36.9 m-85 -59.83 135.76 57.79 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.619 0.768 . . . . 74.1 111.476 -177.241 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -99.05 167.75 10.52 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.965 0.906 . . . . 64.22 111.799 -172.181 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -56.66 -39.43 73.72 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 125.106 1.363 . . . . 73.51 112.516 -179.408 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 51.2 p -59.5 -29.03 67.57 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.299 1.039 . . . . 54.24 111.873 179.135 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -84.16 -26.55 28.74 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.706 0.802 . . . . 72.22 111.72 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 44.7 t -83.52 104.96 12.67 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 N-CA-C 109.364 -0.606 . . . . 74.25 109.364 -175.467 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 97.2 m -133.02 112.88 12.19 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.442 0.697 . . . . 63.34 110.248 178.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 59.8 m95 -76.32 112.3 12.67 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 123.198 0.599 . . . . 74.05 110.481 178.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -121.6 106.08 11.03 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.753 1.221 . . . . 64.21 109.303 179.608 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 72.86 54.75 6.95 Favored Glycine 0 C--N 1.35 1.342 0 O-C-N 123.518 0.511 . . . . 51.24 113.99 172.417 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 60.03 22.77 11.93 Favored 'General case' 0 N--CA 1.503 2.179 0 C-N-CA 124.755 1.222 . . . . 64.3 111.757 -179.383 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 40.4 m -138.96 141.71 38.41 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.073 1.349 . . . . 72.12 107.685 -171.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.543 HG11 HD13 ' A' ' 81' ' ' LEU . 5.1 p -94.99 107.65 19.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 N-CA-C 108.878 -0.786 . . . . 71.43 108.878 179.271 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 89.0 m -98.55 107.72 20.24 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.766 0.826 . . . . 72.54 109.145 -178.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 45.2 t -94.73 131.87 40.35 Favored 'Isoleucine or valine' 0 C--O 1.243 0.733 0 C-N-CA 124.818 1.247 . . . . 70.45 109.631 -178.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -85.13 112.92 21.12 Favored 'General case' 0 C--O 1.24 0.556 0 N-CA-C 107.647 -1.242 . . . . 72.22 107.647 170.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -110.29 137.08 14.04 Favored Glycine 0 N--CA 1.465 0.617 0 CA-C-N 117.8 0.273 . . . . 60.05 112.889 -177.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -133.85 104.11 6.15 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 106.126 -1.805 . . . . 63.03 106.126 164.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.531 HD13 ' H ' ' A' ' 108' ' ' LEU . 0.0 OUTLIER -80.49 163.16 23.97 Favored 'General case' 0 C--O 1.244 0.8 0 C-N-CA 123.581 0.752 . . . . 74.3 111.303 -171.844 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -81.29 -166.36 1.14 Allowed 'General case' 0 CA--C 1.552 1.055 0 CA-C-N 115.156 -0.929 . . . . 64.44 110.283 174.353 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 95.1 -78.77 0.86 Allowed Glycine 0 C--N 1.345 1.069 0 N-CA-C 110.857 -0.897 . . . . 72.14 110.857 178.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 82.8 t -66.26 -38.29 81.56 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 C-N-CA 123.658 0.783 . . . . 64.44 110.589 179.559 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 29.9 t0 -126.12 78.65 1.78 Allowed 'General case' 0 C--O 1.24 0.569 0 CA-C-N 115.353 -0.839 . . . . 75.11 108.995 -175.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 93.8 mt -75.48 131.95 40.46 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.208 -0.906 . . . . 65.42 110.715 178.365 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.463 ' HB3' ' HD2' ' A' ' 117' ' ' HIS . 44.1 mt-10 64.25 39.11 7.61 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.881 1.273 . . . . 62.24 112.788 172.42 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -73.49 -46.93 45.03 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 105.955 -1.869 . . . . 73.24 105.955 157.735 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 51.2 t-80 -78.15 86.79 4.28 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 105.885 -1.894 . . . . 65.44 105.885 159.017 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.463 ' HD2' ' HB3' ' A' ' 114' ' ' GLU . 9.2 t-80 -78.92 13.9 1.57 Allowed 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 124.513 1.125 . . . . 74.34 113.285 -162.452 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 40.6 m80 -140.87 177.9 7.72 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.138 0.975 . . . . 71.53 109.545 171.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 15.1 m-70 -83.53 166.57 18.15 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.523 0.729 . . . . 75.1 110.04 -178.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 77.7 t60 . . . . . 0 CA--C 1.555 1.137 0 N-CA-C 109.147 -0.686 . . . . 73.22 109.147 174.105 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.4 ttm . . . . . 0 N--CA 1.476 0.829 0 CA-C-O 121.657 0.742 . . . . 64.3 109.312 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 27.7 t -82.38 105.26 13.31 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 107.306 -1.368 . . . . 73.54 107.306 173.312 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -178.42 90.57 0.08 OUTLIER Glycine 0 C--N 1.334 0.444 0 N-CA-C 110.168 -1.173 . . . . 41.33 110.168 -175.599 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? -97.54 143.13 28.54 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.401 0.681 . . . . 73.25 109.707 -178.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.483 ' HA ' ' HA ' ' A' ' 26' ' ' TYR . 23.7 ttpp -83.81 115.04 22.05 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.18 -1.044 . . . . 71.54 108.18 165.637 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -101.53 152.56 5.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 N-CA-C 106.341 -1.725 . . . . 64.32 106.341 170.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.476 ' H ' ' HB2' ' A' ' 63' ' ' LYS . 42.6 mt-10 -120.0 114.55 22.2 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.676 0.75 . . . . 73.12 109.607 175.59 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.407 HG21 HD12 ' A' ' 25' ' ' LEU . 62.3 t -96.36 113.39 30.61 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 125.105 1.362 . . . . 55.44 109.165 -174.434 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 91.9 mt-30 -96.94 103.03 14.92 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 108.231 -1.026 . . . . 55.52 108.231 -178.125 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 79.9 t -95.98 110.01 23.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 N-CA-C 109.028 -0.73 . . . . 64.32 109.028 -177.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.405 ' HG3' ' HB3' ' A' ' 20' ' ' GLU . 39.5 ttmt -113.21 102.79 10.7 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.905 0.882 . . . . 72.35 108.754 -178.339 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 10.3 tt -118.07 118.07 56.94 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 C-N-CA 123.098 0.559 . . . . 70.13 110.302 -176.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 60.1 m -90.62 110.49 21.64 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 109.079 -0.711 . . . . 72.42 109.079 175.663 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.609 ' SG ' HG23 ' A' ' 48' ' ' ILE . 42.4 t -112.67 124.47 52.63 Favored 'General case' 0 C--O 1.244 0.796 0 N-CA-C 107.631 -1.248 . . . . 70.33 107.631 179.353 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.517 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 43.8 t30 70.19 -80.45 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.021 1.328 . . . . 64.22 109.51 -176.314 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -158.98 18.47 0.27 Allowed Glycine 0 N--CA 1.464 0.536 0 N-CA-C 111.166 -0.774 . . . . 70.22 111.166 176.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.477 ' HE2' ' HA ' ' A' ' 17' ' ' LYS . 11.1 mmpt? -117.46 126.23 52.27 Favored 'General case' 0 C--N 1.348 0.529 0 C-N-CA 124.344 1.058 . . . . 75.32 108.77 -179.562 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 38.2 m -94.68 122.09 36.92 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.646 0.778 . . . . 51.14 109.532 -176.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.688 ' HB3' HH21 ' A' ' 44' ' ' ARG . 67.3 m-85 -113.71 101.21 9.1 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.807 0.843 . . . . 