data_2mhj_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 2mhj _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 ' 20' ' ' VAL . . . . . . . . . . . . . 39.2 t . . . . . 0 N--CA 1.448 -0.527 0 N-CA-C 110.021 -0.363 . . . . 1.22 110.021 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.408 ' O ' ' HA2' ' A' ' 86' ' ' GLY . 35.9 tp -71.32 102.27 2.56 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.138 -0.689 . . . . 1.53 109.138 174.114 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.458 HG12 ' CE1' ' A' ' 25' ' ' PHE . 75.7 t -76.15 115.54 17.87 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 CA-C-N 115.585 -0.734 . . . . 1.03 110.727 -176.707 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -98.88 -32.6 11.25 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.905 -0.589 . . . . 1.7 109.848 176.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 7.1 ptm180 -158.68 163.09 37.18 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.083 -0.508 . . . . 2.48 110.963 178.426 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.566 ' CE2' ' HG ' ' A' ' 42' ' ' LEU . 42.0 m-85 -111.18 139.12 46.82 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.534 -0.757 . . . . 0.35 109.78 176.051 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.584 ' HA ' HE21 ' A' ' 26' ' ' GLN . 0.0 OUTLIER -120.59 128.99 53.56 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 109.559 -0.534 . . . . 1.64 109.559 176.178 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.47 ' HG ' HD21 ' A' ' 38' ' ' LEU . 3.8 mm? -102.65 129.52 49.27 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.278 0.561 . . . . 1.03 110.013 -179.007 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 40.8 t -121.04 121.67 38.44 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.535 -0.757 . . . . 1.57 110.227 -177.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 101.51 -7.46 56.03 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.835 -0.698 . . . . 0.27 112.295 -179.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 20.6 p-10 -77.49 123.34 26.44 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.139 0.495 . . . . 0.58 110.935 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.42 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 30.1 mmm180 -124.33 -26.71 3.89 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.043 -0.526 . . . . 3.08 110.226 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -81.34 -36.02 30.21 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.886 -0.597 . . . . 2.59 110.835 -179.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.438 ' HD2' ' CZ ' ' A' ' 66' ' ' TYR . 78.3 m-85 -130.92 135.39 47.62 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.139 -0.482 . . . . 0.29 110.336 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.576 ' OD1' ' HB3' ' A' ' 36' ' ' ARG . 1.7 p30 -77.04 169.45 18.32 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.904 -0.589 . . . . 0.62 111.16 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.505 ' O ' HD13 ' A' ' 39' ' ' LEU . 4.2 m-20 -52.81 -52.58 56.35 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 123.284 0.365 . . . . 0.59 110.387 -179.348 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.576 ' HB3' ' OD1' ' A' ' 34' ' ' ASP . 6.7 ttp180 -45.32 -49.57 12.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.467 -0.788 . . . . 4.12 111.975 179.456 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -59.77 -41.96 92.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.175 -0.466 . . . . 3.02 111.372 -179.207 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.47 HD21 ' HG ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -82.51 -25.15 33.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.3 -0.409 . . . . 1.03 111.445 -175.799 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.505 HD13 ' O ' ' A' ' 35' ' ' ASP . 2.5 mp -63.11 -34.6 77.94 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.363 -0.38 . . . . 2.38 111.806 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.91 -21.99 66.42 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.478 -0.328 . . . . 1.11 111.211 178.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.465 ' HB2' ' O ' ' A' ' 38' ' ' LEU . 6.4 mt -69.87 -25.41 63.7 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.072 0.463 . . . . 0.99 110.202 175.033 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.566 ' HG ' ' CE2' ' A' ' 25' ' ' PHE . 0.5 OUTLIER -108.04 14.21 25.39 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.799 -0.637 . . . . 1.07 110.171 -179.29 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 13.0 p80 -47.53 -27.02 1.61 Allowed 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 113.489 0.922 . . . . 0.66 113.489 -174.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -104.21 11.29 35.14 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.486 0.55 . . . . 0.6 112.486 -173.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 81.6 mt -102.38 -56.95 0.11 Allowed Pre-proline 0 C--N 1.323 -0.577 0 N-CA-C 114.005 1.113 . . . . 1.53 114.005 -173.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.451 ' HB3' HG11 ' A' ' 22' ' ' VAL . 74.1 Cg_endo -72.26 164.07 36.75 Favored 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 121.36 1.373 . . . . 0.33 113.145 -166.229 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 91.96 -0.36 72.7 Favored Glycine 0 N--CA 1.446 -0.684 0 N-CA-C 110.331 -1.108 . . . . 0.31 110.331 -170.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -129.57 171.33 12.71 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.075 -0.562 . . . . 2.2 109.77 -179.189 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -99.15 92.15 5.33 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.481 0.658 . . . . 1.12 110.168 178.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -83.18 135.81 34.66 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 114.876 -1.056 . . . . 1.08 109.477 -179.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.569 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 28.2 p-10 -83.78 170.7 13.88 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.586 -0.524 . . . . 1.77 109.586 178.15 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.512 ' O ' ' HD2' ' A' ' 56' ' ' HIS . 3.6 mm? -55.33 -42.19 73.46 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.644 0.259 . . . . 1.6 111.07 -176.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 11.5 m -59.48 -45.74 90.81 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.335 -0.393 . . . . 1.26 111.193 -178.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -66.78 -33.95 76.75 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.891 0.377 . . . . 1.74 110.767 176.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 82.2 mt -63.36 -42.68 98.91 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.021 -0.536 . . . . 1.81 110.854 177.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.512 ' HD2' ' O ' ' A' ' 52' ' ' LEU . 55.3 m-70 -69.76 -35.75 75.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.82 0.343 . . . . 3.73 110.416 177.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.4 -33.86 76.83 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.24 -0.436 . . . . 1.07 110.934 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -57.45 -39.13 75.64 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.827 -0.624 . . . . 1.03 111.012 177.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.44 -30.71 69.65 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.778 -0.646 . . . . 1.0 111.322 -178.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.91 -32.03 73.55 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.213 -0.449 . . . . 1.08 110.838 -179.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 77.5 mtt180 -58.84 -42.08 88.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.828 -0.623 . . . . 0.42 110.172 176.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.462 HD11 HD22 ' A' ' 42' ' ' LEU . 62.3 mt -77.37 -35.86 22.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.363 -0.835 . . . . 1.1 110.761 -175.642 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.513 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -60.97 -36.17 91.79 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.859 -0.686 . . . . 0.22 112.197 178.456 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -80.61 -31.81 36.53 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.883 0.373 . . . . 2.17 110.47 177.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.434 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 90.8 t80 -54.45 -50.75 66.94 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.825 -0.625 . . . . 0.25 110.627 177.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . 0.438 ' CZ ' ' HD2' ' A' ' 33' ' ' PHE . 8.5 m-85 -59.53 -39.64 84.59 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.589 -0.732 . . . . 0.66 111.313 178.704 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . 0.513 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 77.3 mt-30 -60.39 -38.29 83.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.252 -0.431 . . . . 1.96 111.267 -177.713 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -73.08 -19.35 61.18 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.031 0.443 . . . . 1.69 111.071 -179.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.434 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 73.6 mmtt -88.38 -4.43 58.66 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.147 -0.479 . . . . 1.23 110.058 178.079 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.31 -8.27 30.76 Favored Glycine 0 N--CA 1.448 -0.53 0 CA-C-N 115.84 -0.618 . . . . 0.34 112.402 178.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . 0.438 ' HB2' ' HB3' ' A' ' 66' ' ' TYR . 44.3 m-85 -90.53 72.51 6.89 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.235 0.541 . . . . 0.8 109.795 -179.452 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 21.2 t -72.53 -24.63 21.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.735 -0.666 . . . . 1.13 110.85 -175.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 96.1 mt -80.72 -9.89 59.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.837 -0.619 . . . . 2.34 110.849 178.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.544 ' HA ' ' O ' ' A' ' 93' ' ' LEU . . . -85.94 139.95 30.77 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.065 -0.516 . . . . 1.08 111.437 -176.166 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 13.4 tpt180 -147.32 131.42 17.31 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.765 -0.652 . . . . 2.16 110.044 177.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -102.02 132.88 47.61 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.806 -0.442 . . . . 0.99 109.806 175.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 48.1 p90 -139.55 142.84 37.18 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.688 0.28 . . . . 0.43 110.316 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 89' ' ' ARG . 7.0 tt -92.98 106.95 21.26 Favored Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 109.167 -0.679 . . . . 1.15 109.167 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo . . . . . 0 C--N 1.342 0.215 0 C-N-CA 123.029 2.486 . . . . 1.12 113.009 -172.593 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . 0.408 ' HA2' ' O ' ' A' ' 21' ' ' LEU . . . . . . . . 0 N--CA 1.444 -0.777 0 N-CA-C 111.638 -0.585 . . . . 0.72 111.638 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 17.8 m -95.85 121.65 37.8 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.034 0.445 . . . . 1.12 110.424 176.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 35.0 m -104.0 137.33 33.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 109.283 -0.636 . . . . 1.1 109.283 174.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . 0.464 ' O ' ' HG ' ' A' ' 78' ' ' LEU . 27.4 ttm180 -114.38 135.29 54.25 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.447 -0.501 . . . . 3.51 111.404 -176.4 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.413 ' HB ' HD11 ' A' ' 27' ' ' LEU . 59.4 mt -120.26 136.68 56.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.564 -0.744 . . . . 0.99 110.239 179.013 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 44.9 mm-40 -92.97 120.49 33.34 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.862 -0.422 . . . . 1.33 109.862 179.022 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 40.0 t -102.07 102.05 13.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 116.113 -0.494 . . . . 1.04 110.72 -179.023 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.544 ' O ' ' HA ' ' A' ' 74' ' ' ALA . 61.3 tp -86.48 88.66 7.68 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.968 -0.56 . . . . 1.2 109.497 175.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.42 ' CD ' ' H ' ' A' ' 31' ' ' ARG . 50.1 mt-10 -74.22 -34.21 63.62 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.207 0.527 . . . . 0.49 110.389 -178.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.184 0 CA-C-O 118.322 -1.265 . . . . 1.39 111.118 -178.864 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 59.1 t . . . . . 0 N--CA 1.448 -0.534 0 N-CA-C 110.034 -0.358 . . . . 1.22 110.034 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.434 ' HB2' ' HG2' ' A' ' 49' ' ' GLU . 48.7 tp -65.82 115.99 6.52 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.353 -0.385 . . . . 1.53 110.081 175.41 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.567 HG12 ' CE1' ' A' ' 25' ' ' PHE . 51.7 t -100.69 136.52 31.83 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 CA-C-N 115.902 -0.59 . . . . 1.03 109.692 177.368 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -118.64 -24.46 6.72 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 109.797 -0.446 . . . . 1.7 109.797 176.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 16.3 ptp180 -162.69 154.3 18.01 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.06 -0.518 . . . . 2.48 110.67 175.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.567 ' CE1' HG12 ' A' ' 22' ' ' VAL . 33.2 m-85 -106.32 145.54 31.53 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.909 -0.587 . . . . 0.35 110.498 178.093 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.457 ' O ' ' HA ' ' A' ' 89' ' ' ARG . 50.1 tp60 -125.08 129.39 50.14 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 109.371 -0.603 . . . . 1.64 109.371 176.401 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.423 HD13 ' HB ' ' A' ' 90' ' ' ILE . 4.1 mm? -103.31 136.93 42.16 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.675 -0.491 . . . . 1.03 109.675 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.5 t -124.76 128.98 49.6 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.384 -0.371 . . . . 1.57 110.05 -179.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 96.48 -11.07 67.03 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.632 -0.794 . . . . 0.27 112.562 178.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 6.2 p-10 -67.67 144.95 55.25 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.906 0.384 . . . . 0.58 110.61 178.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.443 ' HB3' ' OE1' ' A' ' 94' ' ' GLU . 21.8 tpp180 -143.57 -37.72 0.34 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.795 -0.639 . . . . 3.08 110.161 179.355 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -68.62 -43.67 75.87 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.669 -0.696 . . . . 2.59 110.517 179.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -125.08 151.94 45.0 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.991 -0.744 . . . . 0.29 108.991 175.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -96.78 172.45 7.88 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.199 -0.297 . . . . 0.62 110.199 -178.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.516 ' O ' HD13 ' A' ' 39' ' ' LEU . 4.9 m-20 -50.7 -51.35 50.43 Favored 'General case' 0 C--O 1.221 -0.404 0 O-C-N 123.31 0.381 . . . . 0.59 110.785 -178.649 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 72.9 mtp180 -55.38 -33.67 63.66 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.946 -0.57 . . . . 4.12 111.967 -175.038 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 31.5 tpt85 -77.22 -41.91 39.46 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.683 -0.235 . . . . 