74.53 109.639 -175.172 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.405 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 12.8 pt-20 -118.82 149.24 41.85 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.408 0.683 . . . . 74.33 110.528 -178.476 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 39.8 ttp180 -166.22 137.08 3.52 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.622 0.769 . . . . 72.24 109.904 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 39.4 m -86.24 109.36 18.88 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 109.009 -0.737 . . . . 60.42 109.009 175.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 28.3 m-85 -96.7 134.33 40.1 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 107.985 -1.117 . . . . 72.54 107.985 177.338 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -92.58 108.52 20.04 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 107.661 -1.237 . . . . 63.23 107.661 177.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.407 HD12 HG21 ' A' ' 8' ' ' VAL . 69.7 mt -111.62 96.81 6.31 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 109.187 -0.672 . . . . 44.5 109.187 177.281 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.483 ' HA ' ' HA ' ' A' ' 5' ' ' LYS . 44.6 t80 -93.41 133.92 36.19 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.259 1.024 . . . . 61.01 109.19 173.536 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.556 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -151.67 144.79 24.61 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 122.453 0.301 . . . . 51.44 111.217 179.387 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 94.3 t -65.12 -45.98 92.52 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 O-C-N 124.578 1.174 . . . . 30.43 109.586 173.29 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.564 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 58.4 mtt85 -124.05 155.96 37.38 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.42 0.688 . . . . 74.52 110.118 -179.186 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -65.37 -27.35 68.51 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.58 0.752 . . . . 74.24 110.37 170.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -53.08 -44.88 67.9 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.419 1.088 . . . . 64.33 110.962 168.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.564 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 13.6 mm-40 -73.1 -23.73 60.56 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 115.527 -0.76 . . . . 75.43 111.143 -177.433 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.418 HD22 ' HD2' ' A' ' 36' ' ' LYS . 0.2 OUTLIER -76.15 -26.83 56.67 Favored 'General case' 0 CA--C 1.559 1.292 0 C-N-CA 123.346 0.658 . . . . 71.2 110.133 -178.28 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.498 ' HG2' HG23 ' A' ' 80' ' ' ILE . 55.7 mtpt -60.64 -47.38 86.49 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 123.386 0.674 . . . . 74.33 112.765 -176.037 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -62.33 -35.39 78.94 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.527 0.731 . . . . 75.12 111.511 175.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.418 ' HD2' HD22 ' A' ' 33' ' ' LEU . 66.7 mttm -67.72 -42.82 81.34 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 123.655 0.782 . . . . 64.11 110.54 -179.069 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.466 HD13 HD23 ' A' ' 81' ' ' LEU . 88.8 mt -59.27 -45.95 89.85 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 124.15 0.906 . . . . 71.33 110.216 176.029 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -54.76 -48.47 72.58 Favored 'General case' 0 N--CA 1.482 1.144 0 O-C-N 123.741 0.651 . . . . 72.04 110.964 174.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.477 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 4.5 mmmp? -60.81 -59.51 5.27 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.233 0.613 . . . . 74.44 110.98 -178.23 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 60.7 t -48.65 -44.49 14.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 C-N-CA 125.196 1.398 . . . . 63.03 111.894 -178.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.468 HD21 HD11 ' A' ' 60' ' ' ILE . 58.5 mt -65.88 -51.41 59.0 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.312 -0.858 . . . . 73.03 110.802 177.305 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -68.56 -22.35 64.48 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 113.145 0.794 . . . . 72.55 113.145 -176.438 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 15.6 mm-40 -74.73 -53.56 8.99 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 108.61 -0.885 . . . . 73.44 108.61 174.453 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.688 HH21 ' HB3' ' A' ' 19' ' ' TYR . 17.7 tpt180 -74.64 -25.86 59.49 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-N 114.888 -1.051 . . . . 74.12 111.695 -171.133 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 55.6 mtp -92.39 -8.39 45.02 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 112.639 0.607 . . . . 54.4 112.639 -179.091 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.563 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 33.9 t70 -59.27 -49.84 90.66 Favored Pre-proline 0 CA--C 1.567 1.609 0 CA-C-O 118.791 -0.623 . . . . 72.41 112.206 177.527 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.442 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 39.5 Cg_endo -65.36 -28.53 54.72 Favored 'Trans proline' 0 C--N 1.39 2.761 0 C-N-CA 121.835 1.69 . . . . 74.44 112.644 173.698 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.609 HG23 ' SG ' ' A' ' 14' ' ' CYS . 50.0 mm -67.91 -36.97 77.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 C-N-CA 124.148 0.979 . . . . 54.35 111.511 -170.749 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.563 ' HE2' ' HA ' ' A' ' 46' ' ' ASP . 44.3 mtmt -66.81 -41.15 88.01 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 115.98 -0.554 . . . . 74.34 109.701 177.167 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -72.52 -24.73 61.19 Favored 'General case' 0 CA--C 1.557 1.233 0 CA-C-N 114.603 -1.18 . . . . 70.35 110.189 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 83.3 mt -75.7 -33.01 60.32 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.265 0.626 . . . . 75.2 110.416 173.654 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 72.59 55.05 6.94 Favored Glycine 0 C--N 1.345 1.073 0 CA-C-N 115.91 -0.586 . . . . 43.53 113.052 178.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.517 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 65.6 m -94.54 113.8 25.68 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 108.525 -0.917 . . . . 61.33 108.525 173.153 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.4 mtpm? -63.73 -78.33 0.05 OUTLIER 'General case' 0 N--CA 1.476 0.851 0 O-C-N 123.601 0.563 . . . . 74.24 110.216 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 15.1 ttm180 -84.3 121.21 27.2 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 109.321 -0.622 . . . . 71.41 109.321 178.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 29.3 m -126.26 138.5 54.43 Favored 'Isoleucine or valine' 0 C--O 1.243 0.738 0 C-N-CA 124.275 1.03 . . . . 64.14 108.589 173.618 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 58.9 ttt180 -103.09 109.43 20.99 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 107.775 -1.195 . . . . 53.32 107.775 169.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.409 HG22 HG13 ' A' ' 60' ' ' ILE . 34.0 mt -96.05 102.33 13.4 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 N-CA-C 106.791 -1.559 . . . . 62.21 106.791 173.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.3 m -100.68 102.77 13.96 Favored 'General case' 0 C--O 1.24 0.593 0 N-CA-C 107.597 -1.26 . . . . 75.41 107.597 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.468 HD11 HD21 ' A' ' 41' ' ' LEU . 72.2 mt -102.75 118.62 49.94 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 C-N-CA 123.343 0.657 . . . . 73.34 109.279 -178.136 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 51.9 mtm180 -108.5 118.84 37.83 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 108.55 -0.907 . . . . 71.21 108.55 175.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 7.2 p -92.82 138.25 20.49 Favored 'Isoleucine or valine' 0 C--O 1.242 0.679 0 N-CA-C 108.063 -1.088 . . . . 74.33 108.063 177.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.476 ' HB2' ' H ' ' A' ' 7' ' ' GLU . 10.3 mmpt? -80.12 110.1 15.21 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 107.355 -1.35 . . . . 75.22 107.355 174.134 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 55.6 m80 -75.98 142.65 41.88 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 115.342 -0.844 . . . . 74.11 109.125 -176.192 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.466 ' H ' ' HG2' ' A' ' 73' ' ' GLU . 32.0 m -52.15 -40.46 61.44 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.627 1.171 . . . . 71.41 113.641 -170.627 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -169.28 164.88 10.93 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.155 0.982 . . . . 