3.02 110.829 -178.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.419 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -76.17 -27.37 56.92 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.983 0.421 . . . . 1.03 110.8 -178.515 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.516 HD13 ' O ' ' A' ' 35' ' ' ASP . 3.8 mp -60.9 -30.4 70.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.868 -0.605 . . . . 2.38 111.053 176.297 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.63 -23.32 65.97 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.727 -0.67 . . . . 1.11 111.633 178.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.432 HD11 ' HA ' ' A' ' 62' ' ' ILE . 2.3 mt -75.05 -26.65 59.56 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.344 0.592 . . . . 0.99 110.3 176.574 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.484 ' HG ' ' CE2' ' A' ' 25' ' ' PHE . 0.4 OUTLIER -105.49 14.26 28.9 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.648 -0.706 . . . . 1.07 109.886 -179.086 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 8.3 p80 -51.5 -22.86 3.43 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.408 0.892 . . . . 0.66 113.408 -171.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -107.83 -0.4 21.62 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.816 0.302 . . . . 0.6 111.816 -174.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 64.1 mt -84.45 -54.05 0.49 Allowed Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 113.462 0.912 . . . . 1.53 113.462 -173.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.438 ' HB3' HG11 ' A' ' 22' ' ' VAL . 73.8 Cg_endo -74.22 155.45 46.74 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 121.275 1.316 . . . . 0.33 112.051 -170.275 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 99.23 -17.14 58.36 Favored Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 109.444 -1.462 . . . . 0.31 109.444 -167.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 16.4 mt-30 -116.4 173.3 6.68 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.267 -0.966 . . . . 2.2 109.532 176.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.434 ' HG2' ' HB2' ' A' ' 21' ' ' LEU . 43.0 mt-10 -107.51 106.93 17.55 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.234 0.54 . . . . 1.12 109.972 178.554 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.473 HD13 ' NE2' ' A' ' 54' ' ' GLN . 2.6 mm? -93.56 126.46 38.73 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.911 -1.04 . . . . 1.08 110.318 -173.646 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.529 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 4.0 p30 -77.25 167.79 21.13 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 121.266 -0.174 . . . . 1.77 110.597 178.57 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.408 ' HA ' HD12 ' A' ' 55' ' ' LEU . 4.2 mm? -46.43 -45.06 17.8 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.453 0.538 . . . . 1.6 112.453 -176.181 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 33.2 m -56.59 -46.77 80.64 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.697 0.284 . . . . 1.26 111.032 -178.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.473 ' NE2' HD13 ' A' ' 50' ' ' LEU . 9.8 mt-30 -77.47 -23.72 50.34 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.422 -0.354 . . . . 1.74 111.348 -178.62 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 78.8 mt -61.41 -53.42 56.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.658 0.266 . . . . 1.81 110.366 176.369 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 34.6 p80 -77.38 -23.65 50.73 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.392 -0.523 . . . . 3.73 111.125 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.21 -32.15 73.62 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.139 0.495 . . . . 1.07 110.044 174.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.02 -41.36 92.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.62 -0.718 . . . . 1.03 110.253 175.007 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.16 -36.79 82.56 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.529 -0.76 . . . . 1.0 110.659 178.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.56 -34.6 78.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.911 -0.586 . . . . 1.08 111.09 179.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -57.31 -41.54 80.06 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.419 0.628 . . . . 0.42 110.034 175.021 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.46 HD13 HD23 ' A' ' 42' ' ' LEU . 76.9 mt -75.9 -36.72 33.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.154 -0.93 . . . . 1.1 110.717 -177.031 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.577 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -58.9 -47.98 87.88 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.688 -0.767 . . . . 0.22 111.689 177.038 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -68.35 -30.92 69.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.711 0.291 . . . . 2.17 110.552 178.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.418 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 86.9 t80 -57.79 -49.37 76.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.998 -0.546 . . . . 0.25 110.376 177.751 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 -61.58 -46.66 88.95 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.686 -0.688 . . . . 0.66 111.169 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . 0.577 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 15.7 mt-30 -56.84 -40.42 76.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.16 0.505 . . . . 1.96 110.536 179.452 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -63.72 -30.07 71.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.264 -0.88 . . . . 1.69 110.73 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.418 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 75.8 mmtt -90.04 6.8 40.76 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.902 -0.59 . . . . 1.23 110.927 -178.681 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 104.31 -12.18 51.49 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.953 -0.641 . . . . 0.34 112.914 176.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -88.76 70.16 8.72 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.212 0.529 . . . . 0.8 109.602 -179.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 26.1 t -71.1 -24.33 24.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.759 -0.655 . . . . 1.13 110.579 -176.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 50.3 tp -80.75 -7.16 59.29 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.668 -0.696 . . . . 2.34 110.389 178.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -99.92 134.86 42.21 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.183 0.516 . . . . 1.08 111.466 -176.234 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 16.7 mmm180 -141.86 164.28 30.63 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.553 -0.749 . . . . 2.16 109.509 176.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -127.53 137.5 52.64 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.971 -0.381 . . . . 0.99 109.971 179.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 48.1 p90 -132.39 143.16 49.64 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.9 0.381 . . . . 0.43 110.298 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 8.1 tt -96.18 110.83 54.21 Favored Pre-proline 0 C--N 1.32 -0.705 0 N-CA-C 109.164 -0.68 . . . . 1.15 109.164 178.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo . . . . . 0 N--CA 1.463 -0.282 0 C-N-CA 122.677 2.251 . . . . 1.12 111.701 177.569 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.709 0 N-CA-C 111.271 -0.732 . . . . 0.72 111.271 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 25.8 m -100.65 120.57 40.26 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.288 -0.634 . . . . 1.12 109.288 173.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 29.6 m -116.36 131.43 68.94 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.938 0 N-CA-C 109.847 -0.427 . . . . 1.1 109.847 179.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . 0.457 ' HA ' ' O ' ' A' ' 26' ' ' GLN . 25.0 ttp180 -106.26 128.71 54.16 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.351 0.596 . . . . 3.51 111.221 -174.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.423 ' HB ' HD13 ' A' ' 27' ' ' LEU . 63.1 mt -113.89 134.83 55.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.042 -0.981 . . . . 0.99 109.187 177.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -96.49 128.26 43.26 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.216 0.531 . . . . 1.33 110.693 -179.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.406 ' CG2' HD11 ' A' ' 27' ' ' LEU . 47.7 t -102.63 124.55 56.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.445 -0.798 . . . . 1.04 110.259 -178.464 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 56.7 tp -107.85 99.93 9.35 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.525 -0.546 . . . . 1.2 109.525 177.021 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.443 ' OE1' ' HB3' ' A' ' 31' ' ' ARG . 69.4 mt-10 -87.61 33.64 0.7 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.889 -0.596 . . . . 0.49 111.045 -175.535 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.901 0 CA-C-O 118.65 -1.084 . . . . 1.39 112.13 179.882 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 32.8 t . . . . . 0 N--CA 1.45 -0.437 0 N-CA-C 110.189 -0.301 . . . . 1.22 110.189 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.497 ' O ' ' HA2' ' A' ' 86' ' ' GLY . 24.7 tp -72.91 92.0 1.59 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.081 -0.711 . . . . 1.53 109.081 174.261 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.552 ' HA ' ' O ' ' A' ' 86' ' ' GLY . 98.8 t -70.66 123.8 25.46 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.048 0 CA-C-N 115.295 -0.866 . . . . 1.03 111.149 -174.745 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.405 ' HG2' ' HA3' ' A' ' 86' ' ' GLY . 10.7 mmtp -80.84 -40.45 24.86 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.544 -0.753 . . . . 1.7 109.449 176.1 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 4.6 ptp180 -174.59 169.57 3.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 114.493 -1.23 . . . . 2.48 109.392 -179.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.537 ' CE1' HG11 ' A' ' 22' ' ' VAL . 33.6 m-85 -106.04 125.1 50.58 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.002 -0.544 . . . . 0.35 110.525 178.527 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.4 ' O ' ' HA ' ' A' ' 89' ' ' ARG . 11.9 tp60 -104.63 127.51 52.4 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.325 -0.852 . . . . 1.64 108.721 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.423 HD11 ' HB ' ' A' ' 90' ' ' ILE . 3.7 mm? -102.97 134.91 45.62 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.148 0.499 . . . . 1.03 110.321 -177.591 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.444 ' HB2' ' HD3' ' A' ' 89' ' ' ARG . 28.4 t -127.76 135.04 49.59 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.763 -0.653 . . . . 1.57 109.797 -178.504 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 91.11 -11.36 72.4 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.672 -0.775 . . . . 0.27 112.646 179.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 15.5 p-10 -75.17 137.64 41.46 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.75 0.31 . . . . 0.58 110.688 179.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 30.1 tpt180 -128.2 -44.58 1.42 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.406 -0.361 . . . . 3.08 110.942 177.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.451 ' HG2' ' HH ' ' A' ' 71' ' ' TYR . 21.8 tp60 -64.85 -40.85 95.81 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.972 0.415 . . . . 2.59 110.612 -177.598 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 -125.63 133.37 52.24 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.936 -0.764 . . . . 0.29 108.936 177.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -88.76 178.08 6.56 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.613 -0.435 . . . . 0.62 110.629 -178.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -47.61 -48.83 28.2 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 123.743 0.652 . . . . 0.59 111.909 -176.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 79.0 mtm180 -55.17 -38.22 68.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.835 -0.621 . . . . 4.12 111.799 -173.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 37.1 tpt85 -77.57 -38.65 47.99 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.346 -0.388 . . . . 3.02 110.883 -176.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.447 ' HA ' HD13 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -81.67 -32.57 31.74 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 111.982 0.364 . . . . 1.03 111.982 -174.319 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.5 pp -68.19 -18.83 64.69 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.913 -0.315 . . . . 2.38 110.92 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.46 -24.04 63.74 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.248 -0.433 . . . . 1.11 110.653 177.16 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.447 HD13 ' HA ' ' A' ' 38' ' ' LEU . 1.9 mt -67.44 -22.84 65.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.331 0.586 . . . . 0.99 110.143 175.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.451 ' CD1' ' HD2' ' A' ' 61' ' ' ARG . 0.7 OUTLIER -111.93 13.26 20.83 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.712 -0.676 . . . . 1.07 110.403 -179.041 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 5.4 p80 -51.11 -21.87 2.16 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 113.488 0.921 . . . . 0.66 113.488 -172.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -94.88 -8.89 35.9 Favored 'General case' 0 C--N 1.328 -0.359 0 O-C-N 122.261 -0.274 . . . . 0.6 111.643 -175.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.403 ' O ' HD23 ' A' ' 50' ' ' LEU . 87.7 mt -87.21 -58.18 0.29 Allowed Pre-proline 0 C--N 1.325 -0.495 0 N-CA-C 113.601 0.963 . . . . 1.53 113.601 -171.188 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.417 ' HB3' HG13 ' A' ' 22' ' ' VAL . 61.0 Cg_endo -68.81 156.46 65.36 Favored 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 121.406 1.404 . . . . 0.33 112.439 -168.613 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 96.67 -14.89 63.59 Favored Glycine 0 N--CA 1.446 -0.69 0 N-CA-C 109.895 -1.282 . . . . 0.31 109.895 -168.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -120.23 172.95 7.42 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 114.802 -0.699 . . . . 2.2 109.699 176.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -97.21 108.92 21.75 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.902 -0.59 . . . . 1.12 110.307 177.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.44 HD22 ' N ' ' A' ' 50' ' ' LEU . 2.6 mm? -99.12 131.78 44.91 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.902 -0.59 . . . . 1.08 109.763 -179.472 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.532 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 8.1 p30 -75.31 163.38 27.53 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.157 -0.474 . . . . 1.77 110.819 179.486 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.4 HD11 HD12 ' A' ' 55' ' ' LEU . 4.4 mm? -52.03 -43.03 63.54 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 123.258 0.349 . . . . 1.6 111.77 -176.755 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.402 ' HB2' ' OD1' ' A' ' 51' ' ' ASN . 5.1 m -56.87 -49.18 76.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.882 0.372 . . . . 1.26 110.303 178.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 11.7 mt-30 -68.0 -29.19 68.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.011 -0.54 . . . . 1.74 111.467 178.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.532 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 77.4 mt -65.42 -43.05 91.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.998 0.428 . . . . 1.81 110.236 176.323 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -72.35 -33.97 67.