73.15 108.732 -174.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -74.92 -26.19 59.45 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 112.697 0.629 . . . . 74.44 112.697 -178.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -80.69 -40.51 25.29 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 109.587 -0.523 . . . . 75.33 109.587 171.682 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -70.01 -17.58 63.28 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 115.436 -0.802 . . . . 73.14 111.658 175.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -49.72 -44.06 48.12 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 125.472 1.509 . . . . 75.05 112.284 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 24.5 mtpp -61.8 -37.24 83.65 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 114.623 -1.171 . . . . 73.2 111.357 -178.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.5 ' HE3' ' HA ' ' A' ' 72' ' ' LYS . 0.9 OUTLIER -83.65 -39.59 20.06 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 115.474 -0.784 . . . . 53.32 111.206 178.104 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.466 ' HG2' ' H ' ' A' ' 65' ' ' SER . 16.4 tp10 -76.65 -44.4 34.1 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.851 0.861 . . . . 74.21 111.18 -161.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.02 -48.87 74.63 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 123.928 0.767 . . . . 71.11 110.685 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 49.6 tptt -61.44 -43.81 98.21 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.291 1.037 . . . . 71.34 111.584 -179.318 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.9 tmmm? -64.18 -50.86 66.45 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 124.522 1.129 . . . . 72.21 110.137 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -75.21 -24.2 57.71 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 115.445 -0.798 . . . . 74.32 111.023 -171.314 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.72 -42.71 99.79 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.613 0.765 . . . . 72.12 110.769 174.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.28 -37.11 84.68 Favored 'General case' 0 CA--C 1.547 0.865 0 CA-C-N 115.227 -0.897 . . . . 72.21 111.214 177.354 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.498 HG23 ' HG2' ' A' ' 34' ' ' LYS . 48.2 mm -63.16 -47.12 93.92 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 C-N-CA 124.055 0.942 . . . . 74.54 110.728 177.197 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.659 HD13 HG11 ' A' ' 102' ' ' VAL . 56.1 mt -64.37 -46.2 84.41 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.862 0.865 . . . . 65.43 111.253 -177.178 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -59.59 -32.97 70.88 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.851 0.86 . . . . 75.3 109.907 -174.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -69.15 -48.01 63.46 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.324 0.65 . . . . 73.22 111.222 174.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 77.5 t -64.97 -44.86 96.02 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 C-N-CA 123.03 0.532 . . . . 53.33 111.371 -172.318 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 33.9 m-85 -61.29 -37.32 82.76 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.189 0.596 . . . . 53.33 110.942 175.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.53 -30.64 70.35 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.453 0.701 . . . . 75.53 111.437 175.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -81.18 -2.25 47.88 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.214 1.006 . . . . 75.23 111.138 178.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.7 mt -104.94 -24.56 12.82 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.924 0.89 . . . . 74.12 109.772 173.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 128.15 -17.15 5.98 Favored Glycine 0 C--N 1.346 1.118 0 CA-C-O 119.421 -0.655 . . . . 61.43 113.109 178.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -61.05 138.06 58.21 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-N 117.266 0.533 . . . . 72.54 110.422 178.222 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.456 HD22 ' N ' ' A' ' 91' ' ' ASN . 0.7 OUTLIER -81.01 169.25 17.74 Favored 'General case' 0 C--O 1.243 0.756 0 C-N-CA 123.26 0.624 . . . . 73.32 109.525 176.359 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -61.94 -37.16 83.65 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.009 0.524 . . . . 44.02 111.448 -178.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 40.4 p -63.54 -25.41 68.24 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.367 1.067 . . . . 73.31 113.083 179.203 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . 0.428 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 12.7 m120 -63.56 -39.92 95.64 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 122.687 0.395 . . . . 70.43 110.251 172.548 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 36.3 t -83.74 102.58 9.9 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.93 0 C-N-CA 124.352 1.061 . . . . 74.44 109.8 -171.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.412 ' O ' ' HA ' ' A' ' 102' ' ' VAL . 5.9 m -111.21 152.86 26.61 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.683 0.793 . . . . 62.33 109.079 -179.258 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 20.6 m95 -128.6 115.7 18.48 Favored 'General case' 0 N--CA 1.484 1.243 0 CA-C-N 118.335 0.516 . . . . 74.33 109.777 176.02 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -157.77 126.78 5.75 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 124.426 1.09 . . . . 72.31 110.131 -174.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 62.48 46.75 93.15 Favored Glycine 0 C--N 1.352 1.47 0 C-N-CA 123.049 0.356 . . . . 72.42 112.981 179.024 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 59.08 9.3 1.24 Allowed 'General case' 0 N--CA 1.503 2.198 0 C-N-CA 126.632 1.973 . . . . 73.4 113.243 -176.575 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 33.0 m -109.27 145.12 36.46 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.637 1.175 . . . . 73.22 109.199 -174.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.659 HG11 HD13 ' A' ' 81' ' ' LEU . 6.0 p -97.89 108.85 22.51 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.852 0 N-CA-C 107.961 -1.126 . . . . 64.22 107.961 166.006 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 80.0 m -92.64 100.93 13.35 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 108.564 -0.902 . . . . 74.41 108.564 179.205 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.428 ' HA ' ' O ' ' A' ' 94' ' ' ASN . 52.3 t -95.29 108.43 20.92 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 N-CA-C 107.483 -1.303 . . . . 73.23 107.483 175.345 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -119.06 129.47 55.11 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 107.644 -1.243 . . . . 74.03 107.644 179.594 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -160.71 -164.88 16.43 Favored Glycine 0 C--O 1.241 0.54 0 N-CA-C 111.344 -0.702 . . . . 73.44 111.344 -178.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -127.24 119.38 26.24 Favored 'General case' 0 C--O 1.243 0.751 0 C-N-CA 123.064 0.546 . . . . 73.41 110.049 177.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 4.9 tt -72.44 129.0 37.31 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 107.083 -1.451 . . . . 65.53 107.083 166.38 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -56.87 105.24 0.2 Allowed 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.527 0.731 . . . . 71.32 111.206 -174.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -169.57 43.4 0.21 Allowed Glycine 0 C--N 1.34 0.758 0 CA-C-N 114.996 -1.002 . . . . 70.24 110.684 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 4.2 t -78.19 80.06 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 123.735 0.814 . . . . 72.34 110.682 -170.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -172.07 -36.81 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.919 1.288 . . . . 61.44 108.09 177.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 71.2 mt -68.48 82.12 0.26 Allowed 'General case' 0 CA--C 1.55 0.952 0 CA-C-N 114.868 -1.06 . . . . 72.31 110.474 177.168 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.76 144.94 52.57 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 114.998 -1.001 . . . . 44.23 110.803 -177.097 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -66.4 96.47 0.36 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 123.75 0.82 . . . . 65.12 111.002 -176.264 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 67.7 m-70 -67.95 -18.49 64.76 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 122.801 0.44 . . . . 74.02 110.322 172.096 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 70.0 m-70 -68.01 86.89 0.25 Allowed 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 108.72 -0.844 . . . . 