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.512 -0.313 . . . . 3.73 110.465 178.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.25 -30.98 72.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.076 0.465 . . . . 1.07 110.617 177.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.53 -42.15 98.39 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.775 -0.648 . . . . 1.03 110.74 176.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.61 -34.41 78.16 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.916 -0.584 . . . . 1.0 110.821 178.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.32 -36.52 82.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.915 -0.584 . . . . 1.08 111.128 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.451 ' HD2' ' CD1' ' A' ' 42' ' ' LEU . 94.0 mtt180 -57.89 -41.41 82.48 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.107 -0.497 . . . . 0.42 110.428 177.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.418 ' O ' ' HB3' ' A' ' 65' ' ' PHE . 68.3 mt -78.42 -34.9 18.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.526 -0.761 . . . . 1.1 110.533 -176.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.435 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -59.85 -47.39 91.23 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.765 -0.731 . . . . 0.22 111.692 176.279 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -71.28 -24.25 62.12 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.505 0.193 . . . . 2.17 110.917 177.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.427 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 93.1 t80 -60.36 -49.41 77.7 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.116 0.484 . . . . 0.25 110.019 176.673 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 8.1 m-85 -62.2 -42.27 99.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.593 -0.73 . . . . 0.66 110.721 176.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . 0.435 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 49.8 mt-30 -61.06 -36.0 78.45 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.109 -0.496 . . . . 1.96 111.093 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -62.22 -35.47 78.98 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.1 0.476 . . . . 1.69 110.347 176.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.427 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 73.1 mmtt -83.23 4.75 25.53 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.845 -0.616 . . . . 1.23 110.98 -176.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 98.97 -2.99 58.39 Favored Glycine 0 N--CA 1.449 -0.494 0 CA-C-N 116.01 -0.541 . . . . 0.34 112.706 177.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . 0.451 ' HH ' ' HG2' ' A' ' 32' ' ' GLN . 45.9 m-85 -88.58 75.18 8.35 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.336 0.588 . . . . 0.8 109.721 -179.828 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 21.9 t -74.07 -23.87 18.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.561 -0.745 . . . . 1.13 110.313 -177.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 86.0 mt -81.31 -3.03 51.31 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.848 -0.615 . . . . 2.34 110.806 178.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -102.23 147.16 26.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.918 -0.583 . . . . 1.08 110.996 -178.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 26.1 tpt180 -160.19 136.15 8.52 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.944 -0.571 . . . . 2.16 109.73 177.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -99.11 140.54 33.11 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.646 -0.252 . . . . 0.99 110.438 179.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 46.3 p90 -137.3 155.07 49.89 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.909 0.385 . . . . 0.43 110.407 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 9.9 tt -110.84 107.07 57.93 Favored Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 109.778 -0.453 . . . . 1.15 109.778 -178.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo . . . . . 0 C--O 1.233 0.268 0 C-N-CA 123.004 2.469 . . . . 1.12 112.298 -178.679 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . 0.552 ' O ' ' HA ' ' A' ' 22' ' ' VAL . . . . . . . . 0 N--CA 1.449 -0.495 0 N-CA-C 111.78 -0.528 . . . . 0.72 111.78 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 85.5 m -72.87 120.96 19.23 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 117.191 0.496 . . . . 1.12 110.315 177.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 34.2 m -102.33 138.16 27.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 109.858 -0.423 . . . . 1.1 109.858 179.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . 0.444 ' HD3' ' HB2' ' A' ' 28' ' ' SER . 23.0 ttm180 -107.19 129.01 54.91 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.15 0.5 . . . . 3.51 111.107 -177.476 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.423 ' HB ' HD11 ' A' ' 27' ' ' LEU . 56.6 mt -113.65 130.74 67.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.543 -0.753 . . . . 0.99 109.413 176.596 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -95.22 125.4 39.84 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.373 0.606 . . . . 1.33 110.36 -179.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 71.7 t -98.71 103.47 14.74 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 115.287 -0.869 . . . . 1.04 110.434 -177.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 52.3 tp -85.93 93.62 8.99 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.396 -0.594 . . . . 1.2 109.396 176.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -72.17 -18.98 61.82 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.121 -0.491 . . . . 0.49 110.423 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.157 0 CA-C-O 117.976 -1.458 . . . . 1.39 111.037 179.398 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 75.1 t . . . . . 0 N--CA 1.443 -0.781 0 N-CA-C 109.67 -0.492 . . . . 1.22 109.67 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.589 ' O ' ' HA2' ' A' ' 86' ' ' GLY . 50.8 tp -71.3 91.85 1.0 Allowed 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.574 -0.528 . . . . 1.53 109.574 176.175 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.581 HG11 ' CE1' ' A' ' 25' ' ' PHE . 61.7 t -68.71 113.54 4.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.932 0 CA-C-N 115.339 -0.846 . . . . 1.03 110.582 -178.132 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -92.84 -32.36 14.65 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.545 -0.752 . . . . 1.7 109.168 175.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 12.5 ptp180 -163.87 158.5 19.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.562 -0.745 . . . . 2.48 110.342 -179.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.581 ' CE1' HG11 ' A' ' 22' ' ' VAL . 31.9 m-85 -105.25 142.0 35.79 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.985 -0.552 . . . . 0.35 109.822 176.018 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 45.0 tp60 -123.16 128.27 49.83 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.198 -0.667 . . . . 1.64 109.198 178.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.422 HD13 ' HB ' ' A' ' 90' ' ' ILE . 3.9 mm? -103.36 133.39 48.5 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.124 0.488 . . . . 1.03 110.436 -177.814 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.469 ' O ' ' HA ' ' A' ' 91' ' ' GLU . 23.1 t -127.51 126.2 41.81 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.899 -0.592 . . . . 1.57 109.929 -178.332 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 100.97 -15.17 58.31 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.545 -0.836 . . . . 0.27 112.372 179.086 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 15.1 p-10 -72.38 136.21 46.06 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.754 0.312 . . . . 0.58 110.663 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.8 tpp180 -130.12 -39.28 1.37 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.248 -0.433 . . . . 3.08 110.708 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 24.0 tp60 -68.41 -40.24 81.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.012 0.434 . . . . 2.59 110.634 -179.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -126.59 134.66 50.75 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.027 -0.533 . . . . 0.29 109.64 179.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -79.31 176.19 9.91 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.943 -0.571 . . . . 0.62 111.593 -176.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.508 ' O ' HD13 ' A' ' 39' ' ' LEU . 6.4 m-20 -55.99 -57.01 13.9 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 116.147 -0.479 . . . . 0.59 110.991 -178.502 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 74.2 mtp180 -58.03 -34.77 70.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.233 -0.439 . . . . 4.12 111.502 -175.147 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 15.0 tpt180 -62.26 -46.14 90.14 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.096 -0.502 . . . . 3.02 110.684 176.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.444 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -78.08 -27.54 48.59 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.138 -0.483 . . . . 1.03 111.311 -178.139 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.508 HD13 ' O ' ' A' ' 35' ' ' ASP . 1.8 mp -57.18 -35.15 69.24 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.085 -0.507 . . . . 2.38 111.318 177.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.5 -25.51 66.13 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.042 -0.526 . . . . 1.11 111.697 178.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.444 HD12 ' HA ' ' A' ' 38' ' ' LEU . 4.0 mt -69.62 -28.06 65.61 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.155 0.503 . . . . 0.99 110.45 177.014 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.497 ' HG ' ' CE2' ' A' ' 25' ' ' PHE . 0.4 OUTLIER -106.53 13.27 28.55 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.898 -0.592 . . . . 1.07 110.164 -178.299 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 9.3 p80 -48.86 -26.11 2.26 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.821 1.045 . . . . 0.66 113.821 -172.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -105.08 5.97 32.89 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 111.98 0.363 . . . . 0.6 111.98 -174.101 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 84.3 mt -94.67 -52.19 0.24 Allowed Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 113.84 1.052 . . . . 1.53 113.84 -173.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.426 ' HB3' HG13 ' A' ' 22' ' ' VAL . 71.8 Cg_endo -74.61 157.41 44.41 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 121.233 1.289 . . . . 0.33 112.254 -169.665 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 98.44 -5.9 60.86 Favored Glycine 0 N--CA 1.446 -0.648 0 N-CA-C 110.023 -1.231 . . . . 0.31 110.023 -169.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -121.15 170.52 9.48 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.733 -0.734 . . . . 2.2 109.085 176.253 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -100.07 107.56 19.5 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.477 -0.564 . . . . 1.12 109.477 176.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -101.01 122.91 44.36 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.595 -0.729 . . . . 1.08 110.376 -175.068 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.596 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 31.2 p-10 -72.26 166.3 22.71 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.553 -0.294 . . . . 1.77 110.805 177.587 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.452 ' HA ' HD11 ' A' ' 55' ' ' LEU . 4.6 mm? -48.34 -46.06 36.08 Favored 'General case' 0 C--N 1.329 -0.3 0 O-C-N 123.461 0.476 . . . . 1.6 111.585 -177.26 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.424 ' HA ' ' NE2' ' A' ' 56' ' ' HIS . 13.1 m -50.61 -53.53 30.01 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.878 -0.601 . . . . 1.26 111.113 178.605 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -72.7 -23.83 60.92 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.005 -0.543 . . . . 1.74 111.679 -178.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.596 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 85.5 mt -65.1 -53.0 52.18 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.579 -0.282 . . . . 1.81 110.9 179.426 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.424 ' NE2' ' HA ' ' A' ' 53' ' ' SER . 31.5 p80 -74.34 -23.46 59.04 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.396 -0.522 . . . . 3.73 111.203 -179.448 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.12 -33.85 75.23 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.989 0.423 . . . . 1.07 110.516 175.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.87 -34.87 76.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.782 -0.644 . . . . 1.03 110.854 176.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.98 -30.37 69.63 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.942 -0.572 . . . . 1.0 110.887 -179.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.85 -28.9 69.87 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.98 -0.555 . . . . 1.08 110.829 179.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 78.0 mtt180 -63.06 -39.84 95.91 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.161 0.505 . . . . 0.42 110.129 176.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.44 HD11 HD22 ' A' ' 42' ' ' LEU . 78.6 mt -79.05 -36.32 18.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.467 -0.788 . . . . 1.1 110.726 -177.294 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.629 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -59.94 -46.9 93.32 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.389 -0.91 . . . . 0.22 111.038 174.579 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.419 ' O ' ' HG3' ' A' ' 68' ' ' GLU . 21.6 t70 -63.51 -37.52 87.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.624 -0.288 . . . . 2.17 110.653 176.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.404 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 82.8 t80 -53.22 -53.5 49.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.918 -0.583 . . . . 0.25 110.834 177.003 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -59.63 -40.52 87.89 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.709 -0.678 . . . . 0.66 111.184 178.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . 0.629 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 78.4 mt-30 -61.69 -37.89 85.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.483 -0.326 . . . . 1.96 111.226 -178.451 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.419 ' HG3' ' O ' ' A' ' 64' ' ' ASP . 44.0 mt-10 -70.27 -19.67 63.1 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.058 0.456 . . . . 1.69 110.658 178.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.404 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 75.3 mmtt -90.74 6.47 43.98 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.022 -0.536 . . . . 1.23 110.326 177.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 97.54 -8.95 64.38 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 121.06 -0.59 . . . . 0.34 112.555 177.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -88.46 73.29 8.75 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.381 0.61 . . . . 0.8 109.8 -178.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 23.8 t -71.31 -28.57 32.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.45 -0.795 . . . . 1.13 110.927 -176.039 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 10.8 mp -82.4 -3.47 55.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.282 -0.417 . . . . 2.34 110.92 179.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -91.39 136.24 33.25 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.073 -0.512 . . . . 1.08 110.494 179.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 17.1 tpt180 -149.03 131.73 15.94 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.945 -0.57 . . . . 2.16 110.071 -179.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.75 138.36 36.02 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.029 -0.532 . . . . 