75.44 108.72 162.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 26.4 p80 -161.44 170.08 20.69 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.834 1.254 . . . . 75.22 108.395 177.481 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 48.0 t-80 -78.98 126.5 30.77 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 122.873 0.469 . . . . 72.3 110.981 -178.462 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 25.5 t-80 . . . . . 0 C--O 1.249 1.064 0 C-N-CA 124.43 1.092 . . . . 74.23 108.246 175.794 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.7 tpp . . . . . 0 N--CA 1.481 1.118 0 N-CA-C 109.139 -0.689 . . . . 74.35 109.139 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 45.3 m -84.65 54.72 3.13 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.567 0.747 . . . . 72.31 111.002 -177.154 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 124.43 -144.12 15.13 Favored Glycine 0 C--N 1.348 1.215 0 CA-C-N 116.085 -0.507 . . . . 74.05 113.576 177.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.48 ' HE3' ' HA ' ' A' ' 4' ' ' LYS . 0.8 OUTLIER -154.1 130.91 10.83 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.972 0.909 . . . . 72.12 110.305 -171.996 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -97.84 139.81 33.14 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 108.434 -0.95 . . . . 72.11 108.434 168.749 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 5.6 p -143.05 146.68 21.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 123.547 0.739 . . . . 75.45 109.919 177.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.525 ' HG3' ' HG3' ' A' ' 24' ' ' GLN . 3.4 mp0 -106.19 117.85 35.1 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 107.917 -1.142 . . . . 70.22 107.917 174.517 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.583 HG22 HG23 ' A' ' 62' ' ' VAL . 95.0 t -104.48 127.92 58.45 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 124.324 1.05 . . . . 74.13 108.757 -176.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.421 ' O ' ' HA ' ' A' ' 60' ' ' ILE . 45.7 mt-30 -111.1 101.88 10.38 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 109.198 -0.668 . . . . 52.45 109.198 176.126 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 88.0 t -93.84 112.07 26.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 N-CA-C 108.466 -0.939 . . . . 60.32 108.466 -179.533 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.437 ' O ' ' HA ' ' A' ' 58' ' ' ILE . 39.6 ttmt -106.48 104.4 14.08 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 108.455 -0.943 . . . . 65.14 108.455 179.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 14.9 tt -116.49 116.91 53.73 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 CA-C-O 121.381 0.61 . . . . 72.24 109.813 -178.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 50.7 m -104.81 135.79 45.53 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 123.372 0.669 . . . . 73.23 111.122 -175.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 39.8 t -163.32 141.21 7.78 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.179 0.992 . . . . 75.35 111.339 174.344 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.452 ' ND2' ' HB3' ' A' ' 51' ' ' LEU . 91.9 m-20 60.49 32.24 20.46 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 125.279 1.432 . . . . 64.51 112.74 171.885 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 87.97 -1.98 85.33 Favored Glycine 0 C--N 1.345 1.056 0 CA-C-N 115.974 -0.557 . . . . 34.52 113.837 177.084 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 24.4 mmmt -115.21 147.63 40.09 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.243 0.617 . . . . 62.2 110.392 178.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 53.2 m -116.15 130.46 56.81 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 124.102 0.961 . . . . 54.13 108.731 175.69 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.1 m-85 -114.76 100.36 8.18 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 108.407 -0.96 . . . . 61.32 108.407 -179.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -127.84 142.05 51.39 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.108 0.563 . . . . 74.43 110.254 -177.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.3 tpt180 -159.4 145.27 16.14 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 115.87 -0.605 . . . . 73.41 109.939 -173.243 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 22.6 m -98.33 109.08 21.89 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 124.307 1.043 . . . . 63.24 109.706 178.028 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.402 ' HE1' HH21 ' A' ' 44' ' ' ARG . 5.8 m-85 -100.83 137.87 38.64 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.555 1.142 . . . . 74.12 108.67 -179.107 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.525 ' HG3' ' HG3' ' A' ' 7' ' ' GLU . 27.0 mp0 -103.59 108.23 19.42 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 108.349 -0.982 . . . . 65.4 108.349 178.457 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 80.4 mt -112.07 99.29 7.96 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.335 1.054 . . . . 55.32 109.637 -174.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 89.1 t80 -92.93 135.55 34.04 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 108.88 -0.785 . . . . 64.12 108.88 169.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.565 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -141.03 150.22 42.72 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.989 0.916 . . . . 70.23 109.467 179.718 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.0 t -80.87 -38.92 17.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-O 121.263 0.554 . . . . 74.22 110.338 175.285 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.542 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 52.2 mtt180 -119.92 163.34 17.71 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.279 0.631 . . . . 73.53 110.174 175.386 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -65.18 -34.57 78.69 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 115.253 -0.885 . . . . 52.44 109.919 170.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.524 ' HA ' ' HD3' ' A' ' 34' ' ' LYS . 25.4 mm-40 -56.99 -39.66 75.08 Favored 'General case' 0 C--N 1.359 1.015 0 C-N-CA 124.297 1.039 . . . . 71.14 111.573 173.255 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.565 ' HB2' ' HB1' ' A' ' 27' ' ' ALA . 29.9 mm-40 -68.04 -40.85 82.76 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 116.005 -0.543 . . . . 51.51 110.274 178.599 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.49 -33.92 76.64 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.637 0.775 . . . . 74.3 110.368 -179.305 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.524 ' HD3' ' HA ' ' A' ' 31' ' ' GLU . 59.6 mtpt -59.43 -51.79 68.4 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.629 0.772 . . . . 72.42 112.21 -178.649 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.524 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 1.2 pp20? -67.86 -28.04 67.19 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-O 119.467 -0.301 . . . . 63.02 111.33 179.659 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -64.89 -40.99 95.96 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.137 0.575 . . . . 75.04 111.054 174.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.475 HD13 HD23 ' A' ' 81' ' ' LEU . 70.3 mt -61.18 -44.17 97.72 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 123.747 0.655 . . . . 74.14 110.729 173.736 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -61.23 -39.35 89.95 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 122.834 0.453 . . . . 71.31 111.474 176.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.524 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 33.7 mmtp -61.39 -54.42 43.9 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.45 0.7 . . . . 74.04 110.691 176.828 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 47.1 t -58.43 -51.52 70.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 124.549 1.139 . . . . 71.5 112.169 -177.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 70.3 mt -65.72 -48.79 70.79 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 124.054 0.846 . . . . 65.34 111.384 -174.304 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 31.0 t-20 -60.79 -46.52 90.19 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.256 0.622 . . . . 64.52 110.419 -178.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -60.7 -43.87 97.25 Favored 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 123.622 0.769 . . . . 73.52 112.177 177.371 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.402 HH21 ' HE1' ' A' ' 23' ' ' TYR . 17.1 tpp180 -66.45 -24.89 66.51 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 123.504 0.722 . . . . 75.0 111.298 -178.829 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.483 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 65.3 mtp -85.43 -14.03 47.43 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-O 118.205 -0.902 . . . . 