0.99 109.93 176.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 52.9 p90 -137.45 155.49 49.26 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.555 -0.535 . . . . 0.43 109.555 179.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.8 tt -111.59 108.91 56.1 Favored Pre-proline 0 C--N 1.318 -0.782 0 N-CA-C 109.64 -0.504 . . . . 1.15 109.64 -179.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . 0.492 ' HG3' ' OE2' ' A' ' 91' ' ' GLU . 36.8 Cg_endo . . . . . 0 C--O 1.234 0.319 0 C-N-CA 122.768 2.312 . . . . 1.12 112.165 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . 0.589 ' HA2' ' O ' ' A' ' 21' ' ' LEU . . . . . . . . 0 N--CA 1.445 -0.754 0 N-CA-C 111.94 -0.464 . . . . 0.72 111.94 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 12.5 m -98.32 121.16 39.91 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.772 0.32 . . . . 1.12 110.736 179.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 34.8 m -103.51 134.98 43.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 N-CA-C 109.658 -0.497 . . . . 1.1 109.658 176.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . 0.484 ' O ' ' HD2' ' A' ' 79' ' ' PRO . 37.4 ttp180 -111.54 115.3 28.95 Favored 'General case' 0 C--N 1.32 -0.713 0 C-N-CA 120.554 -0.458 . . . . 3.51 110.968 -177.289 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.422 ' HB ' HD13 ' A' ' 27' ' ' LEU . 60.9 mt -101.88 126.21 55.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.789 -0.641 . . . . 0.99 109.779 177.813 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.492 ' OE2' ' HG3' ' A' ' 79' ' ' PRO . 53.8 mt-10 -94.76 125.23 39.28 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.17 0.509 . . . . 1.33 110.271 -179.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 40.2 t -101.63 100.97 11.43 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-N 115.513 -0.767 . . . . 1.04 110.588 -175.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 57.7 tp -86.18 90.05 8.02 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.359 -0.608 . . . . 1.2 109.359 176.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -68.47 -27.42 66.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.685 -0.688 . . . . 0.49 110.689 -176.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.153 0 CA-C-O 118.47 -1.183 . . . . 1.39 111.584 178.695 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 41.3 t . . . . . 0 N--CA 1.449 -0.487 0 N-CA-C 109.671 -0.492 . . . . 1.22 109.671 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.401 ' HB2' ' HG2' ' A' ' 49' ' ' GLU . 45.4 tp -68.51 97.52 0.78 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.189 0.518 . . . . 1.53 110.02 177.249 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.537 HG13 ' CE1' ' A' ' 25' ' ' PHE . 57.7 t -75.68 120.33 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.996 0 CA-C-N 115.43 -0.804 . . . . 1.03 109.798 178.503 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 66.7 mttt -104.13 -22.39 13.42 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.789 -0.641 . . . . 1.7 109.362 179.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -169.34 160.09 9.19 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.56 -0.745 . . . . 2.48 110.623 178.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.537 ' CE1' HG13 ' A' ' 22' ' ' VAL . 21.4 m-85 -111.31 148.06 33.75 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.742 -0.663 . . . . 0.35 109.231 176.034 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 60.4 tp60 -129.74 134.59 47.7 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 109.541 -0.54 . . . . 1.64 109.541 174.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.412 ' HG ' HD23 ' A' ' 38' ' ' LEU . 3.4 mm? -103.62 135.09 45.85 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 121.052 0.453 . . . . 1.03 109.995 -178.527 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.526 ' O ' ' HA ' ' A' ' 91' ' ' GLU . 45.2 m -129.35 120.49 25.67 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.902 -0.59 . . . . 1.57 110.255 177.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 111.86 -11.04 27.47 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.927 -0.654 . . . . 0.27 112.038 -179.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 17.7 p-10 -84.67 139.65 31.88 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.137 0.494 . . . . 0.58 110.802 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.9 tpp180 -136.67 -32.82 0.81 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.389 -0.823 . . . . 3.08 109.898 177.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -66.48 -40.14 89.16 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.985 -0.552 . . . . 2.59 111.307 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.421 ' CZ ' ' HG3' ' A' ' 69' ' ' LYS . 82.4 m-85 -126.34 137.39 53.46 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 110.104 -0.332 . . . . 0.29 110.104 179.197 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -72.91 168.1 19.64 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.972 -0.558 . . . . 0.62 110.923 -178.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.633 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 58.1 m-20 -53.61 -55.87 22.09 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 123.402 0.439 . . . . 0.59 111.326 -175.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 61.0 ttp180 -57.73 -37.48 73.64 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.354 -0.384 . . . . 4.12 111.581 -175.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 17.1 tpt180 -59.35 -36.0 74.91 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.107 0.479 . . . . 3.02 110.452 177.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.436 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -87.14 -24.51 24.49 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.952 -0.567 . . . . 1.03 110.929 179.57 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.633 ' HG ' ' O ' ' A' ' 35' ' ' ASP . 83.4 mt -66.07 -34.59 78.41 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.6 -0.273 . . . . 2.38 111.187 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.8 -23.46 63.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.172 -0.467 . . . . 1.11 111.311 178.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.45 HD11 ' HA ' ' A' ' 62' ' ' ILE . 5.7 mt -68.22 -29.6 68.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.026 0.441 . . . . 0.99 110.581 176.026 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.491 HD22 HD13 ' A' ' 62' ' ' ILE . 0.4 OUTLIER -107.34 13.14 27.38 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.076 -0.511 . . . . 1.07 110.347 -177.629 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 5.3 p80 -50.43 -26.32 4.91 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 113.047 0.758 . . . . 0.66 113.047 -173.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -97.94 0.99 47.51 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.216 0.45 . . . . 0.6 112.216 -173.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.466 ' O ' HD22 ' A' ' 50' ' ' LEU . 79.6 mt -93.51 -56.28 0.23 Allowed Pre-proline 0 C--N 1.324 -0.538 0 N-CA-C 113.731 1.012 . . . . 1.53 113.731 -173.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.445 ' HB3' HG12 ' A' ' 22' ' ' VAL . 87.5 Cg_endo -74.54 154.8 45.11 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 121.35 1.367 . . . . 0.33 112.587 -167.291 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 103.38 -8.68 52.74 Favored Glycine 0 N--CA 1.447 -0.583 0 N-CA-C 109.95 -1.26 . . . . 0.31 109.95 -169.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -122.87 167.5 13.46 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 114.637 -0.782 . . . . 2.2 109.458 176.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.401 ' HG2' ' HB2' ' A' ' 21' ' ' LEU . 39.4 mt-10 -98.86 89.75 4.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.532 0.682 . . . . 1.12 109.502 176.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.466 HD22 ' O ' ' A' ' 45' ' ' LEU . 1.9 mm? -79.52 135.69 36.7 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.739 -1.119 . . . . 1.08 109.946 -177.666 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -81.51 161.48 23.59 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.215 -0.661 . . . . 1.77 109.215 175.2 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -46.67 -40.49 13.26 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 113.137 0.791 . . . . 1.6 113.137 -173.061 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.7 m -58.1 -38.06 75.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.931 0.396 . . . . 1.26 111.044 -178.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -72.49 -38.34 68.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.072 -0.513 . . . . 1.74 110.827 178.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.423 ' HB3' HD13 ' A' ' 78' ' ' LEU . 9.8 mp -60.56 -44.64 95.93 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.261 -0.427 . . . . 1.81 111.421 176.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 77.9 m-70 -68.35 -31.79 71.42 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.893 -0.323 . . . . 3.73 110.73 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.13 -28.89 69.74 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.23 0.538 . . . . 1.07 110.453 177.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.81 -39.58 94.72 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.519 -0.764 . . . . 1.03 111.06 177.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.22 -34.72 78.66 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.858 -0.61 . . . . 1.0 111.231 -178.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.88 -35.87 82.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 1.08 110.947 -179.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 -58.82 -38.77 79.38 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.879 -0.6 . . . . 0.42 110.446 178.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.491 HD13 HD22 ' A' ' 42' ' ' LEU . 66.2 mt -79.52 -37.77 18.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.285 -0.871 . . . . 1.1 110.871 -175.094 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -61.5 -44.65 97.72 Favored Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 120.389 -0.91 . . . . 0.22 111.65 177.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -73.96 -24.23 59.61 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.619 0.247 . . . . 2.17 110.874 178.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.459 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 91.3 t80 -59.78 -48.8 80.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.121 0.486 . . . . 0.25 109.862 174.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . 0.422 ' HB3' ' HB2' ' A' ' 71' ' ' TYR . 10.0 m-85 -59.82 -46.03 90.53 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.463 -0.79 . . . . 0.66 111.173 177.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 17.6 mt-30 -59.83 -38.61 82.54 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.464 -0.334 . . . . 1.96 111.083 -179.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -61.91 -35.58 78.8 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.554 -0.535 . . . . 1.69 109.554 178.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.459 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 69.6 mmtt -82.58 2.6 32.39 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.837 -0.619 . . . . 1.23 111.113 -179.314 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 106.51 -7.78 39.91 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 121.047 -0.597 . . . . 0.34 112.936 175.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . 0.422 ' HB2' ' HB3' ' A' ' 66' ' ' TYR . 70.5 m-85 -89.26 73.68 8.01 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.153 0.502 . . . . 0.8 109.805 -179.702 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 43.8 t -69.04 -29.02 41.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.779 -0.646 . . . . 1.13 111.204 -175.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 67.3 mt -91.38 22.68 3.78 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.026 0.441 . . . . 2.34 111.042 177.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -121.22 120.29 34.77 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.068 -0.515 . . . . 1.08 110.547 178.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 19.5 mmm180 -128.95 170.82 12.97 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.073 -0.512 . . . . 2.16 109.739 177.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -133.18 132.75 41.93 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 109.707 -0.479 . . . . 0.99 109.707 178.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 51.0 p90 -129.3 143.39 50.83 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.847 0.356 . . . . 0.43 110.171 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.423 HD13 ' HB3' ' A' ' 55' ' ' LEU . 6.6 tt -93.7 107.43 27.17 Favored Pre-proline 0 C--N 1.319 -0.732 0 N-CA-C 108.948 -0.76 . . . . 1.15 108.948 178.841 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo . . . . . 0 C--N 1.348 0.546 0 C-N-CA 123.534 2.823 . . . . 1.12 112.881 -175.766 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.838 0 N-CA-C 112.352 -0.299 . . . . 0.72 112.352 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 19.6 m -91.91 120.66 32.79 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 120.925 0.393 . . . . 1.12 110.627 179.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 31.0 m -108.53 132.52 56.19 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 N-CA-C 109.258 -0.645 . . . . 1.1 109.258 175.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . 0.485 ' HD3' ' OG ' ' A' ' 28' ' ' SER . 27.2 ttm180 -109.32 128.79 55.37 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 121.13 0.49 . . . . 3.51 110.9 -176.233 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 59.5 mt -113.45 135.06 54.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.399 -0.819 . . . . 0.99 109.696 178.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.526 ' HA ' ' O ' ' A' ' 28' ' ' SER . 45.8 mt-10 -94.91 122.46 37.56 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.227 0.537 . . . . 1.33 110.318 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 60.0 t -98.35 123.75 51.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 115.493 -0.776 . . . . 1.04 110.103 -178.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 47.6 tp -108.97 94.8 5.24 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 109.315 -0.624 . . . . 1.2 109.315 178.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -77.4 2.56 15.64 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.628 -0.715 . . . . 0.49 111.035 -174.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.782 0 CA-C-O 118.818 -0.99 . . . . 1.39 112.08 177.212 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 50.0 t . . . . . 0 N--CA 1.449 -0.494 0 N-CA-C 109.787 -0.449 . . . . 1.22 109.787 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.479 ' HA ' ' HA ' ' A' ' 49' ' ' GLU . 55.3 tp -65.66 115.76 6.17 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.021 0.439 . . . . 1.53 110.247 177.729 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.457 HG11 ' CE1' ' A' ' 25' ' ' PHE . 48.5 t -95.54 121.67 46.3 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 CA-C-N 115.842 -0.617 . . . . 1.03 110.353 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 80.2 mttt -107.35 -27.22 10.61 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.589 -0.732 . . . . 1.7 109.704 177.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.8 ptp180 -161.74 161.71 29.39 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.837 -0.619 . . . . 2.48 110.876 177.303 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.509 ' CE2' ' HG ' ' A' ' 42' ' ' LEU . 29.2 m-85 -110.72 137.04 48.9 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.715 -0.675 . . . . 0.35 109.799 176.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 19.2 tp60 -119.12 129.45 55.05 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.409 -0.589 . . . . 1.64 109.409 177.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.459 HD13 ' HB ' ' A' ' 90' ' ' ILE . 3.8 mm? -103.02 132.68 49.11 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.259 0.552 . . . . 