62.14 112.877 176.774 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.462 ' HA ' ' HD2' ' A' ' 49' ' ' LYS . 0.8 OUTLIER -60.34 -43.98 94.73 Favored Pre-proline 0 N--CA 1.503 2.21 0 CA-C-N 119.861 1.209 . . . . 73.33 113.42 -179.746 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.469 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 12.3 Cg_endo -56.71 -37.19 98.35 Favored 'Trans proline' 0 C--N 1.394 2.956 0 C-N-CA 121.715 1.61 . . . . 73.44 111.802 167.556 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.438 HG23 ' SG ' ' A' ' 53' ' ' CYS . 35.1 mm -72.78 -29.2 29.09 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.211 0 C-N-CA 124.77 1.228 . . . . 74.32 110.844 -174.06 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.66 ' HA ' HD11 ' A' ' 108' ' ' LEU . 80.9 mttt -75.1 -39.25 60.82 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.288 0.635 . . . . 73.34 109.681 179.401 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.6 ttpm? -69.44 -26.05 64.41 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 115.185 -0.916 . . . . 73.35 111.233 173.168 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 47' ' ' PRO . 69.8 mt -72.3 -32.48 66.62 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 109.311 -0.626 . . . . 73.25 109.311 171.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 82.59 38.31 12.45 Favored Glycine 0 C--N 1.348 1.212 0 CA-C-N 115.897 -0.592 . . . . 42.5 112.297 178.497 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.438 ' SG ' HG23 ' A' ' 48' ' ' ILE . 33.1 m -73.51 118.98 17.11 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.563 0.745 . . . . 74.21 110.541 -179.076 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.95 -55.47 16.66 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 122.909 0.484 . . . . 71.44 110.349 177.417 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.1 ttm180 -121.51 144.57 48.64 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.984 0.913 . . . . 75.2 109.05 178.479 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 35.2 m -125.78 145.0 33.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 124.191 0.996 . . . . 75.52 109.326 179.165 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 38.6 ttm180 -109.37 109.61 20.53 Favored 'General case' 0 C--O 1.238 0.5 0 N-CA-C 107.948 -1.13 . . . . 74.53 107.948 173.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.437 ' HA ' ' O ' ' A' ' 11' ' ' LYS . 36.6 mt -105.95 134.85 46.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 C-N-CA 123.82 0.848 . . . . 70.13 108.933 179.329 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 50.9 m -129.35 106.97 9.15 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 107.45 -1.315 . . . . 44.2 107.45 173.372 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.474 ' HB ' HG13 ' A' ' 102' ' ' VAL . 76.3 mt -98.88 122.21 50.33 Favored 'Isoleucine or valine' 0 C--O 1.24 0.563 0 C-N-CA 123.513 0.725 . . . . 75.24 110.066 -177.784 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -104.28 103.4 13.15 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 107.078 -1.453 . . . . 75.32 107.078 172.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.583 HG23 HG22 ' A' ' 8' ' ' VAL . 6.7 p -95.98 146.09 7.63 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 N-CA-C 108.776 -0.824 . . . . 74.33 108.776 -177.774 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.441 ' HG3' ' HB2' ' A' ' 7' ' ' GLU . 12.7 mmmm -81.35 109.26 15.68 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.123 0.487 . . . . 71.15 110.236 177.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . 0.428 ' HB2' ' HG2' ' A' ' 70' ' ' GLU . 53.4 m-70 -80.88 111.66 17.55 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 107.501 -1.296 . . . . 74.41 107.501 178.592 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 38.8 t -20.29 -68.35 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 C-N-CA 127.249 2.22 . . . . 45.04 115.281 -166.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.558 ' H ' ' HB2' ' A' ' 69' ' ' GLU . 6.6 m-20 -137.1 173.17 11.98 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 108.057 -1.09 . . . . 74.44 108.057 174.81 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.8 -41.91 97.81 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.431 0.693 . . . . 75.22 111.479 -173.682 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -73.57 -26.87 61.02 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.097 0.559 . . . . 71.14 111.372 176.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.558 ' HB2' ' H ' ' A' ' 66' ' ' ASP . 18.4 mm-40 -74.97 -27.55 60.21 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-O 118.697 -0.668 . . . . 52.54 111.707 179.74 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.428 ' HG2' ' HB2' ' A' ' 64' ' ' HIS . 48.5 mt-10 -46.98 -40.03 13.63 Favored 'General case' 0 N--CA 1.498 1.959 0 N-CA-C 114.449 1.277 . . . . 75.14 114.449 -166.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 58.2 mttp -65.99 -58.21 6.05 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.23 0.612 . . . . 74.34 111.088 -176.65 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.9 tptt -66.19 -35.71 81.17 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.192 0.997 . . . . 72.23 111.048 -178.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -64.61 -48.02 76.43 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.433 1.093 . . . . 71.33 109.438 -179.371 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.48 -39.84 92.41 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 124.129 0.893 . . . . 24.33 111.631 -177.233 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -62.01 -43.64 98.4 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.495 0.718 . . . . 71.15 110.949 175.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.16 -44.55 83.76 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 124.109 0.964 . . . . 71.22 110.351 178.394 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -76.15 -20.27 57.73 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 115.55 -0.75 . . . . 74.11 110.523 -174.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.83 -43.07 94.29 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 123.344 0.657 . . . . 72.53 109.915 171.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.4 -41.03 85.6 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 123.439 0.696 . . . . 52.01 111.092 176.392 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.446 HG23 ' HG2' ' A' ' 34' ' ' LYS . 31.8 mm -57.71 -53.45 44.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 124.514 1.126 . . . . 63.25 110.914 177.125 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.475 HD23 HD13 ' A' ' 37' ' ' LEU . 43.8 mt -69.24 -33.25 72.99 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.779 0.832 . . . . 62.14 112.294 -178.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 62.3 t30 -59.32 -38.22 79.75 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.318 0.647 . . . . 65.24 110.394 -178.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -71.11 -46.08 62.4 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 114.575 -1.193 . . . . 75.45 111.756 175.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 54.6 t -62.34 -54.33 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 C-N-CA 123.949 0.9 . . . . 75.23 110.801 -173.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.581 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 22.2 m-85 -59.5 -37.08 77.34 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 115.017 -0.992 . . . . 61.1 111.93 -179.609 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -66.69 -26.64 67.12 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.306 0.643 . . . . 74.3 112.015 179.454 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -85.85 -12.76 49.94 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.023 0.929 . . . . 72.33 110.683 177.582 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.7 mt -107.21 0.51 23.32 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.608 0.763 . . . . 74.33 111.751 -174.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 103.18 -7.13 51.51 Favored Glycine 0 C--N 1.345 1.061 0 N-CA-C 114.252 0.461 . . . . 71.24 114.252 176.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.581 ' HB2' ' HB3' ' A' ' 85' ' ' PHE . 46.6 m-85 -84.44 131.82 34.63 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.469 0.708 . . . . 65.22 110.059 178.389 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -116.44 -166.06 1.12 Allowed 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 124.509 1.124 . . . . 61.22 109.874 -177.479 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -50.65 -51.13 51.94 Favored 'General case' 0 N--CA 1.492 1.668 0 C-N-CA 124.024 0.929 . . . . 72.51 112.278 -179.216 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 20.1 m -63.17 -17.69 62.66 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 124.205 1.002 . . . . 74.23 112.838 -176.564 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . 0.426 ' O ' ' HA ' ' A' ' 104' ' ' VAL . 18.4 m120 -94.12 -38.98 10.82 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.511 0.725 . . . . 72.34 110.827 -175.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 42.1 t -89.82 127.32 42.5 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 122.708 0.403 . . . . 74.22 109.98 -176.154 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 27.1 m -145.74 113.68 6.49 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.314 0.646 . . . . 75.2 109.862 178.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 68.2 m95 -82.07 142.34 32.39 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 122.778 0.431 . . . . 73.44 110.411 174.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -144.22 94.62 2.6 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.344 1.057 . . . . 73.31 108.93 -177.039 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 67.5 -92.98 0.23 Allowed Glycine 0 C--N 1.348 1.204 0 CA-C-N 115.531 -0.758 . . . . 74.32 113.686 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -114.72 -19.45 11.05 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.348 1.059 . . . . 72.51 110.395 -175.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 89.0 m -100.14 149.65 23.3 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.998 1.319 . . . . 72.45 110.541 -177.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.474 HG13 ' HB ' ' A' ' 60' ' ' ILE . 3.3 p -110.99 113.39 44.14 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 N-CA-C 108.523 -0.917 . . . . 75.2 108.523 169.863 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 48.7 m -100.54 111.19 23.41 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 108.957 -0.757 . . . . 54.45 108.957 178.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.426 ' HA ' ' O ' ' A' ' 94' ' ' ASN . 86.1 t -110.37 109.93 30.29 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 N-CA-C 109.297 -0.631 . . . . 55.12 109.297 177.419 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -110.46 111.49 22.78 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 107.463 -1.31 . . . . 73.43 107.463 177.059 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -157.85 172.87 35.12 Favored Glycine 0 C--N 1.342 0.903 0 C-N-CA 121.802 -0.237 . . . . 70.53 112.718 -174.405 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -85.78 158.51 19.98 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 121.906 0.86 . . . . 73.42 112.142 -172.591 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.66 HD11 ' HA ' ' A' ' 49' ' ' LYS . 2.2 tt -74.3 135.58 42.59 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 113.796 -1.547 . . . . 64.3 107.823 172.26 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -53.96 -63.12 1.25 Allowed 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.965 0.906 . . . . 73.44 111.692 178.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -169.18 128.66 1.72 Allowed Glycine 0 C--N 1.339 0.715 0 CA-C-N 115.412 -0.813 . . . . 41.4 111.169 179.083 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 92.6 t -69.01 105.86 1.11 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.879 0 N-CA-C 108.945 -0.761 . . . . 60.13 108.945 174.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 29.6 t70 67.8 87.14 0.12 Allowed 'General case' 0 C--N 1.35 0.629 0 C-N-CA 125.069 1.348 . . . . 74.33 110.072 -178.048 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 96.6 mt -69.37 129.64 40.33 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.49 -0.777 . . . . 73.12 111.341 -176.336 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -65.95 -49.85 66.44 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.109 0.964 . . . . 75.33 109.257 172.147 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 29.6 t60 -80.94 77.19 7.85 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 107.907 -1.146 . . . . 75.2 107.907 173.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 21.9 p80 -104.07 -6.18 21.37 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 115.81 -0.632 . . . . 74.51 112.627 -172.464 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 34.5 m170 -76.71 82.69 3.34 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 109.259 -0.645 . . . . 70.13 109.259 173.255 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 24.7 p80 -166.83 157.45 11.94 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.987 1.315 . . . . 74.11 108.249 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -70.17 155.28 40.85 Favored 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 109.52 -0.548 . . . . 70.31 109.52 177.464 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 73.7 m-70 . . . . . 0 CA--C 1.556 1.177 0 N-CA-C 109.101 -0.703 . . . . 75.1 109.101 175.812 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.6 ptt? . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 119.971 -0.062 . . . . 63.14 111.019 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 45.7 t -60.87 127.05 29.67 Favored 'General case' 0 C--O 1.246 0.915 0 C-N-CA 123.469 0.708 . . . . 71.31 110.722 -175.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -74.05 73.07 1.31 Allowed Glycine 0 C--N 1.346 1.138 0 N-CA-C 110.53 -1.028 . . . . 62.43 110.53 171.254 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -111.22 172.89 6.61 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 124.545 1.138 . . . . 74.22 110.218 -174.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.7 ttpm? -98.05 113.32 25.15 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 107.884 -1.154 . . . . 73.12 107.884 170.052 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -100.42 127.74 53.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 N-CA-C 107.396 -1.335 . . . . 63.41 107.396 172.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -102.34 113.76 27.35 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 108.303 -0.999 . . . . 74.41 108.303 177.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 75.0 t -95.05 106.14 17.83 Favored 'Isoleucine or valine' 0 C--O 1.239 0.522 0 C-N-CA 125.147 1.379 . . . . 72.13 108.606 -174.274 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.506 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 65.5 mt-30 -99.84 98.84 9.59 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 108.373 -0.973 . . . . 52.03 108.373 -172.51 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.404 ' O ' ' HA ' ' A' ' 20' ' ' GLU . 57.3 t -93.67 107.37 19.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 N-CA-C 108.919 -0.771 . . . . 70.11 108.919 -173.609 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.414 ' HG3' ' HB3' ' A' ' 20' ' ' GLU . 40.1 ttmt -106.19 101.65 11.11 Favored 'General case' 0 C--N 1.346 0.416 0 N-CA-C 107.817 -1.179 . . . . 64.51 107.817 178.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.489 ' HA ' ' O ' ' A' ' 57' ' ' ARG . 14.6 tt -119.09 122.08 68.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 122.965 0.506 . . . . 73.45 110.301 -174.062 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 30.0 m -90.33 123.16 33.86 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 109.178 -0.675 . . . . 75.31 109.178 178.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.639 ' SG ' HG23 ' A' ' 48' ' ' ILE . 16.2 t -156.66 126.27 6.23 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.142 0.977 . . . . 74.35 109.01 -173.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.492 ' N ' ' SG ' ' A' ' 53' ' ' CYS . 6.3 t-20 66.33 25.22 10.45 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 125.218 1.407 . . . . 74.4 110.975 175.569 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.19 1.51 86.34 Favored Glycine 0 C--N 1.352 1.443 0 CA-C-N 115.585 -0.734 . . . . 72.22 113.843 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm -109.85 153.07 24.95 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.937 0.895 . . . . 75.13 110.023 -179.729 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 28.0 m -113.26 107.5 15.98 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.266 0.627 . . . . 71.12 109.415 -179.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -100.89 99.2 9.65 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 107.586 -1.265 . . . . 71.32 107.586 -175.135 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.414 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 8.4 pt-20 -115.4 122.61 46.34 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 109.578 -0.527 . . . . 73.1 109.578 -179.533 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.5 tpm_? -140.76 127.36 20.18 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.554 -0.748 . . . . 71.44 110.243 -169.699 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 27.3 m -86.67 111.35 20.59 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 123.661 0.784 . . . . 73.54 109.891 176.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -97.66 119.81 36.9 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.724 0.81 . . . . 