1.03 110.113 -179.63 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 48.1 t -121.71 122.16 38.92 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.495 -0.775 . . . . 1.57 109.667 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 103.79 -16.11 51.53 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.625 -0.798 . . . . 0.27 112.331 179.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 20.7 p-10 -69.18 126.53 30.08 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.051 0.453 . . . . 0.58 110.367 179.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.566 ' NE ' ' HA ' ' A' ' 31' ' ' ARG . 1.9 mmp_? -125.97 -34.64 2.55 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.266 -0.425 . . . . 3.08 110.678 179.435 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.423 ' HG2' ' CZ ' ' A' ' 71' ' ' TYR . 57.5 tp60 -75.17 -38.29 60.94 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.258 -0.428 . . . . 2.59 110.598 -179.697 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -123.44 146.91 47.65 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.605 -0.517 . . . . 0.29 109.605 178.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -92.41 169.71 10.35 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.27 -0.423 . . . . 0.62 111.233 -176.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.526 ' O ' HD13 ' A' ' 39' ' ' LEU . 4.1 m-20 -56.07 -52.87 62.74 Favored 'General case' 0 CA--C 1.517 -0.323 0 O-C-N 123.258 0.349 . . . . 0.59 110.616 -177.579 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 61.9 ttp180 -52.79 -39.61 62.46 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.307 -0.406 . . . . 4.12 111.1 -177.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 15.4 tpt180 -63.75 -50.09 70.45 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.925 -0.58 . . . . 3.02 111.094 178.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.44 HD22 ' HG ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -73.56 -26.79 61.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.844 0.354 . . . . 1.03 111.261 -176.736 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.526 HD13 ' O ' ' A' ' 35' ' ' ASP . 2.3 mp -60.14 -32.93 71.48 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.154 -0.475 . . . . 2.38 111.781 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.54 -25.58 66.25 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.146 -0.479 . . . . 1.11 111.452 179.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.415 HD12 ' HA ' ' A' ' 38' ' ' LEU . 1.7 mt -70.12 -27.49 64.62 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.888 0.375 . . . . 0.99 110.431 176.826 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.509 ' HG ' ' CE2' ' A' ' 25' ' ' PHE . 0.4 OUTLIER -107.55 13.32 26.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.94 -0.573 . . . . 1.07 110.447 -177.184 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 6.5 p80 -51.92 -24.77 6.85 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.798 -0.637 . . . . 0.66 112.554 -173.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -101.02 3.38 41.43 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.369 0.507 . . . . 0.6 112.369 -172.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 86.9 mt -95.53 -54.87 0.22 Allowed Pre-proline 0 C--N 1.323 -0.556 0 N-CA-C 113.932 1.086 . . . . 1.53 113.932 -172.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.446 ' HB3' HG13 ' A' ' 22' ' ' VAL . 75.3 Cg_endo -73.41 161.38 42.69 Favored 'Trans proline' 0 C--N 1.351 0.697 0 C-N-CA 121.318 1.345 . . . . 0.33 112.678 -168.205 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 100.87 3.98 54.63 Favored Glycine 0 N--CA 1.449 -0.477 0 N-CA-C 110.594 -1.002 . . . . 0.31 110.594 -170.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -143.07 170.23 16.11 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.858 -0.671 . . . . 2.2 109.282 177.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.479 ' HA ' ' HA ' ' A' ' 21' ' ' LEU . 35.9 mt-10 -98.46 96.04 7.73 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.384 0.611 . . . . 1.12 109.679 178.235 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.407 ' HA ' ' OE1' ' A' ' 54' ' ' GLN . 2.7 mm? -83.72 140.77 31.91 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.068 -0.969 . . . . 1.08 109.604 -178.216 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -88.87 161.55 16.63 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.484 -0.561 . . . . 1.77 109.484 178.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -45.08 -43.4 9.52 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.462 0.912 . . . . 1.6 113.462 -172.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.648 ' HA ' ' NE2' ' A' ' 56' ' ' HIS . 50.0 m -58.61 -37.12 75.17 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.929 0.395 . . . . 1.26 110.971 179.562 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.407 ' OE1' ' HA ' ' A' ' 50' ' ' LEU . 99.5 mt-30 -72.2 -38.67 69.0 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.656 -0.702 . . . . 1.74 110.56 179.043 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.496 ' HB3' HD11 ' A' ' 78' ' ' LEU . 9.4 mp -58.87 -54.78 43.23 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 112.62 0.6 . . . . 1.81 112.62 179.206 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.648 ' NE2' ' HA ' ' A' ' 53' ' ' SER . 32.7 p80 -72.76 -23.48 60.83 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.014 -0.674 . . . . 3.73 111.294 -177.579 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.07 -32.94 73.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.288 0.565 . . . . 1.07 109.976 173.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.63 -37.79 88.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.392 -0.822 . . . . 1.03 110.638 175.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.07 -34.03 77.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.733 -0.667 . . . . 1.0 110.686 179.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.58 -35.0 78.12 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.929 -0.578 . . . . 1.08 111.013 178.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 88.6 mtt180 -59.06 -42.38 90.18 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.24 0.543 . . . . 0.42 109.976 177.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.488 HD11 HD21 ' A' ' 42' ' ' LEU . 80.9 mt -77.6 -37.39 24.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.398 -0.819 . . . . 1.1 110.3 -177.349 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.606 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -57.55 -46.48 91.99 Favored Glycine 0 N--CA 1.442 -0.909 0 CA-C-N 115.447 -0.797 . . . . 0.22 111.583 176.168 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -68.97 -33.51 73.8 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.61 0.243 . . . . 2.17 110.395 177.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.573 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 76.8 t80 -54.68 -49.38 70.79 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.016 -0.538 . . . . 0.25 110.508 177.577 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -62.12 -47.16 85.85 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.004 -0.544 . . . . 0.66 111.159 178.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . 0.606 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 14.3 mt-30 -57.48 -41.72 81.2 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.359 0.599 . . . . 1.96 110.45 179.49 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -58.37 -38.55 77.48 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.135 -0.939 . . . . 1.69 110.798 178.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.573 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 68.9 mmtt -82.33 2.88 30.1 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.937 -0.574 . . . . 1.23 111.058 -177.302 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.31 -14.6 30.57 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 121.017 -0.611 . . . . 0.34 112.683 176.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . 0.423 ' CZ ' ' HG2' ' A' ' 32' ' ' GLN . 60.7 m-85 -83.33 69.49 9.99 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.182 0.515 . . . . 0.8 110.239 -177.37 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 41.1 t -69.89 -23.95 26.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.776 -0.647 . . . . 1.13 110.841 -177.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 95.0 mt -83.04 -3.2 57.0 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 2.34 110.811 178.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -101.08 144.12 30.37 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.914 -0.585 . . . . 1.08 110.867 -178.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 20.7 tpt180 -154.33 137.33 15.49 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.015 -0.539 . . . . 2.16 110.033 178.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -102.41 135.49 43.94 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.271 -0.422 . . . . 0.99 110.141 177.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 48.7 p90 -135.6 151.06 49.9 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.722 -0.473 . . . . 0.43 109.722 179.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.496 HD11 ' HB3' ' A' ' 55' ' ' LEU . 6.7 tt -107.54 109.47 62.53 Favored Pre-proline 0 C--N 1.32 -0.704 0 N-CA-C 109.5 -0.556 . . . . 1.15 109.5 -179.487 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo . . . . . 0 N--CA 1.46 -0.469 0 C-N-CA 122.609 2.206 . . . . 1.12 112.06 179.84 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.816 0 N-CA-C 112.469 -0.252 . . . . 0.72 112.469 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 20.4 m -117.81 120.77 38.92 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 120.866 0.365 . . . . 1.12 110.802 -177.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 34.3 m -103.1 137.02 32.93 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 109.638 -0.504 . . . . 1.1 109.638 176.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 30.4 ttm180 -113.58 117.6 32.07 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.122 0.486 . . . . 3.51 110.778 -177.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.459 ' HB ' HD13 ' A' ' 27' ' ' LEU . 70.0 mt -103.83 129.73 55.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.465 -0.789 . . . . 0.99 109.605 177.609 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -94.7 123.61 38.24 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.147 0.499 . . . . 1.33 110.266 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 40.6 t -101.8 108.28 23.38 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 115.552 -0.749 . . . . 1.04 110.256 -178.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 62.0 tp -90.11 96.57 10.73 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.236 -0.653 . . . . 1.2 109.236 175.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.443 ' OE1' ' HB2' ' A' ' 31' ' ' ARG . 43.6 mt-10 -76.68 -31.13 57.06 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.016 0.436 . . . . 0.49 110.461 -177.219 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.869 0 CA-C-O 118.244 -1.309 . . . . 1.39 111.562 178.246 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 38.3 t . . . . . 0 N--CA 1.446 -0.644 0 N-CA-C 109.61 -0.515 . . . . 1.22 109.61 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.431 ' O ' ' HA2' ' A' ' 86' ' ' GLY . 42.8 tp -71.99 90.66 1.17 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.233 0.539 . . . . 1.53 110.194 176.417 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.493 HG12 ' CE1' ' A' ' 25' ' ' PHE . 56.7 t -72.85 129.33 35.99 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 CA-C-N 115.27 -0.877 . . . . 1.03 110.77 -177.314 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 54.5 mttp -112.48 -25.15 9.32 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.654 -0.703 . . . . 1.7 109.586 177.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 13.1 ptp180 -163.22 157.43 20.36 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.791 -0.64 . . . . 2.48 110.811 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.499 ' CE2' ' HG ' ' A' ' 42' ' ' LEU . 22.4 m-85 -111.27 149.03 31.63 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.664 -0.698 . . . . 0.35 109.915 177.561 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 59.6 tp60 -130.27 135.38 48.05 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 109.454 -0.573 . . . . 1.64 109.454 176.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -103.73 143.43 32.8 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.004 0.431 . . . . 1.03 110.058 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 28.5 t -128.83 133.88 48.14 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.95 -0.568 . . . . 1.57 109.996 -179.607 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 84.74 -3.77 86.17 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.714 -0.755 . . . . 0.27 112.575 178.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 20.6 p-10 -76.06 130.36 38.23 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.964 0.411 . . . . 0.58 110.954 179.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.465 ' NE ' ' HA ' ' A' ' 31' ' ' ARG . 4.7 tpm_? -137.15 -33.42 0.75 Allowed 'General case' 0 C--N 1.321 -0.63 0 CA-C-N 116.291 -0.413 . . . . 3.08 110.639 178.419 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -68.14 -36.8 80.27 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.207 -0.452 . . . . 2.59 110.396 177.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.438 ' CZ ' ' HG3' ' A' ' 69' ' ' LYS . 86.7 m-85 -129.48 137.41 50.82 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.084 -0.507 . . . . 0.29 109.993 176.371 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.597 ' OD1' ' HB3' ' A' ' 36' ' ' ARG . 4.1 p30 -74.61 164.26 26.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.122 -0.49 . . . . 0.62 110.839 -179.414 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.663 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 3.8 m-20 -50.46 -55.24 16.79 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 123.393 0.433 . . . . 0.59 110.804 -177.553 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.597 ' HB3' ' OD1' ' A' ' 34' ' ' ASP . 6.0 ttp180 -46.25 -48.17 17.95 Favored 'General case' 0 C--N 1.33 -0.278 0 O-C-N 123.814 0.696 . . . . 4.12 111.999 178.385 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -59.04 -35.46 73.35 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.964 -0.562 . . . . 3.02 110.96 -178.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.475 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -87.22 -26.23 23.62 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.21 -0.45 . . . . 1.03 111.085 -179.913 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.663 ' HG ' ' O ' ' A' ' 35' ' ' ASP . 92.9 mt -62.98 -34.39 77.41 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.763 0.316 . . . . 2.38 111.204 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.29 -23.46 65.71 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.027 -0.533 . . . . 1.11 111.305 178.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.475 HD12 ' HA ' ' A' ' 38' ' ' LEU . 5.2 mt -70.0 -26.98 64.33 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.864 0.364 . . . . 0.99 110.659 177.366 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.499 ' HG ' ' CE2' ' A' ' 25' ' ' PHE . 0.4 OUTLIER -109.08 12.9 24.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.237 -0.438 . . . . 1.07 110.39 -178.026 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -51.39 -26.55 8.04 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.768 0.655 . . . . 0.66 112.768 -174.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -104.84 11.82 33.3 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.137 0.421 . . . . 0.6 112.137 -173.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 81.5 mt -99.56 -54.54 0.17 Allowed Pre-proline 0 C--N 1.324 -0.501 0 N-CA-C 113.723 1.008 . . . . 1.53 113.723 -176.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.416 ' HB3' HG11 ' A' ' 22' ' ' VAL . 72.5 Cg_endo -73.37 165.75 31.71 Favored 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 121.324 1.349 . . . . 0.33 112.845 -168.441 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 97.74 -12.42 64.38 Favored Glycine 0 N--CA 1.446 -0.682 0 N-CA-C 110.371 -1.092 . . . . 0.31 110.371 -171.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 53.3 mt-30 -117.11 175.06 5.77 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.66 -0.77 . . . . 2.2 109.559 176.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -99.5 101.18 12.34 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 121.283 0.563 . . . . 1.12 109.816 174.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.51 131.97 35.28 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.189 -0.914 . . . . 1.08 110.097 -176.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.627 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 33.4 p30 -80.84 170.52 16.18 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 121.124 -0.23 . . . . 1.77 110.452 178.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.46 ' HA ' HD11 ' A' ' 55' ' ' LEU . 4.4 mm? -50.73 -43.38 58.06 Favored 'General case' 0 N--CA 1.465 0.298 0 O-C-N 123.141 0.275 . . . . 1.6 111.235 -177.535 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.475 ' HA ' ' NE2' ' A' ' 56' ' ' HIS . 14.9 m -54.39 -55.71 25.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.021 -0.536 . . . . 1.26 110.619 178.375 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -62.62 -34.24 76.64 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.831 -0.622 . . . . 1.74 111.223 -179.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.627 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 89.8 mt -59.65 -57.0 14.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 1.81 111.167 179.566 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.475 ' NE2' ' HA ' ' A' ' 53' ' ' SER . 34.5 p80 -74.0 -23.86 59.5 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.314 -0.554 . . . . 3.73 110.867 -178.407 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.1 -30.95 72.0 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.98 0.419 . . . . 1.07 110.491 174.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.61 -38.94 86.35 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.885 -0.598 . . . . 1.03 110.335 174.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.56 -32.93 74.03 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.622 -0.717 . . . . 1.0 110.841 179.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.91 -32.16 73.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.965 -0.562 . . . . 1.08 110.897 178.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 74.8 mtt180 -62.68 -39.51 94.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.915 -0.584 . . . . 0.42 110.175 176.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.49 HD11 HD21 ' A' ' 42' ' ' LEU . 68.7 mt -79.8 -37.29 18.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.453 -0.794 . . . . 1.1 110.99 -175.338 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.568 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -59.66 -47.88 88.75 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.615 -0.803 . . . . 0.22 111.556 177.39 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.419 ' O ' ' HG3' ' A' ' 68' ' ' GLU . 28.5 t70 -68.86 -31.62 70.69 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.731 0.301 . . . . 2.17 110.57 178.556 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.445 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 90.7 t80 -57.54 -51.37 69.75 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.092 -0.504 . . . . 0.25 110.267 176.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . 0.408 ' HB3' ' HB2' ' A' ' 71' ' ' TYR . 4.3 m-85 -57.65 -42.54 83.65 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.537 -0.756 . . . . 0.66 110.749 177.162 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . 0.568 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 91.0 mt-30 -62.07 -35.32 78.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 1.96 111.347 -178.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.419 ' HG3' ' O ' ' A' ' 64' ' ' ASP . 43.6 mt-10 -71.19 -23.31 62.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.873 0.368 . . . . 1.69 110.837 179.309 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.445 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 74.5 mmtt -91.41 1.88 56.8 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.061 -0.518 . . . . 1.23 110.676 -179.583 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.25 -14.17 28.26 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.734 -0.745 . . . . 0.34 112.86 176.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . 0.408 ' HB2' ' HB3' ' A' ' 66' ' ' TYR . 55.0 m-85 -87.06 67.66 9.8 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.243 0.544 . . . . 0.8 109.852 -178.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 22.0 t -68.93 -23.43 27.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.735 -0.666 . . . . 1.13 110.889 -175.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 97.8 mt -86.09 -8.54 57.82 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.04 -0.527 . . . . 2.34 111.111 179.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -82.98 140.45 32.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.17 -0.468 . . . . 1.08 110.574 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 5.0 tpp180 -144.54 131.71 20.59 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.166 -0.47 . . . . 2.16 109.884 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -102.51 136.28 42.62 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.97 -0.381 . . . . 0.99 109.97 177.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 52.8 p90 -137.75 151.54 48.27 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.869 -0.419 . . . . 0.43 109.869 179.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.405 ' HA ' ' HD2' ' A' ' 79' ' ' PRO . 7.1 tt -105.89 113.04 64.2 Favored Pre-proline 0 C--N 1.32 -0.681 0 N-CA-C 109.908 -0.404 . . . . 1.15 109.908 -178.509 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . 0.461 ' HD2' ' O ' ' A' ' 89' ' ' ARG . 35.3 Cg_endo . . . . . 0 C--O 1.234 0.317 0 C-N-CA 122.748 2.299 . . . . 1.12 111.459 176.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . 0.431 ' HA2' ' O ' ' A' ' 21' ' ' LEU . . . . . . . . 0 N--CA 1.444 -0.831 0 N-CA-C 111.572 -0.611 . . . . 0.72 111.572 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 24.3 m -96.33 120.87 37.42 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-O 120.84 0.352 . . . . 1.12 110.676 177.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 35.0 m -111.4 134.94 52.16 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 N-CA-C 109.201 -0.666 . . . . 1.1 109.201 175.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . 0.461 ' O ' ' HD2' ' A' ' 79' ' ' PRO . 15.6 ttp180 -113.11 131.0 56.0 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 120.177 -0.609 . . . . 3.51 110.666 -177.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 72.4 mt -112.63 131.05 65.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 115.354 -0.839 . . . . 0.99 109.696 179.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -94.07 126.33 39.23 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.43 0.633 . . . . 1.33 109.986 179.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 66.0 t -100.76 101.45 12.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 CA-C-N 115.161 -0.927 . . . . 1.04 110.562 -176.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 63.1 tp -83.93 92.39 7.8 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.898 -0.779 . . . . 1.2 108.898 175.019 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 57.8 mt-10 -69.47 -17.33 63.61 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.217 -0.447 . . . . 0.49 111.017 -175.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.787 -1.007 . . . . 1.39 112.643 174.656 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 23.8 t . . . . . 0 N--CA 1.451 -0.393 0 N-CA-C 110.24 -0.281 . . . . 1.22 110.24 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 56.8 tp -71.44 106.07 3.8 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.385 0.612 . . . . 1.53 109.609 174.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.453 HG12 ' CE1' ' A' ' 25' ' ' PHE . 56.4 t -91.64 118.72 37.62 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 CA-C-N 115.435 -0.802 . . . . 1.03 109.973 179.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -98.08 -26.03 14.74 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 109.111 -0.7 . . . . 1.7 109.111 174.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 13.9 ptp180 -162.75 162.87 26.92 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.369 -0.832 . . . . 2.48 110.712 -178.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.466 ' CE2' ' HG ' ' A' ' 42' ' ' LEU . 29.6 m-85 -111.12 154.87 23.68 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.694 -0.685 . . . . 0.35 109.967 177.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.478 ' O ' ' HA ' ' A' ' 89' ' ' ARG . 8.1 tp-100 -137.3 140.1 41.33 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 109.065 -0.717 . . . . 1.64 109.065 177.497 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.458 HD12 HD13 ' A' ' 62' ' ' ILE . 3.8 mm? -108.36 152.16 25.02 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 120.935 0.397 . . . . 1.03 110.403 -179.215 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 23.1 t -132.9 125.83 30.77 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.127 -0.488 . . . . 1.57 110.254 177.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 90.86 -2.09 79.2 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.8 -0.714 . . . . 0.27 113.009 175.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 14.7 p-10 -74.04 123.05 23.64 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.183 0.516 . . . . 0.58 111.072 179.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 29.8 mmm180 -121.43 -33.57 3.62 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.828 -0.624 . . . . 3.08 110.514 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -70.92 -42.25 70.13 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.007 -0.542 . . . . 2.59 110.551 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 86.2 m-85 -128.68 137.08 51.43 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.033 -0.53 . . . . 0.29 109.749 179.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.64 ' OD2' ' HB3' ' A' ' 36' ' ' ARG . 4.6 p-10 -79.72 167.5 20.56 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.234 -0.439 . . . . 0.62 111.028 -177.636 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.469 ' O ' HD12 ' A' ' 39' ' ' LEU . 2.8 m-20 -54.22 -52.8 60.15 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 123.084 0.24 . . . . 0.59 110.959 -176.836 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.64 ' HB3' ' OD2' ' A' ' 34' ' ' ASP . 8.7 ttp180 -45.25 -45.51 11.95 Favored 'General case' 0 C--N 1.327 -0.394 0 O-C-N 123.763 0.664 . . . . 4.12 111.536 177.403 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 22.0 tpt85 -65.21 -42.88 93.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.803 -0.635 . . . . 3.02 111.476 -178.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.506 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -79.91 -24.9 40.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.723 0.297 . . . . 1.03 111.377 -177.545 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.469 HD12 ' O ' ' A' ' 35' ' ' ASP . 2.2 mp -62.15 -36.37 81.6 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.339 -0.392 . . . . 2.38 111.328 178.506 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.59 -26.26 66.83 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.062 -0.517 . . . . 1.11 111.051 178.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.506 ' HB2' ' O ' ' A' ' 38' ' ' LEU . 5.9 mt -64.88 -30.51 71.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.008 0.432 . . . . 0.99 110.98 176.165 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.494 HD21 HD12 ' A' ' 62' ' ' ILE . 0.4 OUTLIER -105.36 12.86 31.16 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.139 -0.482 . . . . 1.07 110.271 -177.713 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 7.1 p80 -47.3 -29.83 2.73 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.5 0.926 . . . . 0.66 113.5 -173.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -104.2 11.25 35.22 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.246 0.461 . . . . 0.6 112.246 -174.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 80.0 mt -97.08 -53.03 0.21 Allowed Pre-proline 0 C--N 1.323 -0.573 0 N-CA-C 113.591 0.96 . . . . 1.53 113.591 -176.353 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.415 ' HB3' HG11 ' A' ' 22' ' ' VAL . 77.6 Cg_endo -75.9 175.59 11.12 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 121.428 1.418 . . . . 0.33 113.023 -168.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 89.18 -6.78 83.26 Favored Glycine 0 N--CA 1.445 -0.712 0 N-CA-C 110.629 -0.989 . . . . 0.31 110.629 -172.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -124.75 175.48 7.21 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.979 -0.611 . . . . 2.2 109.72 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -100.59 96.36 7.31 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.402 0.62 . . . . 1.12 109.83 176.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.439 HD23 ' CG2' ' A' ' 22' ' ' VAL . 2.7 mm? -84.42 134.55 34.46 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.016 -0.993 . . . . 1.08 110.231 -174.5 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.577 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 8.5 p30 -85.03 171.37 12.13 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.727 -0.472 . . . . 1.77 109.727 177.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.456 ' HA ' HD11 ' A' ' 55' ' ' LEU . 4.0 mm? -48.8 -45.17 39.87 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.512 0.56 . . . . 1.6 112.512 -175.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.557 ' HA ' ' NE2' ' A' ' 56' ' ' HIS . 69.1 m -57.46 -46.0 84.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.622 0.249 . . . . 1.26 110.929 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.407 ' NE2' HD13 ' A' ' 50' ' ' LEU . 55.2 mt-30 -66.42 -32.64 74.14 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.982 0.42 . . . . 1.74 110.522 179.546 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.577 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 79.7 mt -62.67 -55.58 25.57 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.766 -0.652 . . . . 1.81 111.279 -178.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.557 ' NE2' ' HA ' ' A' ' 53' ' ' SER . 34.0 p80 -74.76 -23.42 58.53 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.324 -0.55 . . . . 3.73 111.184 -178.094 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.14 -31.97 70.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.184 0.516 . . . . 1.07 110.192 173.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.33 -45.57 92.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.624 -0.716 . . . . 1.03 110.477 175.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.48 -34.99 78.98 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.662 -0.699 . . . . 1.0 110.82 179.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.3 -42.51 99.42 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.872 -0.604 . . . . 1.08 110.93 178.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 77.2 mtt180 -54.19 -40.9 67.98 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 121.183 0.516 . . . . 0.42 110.642 177.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.494 HD12 HD21 ' A' ' 42' ' ' LEU . 67.4 mt -78.45 -37.5 21.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.53 -0.759 . . . . 1.1 110.579 -176.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.461 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -60.32 -42.11 98.68 Favored Glycine 0 N--CA 1.442 -0.913 0 CA-C-N 115.651 -0.704 . . . . 0.22 111.89 177.818 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -75.98 -26.48 56.82 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.54 0.209 . . . . 2.17 110.551 177.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -59.97 -50.33 74.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.936 0.398 . . . . 0.25 110.277 178.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . 0.418 ' HB3' ' HB2' ' A' ' 71' ' ' TYR . 10.3 m-85 -58.58 -44.97 89.98 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.729 -0.669 . . . . 0.66 110.453 176.193 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . 0.461 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 79.7 mt-30 -59.97 -38.06 81.44 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.966 -0.561 . . . . 1.96 111.218 -179.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -69.42 -26.59 64.69 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.152 -0.477 . . . . 1.69 110.632 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -88.97 4.78 46.98 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.004 -0.544 . . . . 1.23 110.932 178.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 106.32 -14.96 43.22 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.819 -0.705 . . . . 0.34 112.881 176.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . 0.418 ' HB2' ' HB3' ' A' ' 66' ' ' TYR . 80.5 m-85 -82.3 71.56 9.36 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.191 0.52 . . . . 0.8 110.186 -178.448 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 40.5 t -67.77 -28.69 42.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.629 -0.714 . . . . 1.13 110.992 -176.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 43.4 tp -78.84 -8.93 59.26 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.038 -0.528 . . . . 2.34 110.908 -179.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -93.15 141.07 28.82 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.076 0.465 . . . . 1.08 111.241 -177.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 30.3 tpt180 -151.28 131.5 13.6 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.959 -0.564 . . . . 2.16 109.603 177.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.22 138.16 35.9 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.378 -0.374 . . . . 0.99 110.203 178.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 49.0 p90 -135.78 142.59 44.95 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.415 -0.357 . . . . 0.43 110.053 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.8 tt -95.79 115.42 65.51 Favored Pre-proline 0 C--N 1.318 -0.784 0 N-CA-C 109.211 -0.663 . . . . 1.15 109.211 179.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . 0.403 ' HD2' ' O ' ' A' ' 89' ' ' ARG . 55.7 Cg_endo . . . . . 0 N--CA 1.462 -0.374 0 C-N-CA 122.39 2.06 . . . . 1.12 111.796 178.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.688 0 N-CA-C 112.077 -0.409 . . . . 0.72 112.077 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 25.8 m -127.04 121.67 32.23 Favored 'General case' 0 C--N 1.322 -0.595 0 O-C-N 122.692 -0.299 . . . . 1.12 110.717 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 31.7 m -102.84 131.66 50.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 N-CA-C 109.716 -0.476 . . . . 1.1 109.716 175.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . 0.478 ' HA ' ' O ' ' A' ' 26' ' ' GLN . 51.8 ttt180 -110.52 130.87 55.46 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.268 0.556 . . . . 3.51 110.901 -177.316 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.4 ' HB ' HD13 ' A' ' 27' ' ' LEU . 67.2 mt -110.86 134.34 53.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.046 -0.979 . . . . 0.99 109.868 -179.249 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -94.14 123.75 37.72 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.342 0.591 . . . . 1.33 110.13 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 57.9 t -98.63 110.6 26.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 115.367 -0.833 . . . . 1.04 110.501 -176.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 56.2 tp -94.35 95.13 8.69 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.356 -0.609 . . . . 1.2 109.356 176.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 55.7 mt-10 -78.56 -9.9 59.52 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.895 -0.593 . . . . 0.49 110.816 -176.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.934 -0.926 . . . . 1.39 111.723 178.189 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 60.3 t . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.768 0.318 . . . . 1.22 110.555 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.435 ' HA ' ' HA ' ' A' ' 49' ' ' GLU . 51.8 tp -69.46 101.37 1.56 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.047 0.451 . . . . 1.53 110.478 177.427 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.419 HG11 ' HB3' ' A' ' 46' ' ' PRO . 60.8 t -80.68 126.54 39.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.704 -0.68 . . . . 1.03 110.172 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -108.52 -35.49 6.46 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.98 -0.555 . . . . 1.7 110.289 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 12.6 ptp180 -155.11 160.96 41.36 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.231 -0.44 . . . . 2.48 111.016 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.546 ' CE2' ' HG ' ' A' ' 42' ' ' LEU . 40.7 m-85 -114.78 141.02 48.42 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.735 -0.666 . . . . 0.35 110.228 178.569 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 29.9 tp60 -129.08 127.56 41.76 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.355 -0.609 . . . . 1.64 109.355 179.215 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.418 HD13 ' HB ' ' A' ' 90' ' ' ILE . 3.5 mm? -101.93 136.53 41.61 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.113 0.483 . . . . 1.03 109.8 -178.578 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.479 ' O ' ' HA ' ' A' ' 91' ' ' GLU . 74.1 m -132.16 131.25 42.07 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.757 -0.656 . . . . 1.57 110.414 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 99.18 -11.71 61.96 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.764 -0.732 . . . . 0.27 111.803 -177.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 17.3 p-10 -77.88 131.97 37.75 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.975 0.417 . . . . 0.58 110.58 179.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 28.5 mmm180 -126.23 -38.37 2.15 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.133 -0.485 . . . . 3.08 110.252 179.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 49.3 tp60 -68.5 -44.61 74.32 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.046 -0.524 . . . . 2.59 110.67 -177.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.436 ' HD2' ' CZ ' ' A' ' 66' ' ' TYR . 83.1 m-85 -122.98 136.19 54.76 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.016 -0.538 . . . . 0.29 109.69 179.583 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -82.48 175.72 9.98 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.027 -0.533 . . . . 0.62 111.046 -175.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.428 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 72.5 m-20 -54.73 -48.8 72.08 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 116.222 -0.444 . . . . 0.59 111.296 -177.489 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -62.34 -25.69 68.03 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.193 -0.458 . . . . 4.12 111.319 -174.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.2 tpt180 -79.89 -36.35 36.65 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.874 -0.603 . . . . 3.02 110.718 179.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -87.45 -34.35 18.74 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.053 0.39 . . . . 1.03 112.053 -176.456 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 35' ' ' ASP . 4.1 pp -67.0 -18.15 65.25 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 120.917 -0.313 . . . . 2.38 110.896 -179.065 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.49 -23.44 66.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.061 0.458 . . . . 1.11 110.37 176.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.492 HD11 ' HA ' ' A' ' 62' ' ' ILE . 2.4 mt -70.46 -23.09 62.64 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.871 -0.604 . . . . 0.99 110.45 175.636 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.546 ' HG ' ' CE2' ' A' ' 25' ' ' PHE . 0.7 OUTLIER -110.21 13.79 22.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.859 -0.61 . . . . 1.07 110.116 -179.444 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.9 p80 -56.19 -25.34 46.53 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.451 0.537 . . . . 0.66 112.451 -172.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -103.57 9.57 37.4 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.659 0.266 . . . . 0.6 111.152 -176.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 10.5 tp -97.52 -55.75 0.19 Allowed Pre-proline 0 C--N 1.32 -0.689 0 N-CA-C 113.792 1.034 . . . . 1.53 113.792 -169.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.419 ' HB3' HG11 ' A' ' 22' ' ' VAL . 82.7 Cg_endo -76.03 172.83 15.54 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 121.567 1.512 . . . . 0.33 112.825 -170.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.26 -0.67 64.01 Favored Glycine 0 N--CA 1.445 -0.728 0 N-CA-C 110.435 -1.066 . . . . 0.31 110.435 -172.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -131.33 174.62 9.88 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.954 -0.623 . . . . 2.2 109.621 178.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.435 ' HA ' ' HA ' ' A' ' 21' ' ' LEU . 37.4 mt-10 -95.58 95.56 8.46 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.385 0.612 . . . . 1.12 110.178 175.572 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -85.39 136.12 33.59 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.256 -0.884 . . . . 1.08 109.408 178.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.8 t-20 -80.39 156.47 26.67 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.452 -0.573 . . . . 1.77 109.452 178.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -49.76 -43.1 47.89 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 117.945 0.338 . . . . 1.6 111.738 -175.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 11.2 m -52.25 -45.03 65.21 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.092 0.472 . . . . 1.26 110.659 175.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -68.3 -39.2 82.11 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.629 -0.714 . . . . 1.74 111.152 179.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.495 ' HB3' HD13 ' A' ' 78' ' ' LEU . 10.9 mp -56.85 -46.99 81.4 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 120.719 0.295 . . . . 1.81 111.265 173.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 80.8 m-70 -65.95 -34.82 79.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.883 0.373 . . . . 3.73 110.451 178.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.7 -27.84 67.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.178 -0.464 . . . . 1.07 110.962 178.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.0 -38.49 91.28 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.193 0.521 . . . . 1.03 110.233 175.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.18 -30.85 71.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.596 -0.729 . . . . 1.0 110.546 177.427 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -66.16 -36.72 83.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.965 -0.562 . . . . 1.08 110.895 179.056 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 80.7 mtt180 -55.35 -42.06 73.36 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.299 0.571 . . . . 0.42 110.001 175.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.492 ' HA ' HD11 ' A' ' 41' ' ' LEU . 66.0 mt -77.91 -35.17 20.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.111 -0.949 . . . . 1.1 111.151 -175.626 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.616 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -58.89 -49.59 76.49 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.376 -0.916 . . . . 0.22 111.624 176.471 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -66.45 -28.32 68.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.541 0.21 . . . . 2.17 110.957 178.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.535 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 87.7 t80 -58.99 -50.38 74.29 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.019 0.437 . . . . 0.25 110.183 177.022 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . 0.436 ' CZ ' ' HD2' ' A' ' 33' ' ' PHE . 8.6 m-85 -61.66 -44.46 96.93 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.651 -0.704 . . . . 0.66 110.964 177.658 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . 0.616 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 42.0 mt-30 -61.16 -35.49 77.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.11 -0.496 . . . . 1.96 111.033 -178.621 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -64.49 -35.66 81.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.219 0.533 . . . . 1.69 110.589 176.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.535 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 69.6 mmtt -79.16 -4.12 48.91 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.982 -0.554 . . . . 1.23 110.829 -177.284 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.67 -6.99 27.94 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.953 -0.642 . . . . 0.34 112.302 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 -92.37 65.78 4.59 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.324 -0.621 . . . . 0.8 109.324 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 43.8 t -66.0 -28.1 42.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.699 -0.682 . . . . 1.13 110.836 -175.52 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 55.6 tp -73.66 -25.32 60.21 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.832 -0.622 . . . . 2.34 110.349 178.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -79.68 131.64 36.01 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.824 -0.626 . . . . 1.08 111.438 -175.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 20.5 mmm180 -140.37 155.13 46.88 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.645 -0.707 . . . . 2.16 109.918 176.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -113.51 135.05 54.32 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.954 -0.566 . . . . 0.99 109.754 178.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 47.4 p90 -130.33 149.71 51.89 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.511 -0.551 . . . . 0.43 109.511 179.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.495 HD13 ' HB3' ' A' ' 55' ' ' LEU . 7.5 tt -106.24 108.43 61.73 Favored Pre-proline 0 C--N 1.316 -0.88 0 N-CA-C 110.018 -0.364 . . . . 1.15 110.018 -178.008 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo . . . . . 0 C--O 1.233 0.271 0 C-N-CA 122.891 2.394 . . . . 1.12 112.163 176.903 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.832 0 N-CA-C 111.436 -0.666 . . . . 0.72 111.436 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 25.0 m -102.31 122.29 43.96 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 120.814 0.34 . . . . 1.12 110.211 178.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 33.2 m -108.21 128.07 63.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 109.918 -0.401 . . . . 1.1 109.918 176.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 14.3 ttt180 -103.94 114.29 28.44 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 120.494 -0.482 . . . . 3.51 110.43 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.418 ' HB ' HD13 ' A' ' 27' ' ' LEU . 49.1 mt -103.56 131.43 52.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 115.888 -0.596 . . . . 0.99 109.772 178.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.479 ' HA ' ' O ' ' A' ' 28' ' ' SER . 38.6 mt-10 -96.75 125.95 41.57 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.36 0.6 . . . . 1.33 110.591 -179.028 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 57.8 t -98.76 111.43 28.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.435 -0.802 . . . . 1.04 110.215 -178.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 30.9 tp -94.63 89.02 5.61 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.076 -0.713 . . . . 1.2 109.076 178.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 57.6 mt-10 -67.22 -15.67 63.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.508 -0.769 . . . . 