74.22 109.374 177.29 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 26.8 mp0 -86.69 109.26 19.08 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 108.135 -1.061 . . . . 74.41 108.135 -179.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.466 HD11 HG21 ' A' ' 40' ' ' VAL . 86.1 mt -120.26 132.58 55.39 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.922 0.889 . . . . 51.21 109.286 -178.069 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 39.8 t80 -126.4 135.97 52.09 Favored 'General case' 0 C--O 1.24 0.577 0 N-CA-C 108.673 -0.862 . . . . 72.0 108.673 177.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.444 ' HB1' ' HB2' ' A' ' 32' ' ' GLU . . . -156.15 152.55 28.04 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.245 0.618 . . . . 64.12 109.439 173.157 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 95.8 t -67.99 -60.05 2.99 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 O-C-N 124.158 0.911 . . . . 65.3 109.294 174.031 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.577 ' HB2' ' HG2' ' A' ' 32' ' ' GLU . 97.4 mtt180 -96.57 162.87 13.27 Favored 'General case' 0 C--O 1.242 0.665 0 CA-C-O 121.837 0.827 . . . . 61.32 111.61 -178.267 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 18.2 p-10 -67.29 -37.16 82.95 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 113.598 -1.637 . . . . 65.14 111.055 174.057 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -67.68 -31.83 72.08 Favored 'General case' 0 C--N 1.353 0.747 0 C-N-CA 124.244 1.017 . . . . 71.25 111.58 -175.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.577 ' HG2' ' HB2' ' A' ' 29' ' ' ARG . 26.1 mm-40 -66.4 -35.63 80.8 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.861 -0.609 . . . . 64.35 109.926 177.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.407 HD23 ' HB3' ' A' ' 27' ' ' ALA . 0.1 OUTLIER -69.86 -25.85 63.92 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 123.893 0.877 . . . . 54.4 110.784 -176.243 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.508 ' HG2' HG23 ' A' ' 80' ' ' ILE . 53.2 mtmt -55.19 -62.13 1.87 Allowed 'General case' 0 C--N 1.365 1.28 0 C-N-CA 122.944 0.498 . . . . 75.54 111.556 -178.71 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.542 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 3.1 pp20? -61.29 -29.99 70.21 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 115.979 -0.555 . . . . 72.11 111.857 -176.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 56.4 mttm -67.08 -43.38 82.75 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.231 0.612 . . . . 71.25 110.423 177.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.493 HD13 HD23 ' A' ' 81' ' ' LEU . 88.8 mt -59.7 -40.55 88.27 Favored 'General case' 0 N--CA 1.474 0.746 0 O-C-N 123.989 0.806 . . . . 73.21 110.496 176.269 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -58.91 -46.51 87.73 Favored 'General case' 0 C--N 1.359 0.995 0 C-N-CA 123.025 0.53 . . . . 74.25 110.971 175.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.542 ' HG2' ' O ' ' A' ' 35' ' ' GLU . 14.2 mmmm -60.58 -52.0 67.02 Favored 'General case' 0 N--CA 1.48 1.046 0 O-C-N 123.586 0.554 . . . . 75.44 110.04 179.183 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.466 HG21 HD11 ' A' ' 25' ' ' LEU . 46.5 t -55.16 -42.87 67.84 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 125.127 1.371 . . . . 70.24 111.996 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 67.0 mt -71.95 -36.64 69.93 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 122.869 0.468 . . . . 70.22 110.611 -179.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.3 m-80 -65.52 -30.95 71.77 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 122.78 0.432 . . . . 74.12 111.643 173.182 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 13.6 mm-40 -75.18 -54.54 6.94 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 122.501 0.32 . . . . 64.25 110.624 179.158 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.7 tpp180 -66.58 -36.38 82.5 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.29 0.636 . . . . 63.13 111.113 -175.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.505 ' O ' ' HG3' ' A' ' 49' ' ' LYS . 69.9 mtp -86.41 -10.8 53.54 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 118.728 -0.653 . . . . 71.52 112.613 -178.159 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.54 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 22.4 t70 -58.79 -53.22 68.57 Favored Pre-proline 0 CA--C 1.564 1.49 0 CA-C-O 118.41 -0.805 . . . . 73.53 111.479 178.705 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -61.59 -29.67 84.65 Favored 'Trans proline' 0 C--N 1.395 2.988 0 C-N-CA 121.877 1.718 . . . . 75.21 111.912 174.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.639 HG23 ' SG ' ' A' ' 14' ' ' CYS . 49.4 mm -70.25 -34.0 56.82 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 123.893 0.877 . . . . 71.11 110.804 -173.158 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.582 ' HG2' HD21 ' A' ' 108' ' ' LEU . 45.6 mtmt -71.01 -38.97 72.64 Favored 'General case' 0 C--N 1.353 0.722 0 N-CA-C 109.667 -0.494 . . . . 75.02 109.667 178.195 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.1 tmmt? -73.85 -26.05 60.38 Favored 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 116.046 -0.524 . . . . 73.52 110.34 177.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 87.6 mt -70.9 -27.79 64.06 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 108.726 -0.842 . . . . 63.03 108.726 170.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 69.43 37.73 79.45 Favored Glycine 0 C--N 1.353 1.473 0 O-C-N 124.275 0.985 . . . . 70.32 112.933 172.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.492 ' SG ' ' N ' ' A' ' 15' ' ' ASN . 71.4 m -70.74 111.25 6.06 Favored 'General case' 0 C--O 1.241 0.635 0 O-C-N 124.282 0.637 . . . . 51.21 109.917 177.881 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -58.01 -55.01 40.41 Favored 'General case' 0 C--O 1.215 -0.746 0 O-C-N 124.804 1.315 . . . . 75.54 110.465 -173.231 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 73.9 ttt180 -108.62 136.06 48.83 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 108.641 -0.874 . . . . 64.14 108.641 172.207 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 30.1 m -124.75 139.76 49.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 123.546 0.739 . . . . 73.11 109.623 175.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.489 ' O ' ' HA ' ' A' ' 12' ' ' ILE . 48.8 ttt180 -109.05 106.92 17.05 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 108.569 -0.9 . . . . 71.24 108.569 171.654 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 41.9 mt -102.31 106.16 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 N-CA-C 108.383 -0.969 . . . . 72.33 108.383 -179.67 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 17.5 m -109.22 102.5 11.44 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 107.963 -1.125 . . . . 63.23 107.963 -177.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 71.2 mt -99.67 113.83 36.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 123.496 0.718 . . . . 74.42 109.884 -174.261 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.506 ' HB2' ' HB2' ' A' ' 9' ' ' GLN . 58.5 mtm180 -98.96 122.72 42.59 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 107.705 -1.22 . . . . 73.43 107.705 -179.042 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.2 p -93.59 129.01 44.6 Favored 'Isoleucine or valine' 0 C--O 1.242 0.673 0 N-CA-C 108.932 -0.766 . . . . 61.45 108.932 -177.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.3 tmtt? -97.1 121.97 39.58 Favored 'General case' 0 C--O 1.239 0.532 0 N-CA-C 107.524 -1.287 . . . . 54.3 107.524 176.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 5.9 p80 -113.12 131.51 55.81 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.765 1.226 . . . . 74.41 109.369 -179.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 16.9 m -89.32 -59.22 2.27 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.611 0.765 . . . . 54.1 111.227 -173.365 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -87.53 131.81 34.25 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 116.276 -0.42 . . . . 74.41 110.244 -175.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -75.3 -24.27 57.45 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 123.653 0.781 . . . . 34.32 112.815 -173.223 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -81.33 -40.19 23.96 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 122.918 0.487 . . . . 61.0 110.417 178.356 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 -68.81 -49.19 60.55 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.017 0.527 . . . . 72.52 111.983 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -49.84 -30.02 9.09 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 124.911 1.382 . . . . 72.0 114.692 -166.07 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.9 ttpm? -64.96 -48.26 74.67 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.018 0.927 . . . . 44.42 110.725 -176.322 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 4.6 ttmp? -79.39 -40.98 28.78 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.123 0.569 . . . . 64.12 110.26 173.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -63.15 -37.97 89.32 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.321 1.049 . . . . 65.12 111.524 -166.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.71 -36.78 62.72 Favored 'General case' 0 C--N 1.356 0.871 0 C-N-CA 123.494 0.718 . . . . 55.25 111.623 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -66.41 -36.83 83.81 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 122.997 0.519 . . . . 63.34 111.179 174.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.454 ' O ' HG12 ' A' ' 80' ' ' ILE . 79.3 tttt -76.19 -31.71 58.61 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.719 -0.673 . . . . 63.25 109.456 177.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -75.96 -21.97 56.43 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.811 0.845 . . . . 71.05 109.605 176.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.37 -40.3 93.37 Favored 'General case' 0 C--N 1.35 0.615 0 C-N-CA 123.574 0.75 . . . . 71.35 109.757 172.137 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.94 -43.25 93.32 Favored 'General case' 0 C--N 1.351 0.632 0 O-C-N 123.969 0.793 . . . . 52.2 110.38 174.138 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.508 HG23 ' HG2' ' A' ' 34' ' ' LYS . 29.3 mm -62.4 -46.27 96.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 124.306 1.042 . . . . 73.12 111.267 -179.396 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.506 HD13 HG11 ' A' ' 102' ' ' VAL . 39.2 mt -63.05 -46.9 85.31 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.839 0.856 . . . . 55.23 110.013 178.606 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -62.47 -36.94 84.05 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 123.999 0.812 . . . . 73.32 109.819 -175.022 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.426 ' O ' ' HG2' ' A' ' 87' ' ' GLU . 30.2 mmmt -65.54 -41.63 92.83 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 122.902 0.481 . . . . 73.21 111.115 175.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.458 HG21 ' HB2' ' A' ' 37' ' ' LEU . 53.6 t -65.69 -43.16 93.78 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 123.428 0.691 . . . . 71.03 110.919 -178.453 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.461 ' HB3' ' HB2' ' A' ' 90' ' ' TYR . 26.4 m-85 -60.31 -41.62 93.83 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 115.308 -0.86 . . . . 72.31 109.808 175.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -64.75 -31.75 73.11 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.588 0.755 . . . . 40.53 111.711 177.275 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 83' ' ' LYS . 23.5 mm-40 -76.2 -19.6 58.26 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.65 0.78 . . . . 73.05 111.336 178.819 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 78.5 mt -109.32 14.32 23.78 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.551 0.74 . . . . 64.3 110.999 -177.838 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 81.17 28.5 44.71 Favored Glycine 0 C--N 1.35 1.356 0 N-CA-C 114.488 0.555 . . . . 63.03 114.488 171.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.639 ' HB3' HD21 ' A' ' 94' ' ' ASN . 13.7 m-85 -111.04 146.7 36.26 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 107.856 -1.164 . . . . 64.45 107.856 171.744 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.413 ' O ' HG23 ' A' ' 95' ' ' VAL . 18.4 m120 -101.18 172.11 7.21 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.064 0.546 . . . . 62.12 111.402 -178.115 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -65.64 -36.93 85.1 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.372 1.069 . . . . 70.53 111.594 -173.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 18.3 m -62.51 -36.01 81.2 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 124.029 0.931 . . . . 61.52 112.776 -175.527 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ASN . . . . . 0.639 HD21 ' HB3' ' A' ' 90' ' ' TYR . 2.1 p-10 -86.08 -0.53 55.84 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 111.936 0.347 . . . . 64.11 111.936 178.124 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.553 ' HA ' HG22 ' A' ' 104' ' ' VAL . 57.9 t -101.07 106.59 19.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 N-CA-C 107.908 -1.145 . . . . 72.3 107.908 174.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 26.2 m -136.74 133.41 36.01 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.195 0.598 . . . . 74.23 109.622 -175.18 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 40.5 m95 -87.77 152.91 21.76 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-O 121.703 0.763 . . . . 74.22 111.826 -179.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -149.89 79.2 1.37 Allowed 'General case' 0 C--O 1.242 0.688 0 C-N-CA 126.254 1.821 . . . . 74.11 106.57 -175.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 72.99 -117.38 5.96 Favored Glycine 0 CA--C 1.531 1.091 0 CA-C-N 115.149 -0.932 . . . . 73.23 112.173 -173.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -97.43 11.16 37.68 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.764 0.825 . . . . 73.02 110.912 175.829 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 61.6 m -119.58 125.87 49.83 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.663 0.785 . . . . 50.24 109.976 -178.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.506 HG11 HD13 ' A' ' 81' ' ' LEU . 8.9 p -96.02 116.78 38.72 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.763 0 N-CA-C 107.866 -1.161 . . . . 65.11 107.866 170.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 4.3 m -99.64 108.14 20.44 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 108.337 -0.986 . . . . 62.54 108.337 -177.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.583 HG13 HD22 ' A' ' 94' ' ' ASN . 83.6 t -115.12 112.28 39.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 C-N-CA 124.819 1.248 . . . . 50.25 108.549 -177.609 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.426 ' HG2' ' HA ' ' A' ' 57' ' ' ARG . 28.1 mt-10 -111.22 152.23 27.35 Favored 'General case' 0 C--O 1.241 0.631 0 N-CA-C 109.484 -0.562 . . . . 70.04 109.484 177.561 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -170.39 145.87 9.41 Favored Glycine 0 N--CA 1.449 -0.436 0 CA-C-N 115.748 -0.66 . . . . 74.51 112.189 177.799 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 57.8 tt0 -71.54 108.58 5.0 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 109.025 -0.731 . . . . 75.44 109.025 168.238 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.582 HD21 ' HG2' ' A' ' 49' ' ' LYS . 49.5 tp -83.03 96.35 8.32 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 107.424 -1.325 . . . . 72.24 107.424 168.626 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 38.79 -78.9 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 126.479 1.911 . . . . 71.42 114.133 177.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 126.5 34.29 0.62 Allowed Glycine 0 C--N 1.344 1.022 0 N-CA-C 110.105 -1.198 . . . . 73.14 110.105 -172.211 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 2.8 m -62.57 92.63 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 CA-C-O 122.197 0.998 . . . . 74.45 111.902 -177.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -134.89 98.42 4.02 Favored 'General case' 0 C--O 1.239 0.539 0 CA-C-N 114.332 -1.304 . . . . 71.35 107.872 176.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 80.0 mt -86.27 101.08 12.74 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.15 0.98 . . . . 75.33 109.723 -175.008 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -73.49 -51.98 15.23 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 124.001 0.921 . . . . 72.01 112.327 -170.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 22.2 t-80 -116.65 -32.13 5.28 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.344 0.658 . . . . 71.34 109.886 178.518 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 34.0 m80 -82.03 57.32 3.46 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 123.535 0.734 . . . . 63.22 110.018 174.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 38.7 p-80 -53.9 152.39 5.67 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 124.654 1.181 . . . . 55.4 112.944 -171.046 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' HIS . . . . . . . . . . . . . 80.4 t60 -68.19 104.24 1.76 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 123.387 0.675 . . . . 74.43 110.439 -178.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' HIS . . . . . . . . . . . . . 21.9 m-70 -69.67 173.84 5.71 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.943 0.897 . . . . 74.13 110.572 172.165 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 81.3 t60 . . . . . 0 C--O 1.254 1.295 0 C-N-CA 122.919 0.487 . . . . 72.32 110.548 179.605 . . . . . . . . 0 0 . 1 stop_ save_