0.49 111.725 -174.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.964 0 CA-C-O 118.929 -0.928 . . . . 1.39 111.764 178.904 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 21.8 t . . . . . 0 N--CA 1.447 -0.584 0 N-CA-C 109.846 -0.428 . . . . 1.22 109.846 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -71.72 126.76 30.55 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.028 -0.73 . . . . 1.53 109.028 175.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.489 HG13 ' CE1' ' A' ' 25' ' ' PHE . 63.9 t -108.36 116.89 52.69 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 CA-C-N 115.909 -0.587 . . . . 1.03 110.498 -176.138 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -97.85 -26.17 14.78 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.335 -0.848 . . . . 1.7 109.382 178.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 4.3 ptp180 -168.05 161.9 12.89 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.839 -0.619 . . . . 2.48 110.685 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.565 ' CE2' ' HG ' ' A' ' 42' ' ' LEU . 26.7 m-85 -110.91 137.14 48.92 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.696 -0.684 . . . . 0.35 109.731 178.033 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 7.2 tp-100 -114.72 129.18 56.65 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 109.544 -0.539 . . . . 1.64 109.544 177.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -103.7 127.29 51.18 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.007 0.432 . . . . 1.03 110.098 -178.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.0 t -115.08 119.47 36.56 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.938 -0.574 . . . . 1.57 110.164 -178.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 99.27 0.63 56.97 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.756 -0.735 . . . . 0.27 112.758 178.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 20.0 p-10 -81.23 124.29 29.17 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.361 0.6 . . . . 0.58 111.259 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 31' ' ' ARG . 15.3 mmm180 -128.22 -34.03 2.12 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.782 -0.645 . . . . 3.08 110.575 177.782 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -69.35 -32.68 71.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.108 -0.497 . . . . 2.59 110.543 179.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 -136.94 141.68 42.66 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.406 -0.59 . . . . 0.29 109.406 175.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -81.06 169.7 17.13 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.433 -0.349 . . . . 0.62 110.721 -178.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.508 ' O ' HD11 ' A' ' 39' ' ' LEU . 1.0 OUTLIER -55.4 -54.99 36.79 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-N 116.455 -0.339 . . . . 0.59 111.344 -176.048 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 62.8 ttt180 -58.69 -32.79 69.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.764 0.316 . . . . 4.12 110.853 -175.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 20.2 tpt180 -64.59 -42.94 95.26 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.212 -0.449 . . . . 3.02 110.575 176.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.449 ' HA ' HD11 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -78.79 -26.14 44.36 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.91 0.386 . . . . 1.03 110.916 179.651 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.508 HD11 ' O ' ' A' ' 35' ' ' ASP . 1.4 mp -60.3 -31.47 70.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.145 -0.48 . . . . 2.38 111.116 177.668 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.73 -24.06 65.41 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.903 -0.59 . . . . 1.11 111.403 176.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.471 HD13 ' HA ' ' A' ' 62' ' ' ILE . 3.8 mt -74.69 -24.49 58.78 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.123 0.487 . . . . 0.99 110.513 176.366 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.565 ' HG ' ' CE2' ' A' ' 25' ' ' PHE . 0.4 OUTLIER -107.67 14.27 25.79 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.989 -0.551 . . . . 1.07 110.12 -179.041 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 8.1 p80 -53.9 -19.94 5.29 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 113.161 0.8 . . . . 0.66 113.161 -171.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -110.65 11.0 22.85 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.082 0.401 . . . . 0.6 112.082 -175.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 84.8 mt -100.31 -54.72 0.16 Allowed Pre-proline 0 CA--C 1.539 0.519 0 N-CA-C 113.823 1.046 . . . . 1.53 113.823 -174.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.419 ' HB3' HG12 ' A' ' 22' ' ' VAL . 41.3 Cg_endo -69.92 165.82 29.88 Favored 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 121.345 1.363 . . . . 0.33 112.788 -170.384 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.26 -24.26 29.75 Favored Glycine 0 N--CA 1.447 -0.567 0 N-CA-C 110.711 -0.955 . . . . 0.31 110.711 -171.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -109.08 169.79 8.46 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.284 -0.458 . . . . 2.2 110.165 175.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -97.93 110.74 23.25 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.705 -0.68 . . . . 1.12 109.894 177.189 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -96.85 140.74 30.96 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.293 -0.867 . . . . 1.08 110.402 -174.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.658 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 36.1 p30 -85.44 171.34 11.88 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.938 -0.394 . . . . 1.77 109.938 177.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.427 ' HA ' HD12 ' A' ' 55' ' ' LEU . 3.8 mm? -50.69 -45.01 58.08 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.515 0.197 . . . . 1.6 111.521 -178.506 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.45 ' HA ' ' NE2' ' A' ' 56' ' ' HIS . 22.5 m -55.42 -51.1 67.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.327 -0.397 . . . . 1.26 111.069 179.3 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -67.28 -30.83 70.8 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.111 -0.495 . . . . 1.74 111.185 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.658 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 84.3 mt -60.78 -55.03 38.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.404 -0.362 . . . . 1.81 111.027 178.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.45 ' NE2' ' HA ' ' A' ' 53' ' ' SER . 34.8 p80 -75.88 -22.91 55.66 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.493 -0.483 . . . . 3.73 111.183 -178.125 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.32 -33.31 72.21 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.132 0.492 . . . . 1.07 110.403 174.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.86 -39.7 90.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.676 -0.693 . . . . 1.03 110.662 176.345 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.48 -34.99 78.3 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.802 -0.635 . . . . 1.0 110.729 179.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.06 -39.19 94.0 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.873 -0.603 . . . . 1.08 110.962 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 80.6 mtt180 -55.45 -42.59 74.46 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.266 0.555 . . . . 0.42 110.334 176.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ILE . . . . . 0.504 HD12 HD22 ' A' ' 42' ' ' LEU . 72.6 mt -78.34 -37.52 21.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.533 -0.758 . . . . 1.1 110.699 -176.238 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.654 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -59.1 -45.36 95.41 Favored Glycine 0 N--CA 1.442 -0.929 0 C-N-CA 120.67 -0.776 . . . . 0.22 111.645 176.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -68.25 -33.41 74.34 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.818 0.342 . . . . 2.17 110.52 178.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.438 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 90.4 t80 -57.27 -51.32 69.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.889 -0.596 . . . . 0.25 110.628 178.231 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -59.61 -41.42 90.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.97 -0.559 . . . . 0.66 111.157 178.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . 0.654 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 21.2 mt-30 -58.73 -44.8 90.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.034 -0.53 . . . . 1.96 111.087 -178.146 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -70.44 -17.27 62.99 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.84 0.352 . . . . 1.69 111.339 -179.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.438 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 75.5 mmtt -91.2 4.89 51.1 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.802 0.334 . . . . 1.23 110.642 179.704 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 102.61 -11.54 56.47 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.769 -0.729 . . . . 0.34 112.489 176.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -89.72 74.24 7.53 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.426 0.631 . . . . 0.8 109.387 -179.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 28.7 t -74.34 -25.77 19.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.434 -0.803 . . . . 1.13 111.091 -174.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 60.8 tp -78.19 -16.77 57.56 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.134 0.492 . . . . 2.34 110.029 176.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.503 ' HA ' ' O ' ' A' ' 93' ' ' LEU . . . -82.7 137.3 34.48 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.957 -0.565 . . . . 1.08 111.504 -178.286 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 21.5 tpt180 -152.12 132.6 13.81 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.7 -0.682 . . . . 2.16 109.602 176.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -95.81 135.13 37.94 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 110.288 -0.264 . . . . 0.99 110.288 178.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 51.0 p90 -135.36 149.39 49.68 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.86 0.362 . . . . 0.43 110.27 179.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.5 tt -104.21 118.4 56.99 Favored Pre-proline 0 C--N 1.318 -0.791 0 N-CA-C 108.997 -0.742 . . . . 1.15 108.997 178.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo . . . . . 0 C--O 1.234 0.292 0 C-N-CA 122.654 2.236 . . . . 1.12 112.095 179.087 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.703 0 N-CA-C 111.599 -0.6 . . . . 0.72 111.599 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 87.0 m -128.86 119.76 25.03 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.904 0.383 . . . . 1.12 110.397 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 32.6 m -95.91 132.97 38.74 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 N-CA-C 109.676 -0.49 . . . . 1.1 109.676 178.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 34.4 ttp180 -111.34 117.32 32.8 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.287 0.565 . . . . 3.51 110.707 -177.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 71.9 mt -100.98 131.47 48.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 115.223 -0.899 . . . . 0.99 109.669 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -94.21 117.95 30.86 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.371 0.605 . . . . 1.33 110.068 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 55.4 t -92.85 109.57 21.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 115.426 -0.806 . . . . 1.04 110.263 -177.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.503 ' O ' ' HA ' ' A' ' 74' ' ' ALA . 57.5 tp -89.9 90.72 8.3 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.47 -0.567 . . . . 1.2 109.47 176.589 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -77.79 -12.32 59.96 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.203 0.525 . . . . 0.49 110.465 -178.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.232 0 CA-C-O 118.279 -1.289 . . . . 1.39 111.22 178.277 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.1 ttt . . . . . 0 N--CA 1.478 0.943 0 N-CA-C 109.669 -0.493 . . . . 15.98 109.669 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -60.53 112.98 2.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.091 -0.504 . . . . 13.23 111.604 -176.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 53.6 m80 -120.23 -81.9 0.64 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.763 -0.653 . . . . 13.93 109.765 175.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 37.7 p-80 -84.02 127.81 34.13 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.225 -0.443 . . . . 11.29 109.841 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . 0.487 ' HB2' ' OE2' ' A' ' 49' ' ' GLU . 77.1 m80 -90.23 -44.36 9.79 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.655 -0.498 . . . . 9.64 109.655 178.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 40.3 t-80 48.48 61.75 2.89 Favored 'General case' 0 N--CA 1.468 0.429 0 O-C-N 123.786 0.679 . . . . 10.58 112.215 169.275 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 30.8 m170 -122.47 -3.11 8.88 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.271 0.558 . . . . 8.21 109.813 174.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 54.1 t-80 -178.73 -39.5 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.735 -1.121 . . . . 7.27 108.181 177.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.411 HG21 ' HA ' ' A' ' 48' ' ' GLN . 15.6 m -129.27 168.08 23.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 114.527 -1.215 . . . . 2.46 109.266 174.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -163.59 -169.71 2.01 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 110.466 -0.198 . . . . 4.2 110.466 178.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.441 ' HA ' HG22 ' A' ' 19' ' ' THR . 3.9 p-10 -59.92 133.26 55.93 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.443 0.64 . . . . 4.33 112.325 -174.219 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -133.93 165.31 25.3 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.308 -0.86 . . . . 4.37 109.54 -178.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 22.9 t70 68.62 -75.94 0.06 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.336 0.654 . . . . 5.36 110.343 -175.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -107.58 93.87 4.78 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.565 -0.902 . . . . 3.85 108.565 174.169 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 63.9 mtt -78.27 143.18 37.27 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.702 -0.681 . . . . 4.76 110.596 -177.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 82.23 12.82 80.16 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.97 -0.633 . . . . 3.71 112.279 -177.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -118.26 -173.05 15.87 Favored Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 120.819 -0.705 . . . . 2.09 111.836 178.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_exo -71.87 131.74 18.83 Favored 'Trans proline' 0 N--CA 1.459 -0.517 0 C-N-CA 122.515 2.143 . . . . 1.35 111.372 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.441 HG22 ' HA ' ' A' ' 11' ' ' ASP . 17.3 p -135.59 154.18 51.43 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.223 -0.444 . . . . 1.2 110.902 -179.461 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 39.2 t -123.51 123.68 67.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-N 116.04 -0.527 . . . . 1.22 110.021 178.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.408 ' O ' ' HA2' ' A' ' 86' ' ' GLY . 35.9 tp -71.32 102.27 2.56 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.138 -0.689 . . . . 1.53 109.138 174.114 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.458 HG12 ' CE1' ' A' ' 25' ' ' PHE . 75.7 t -76.15 115.54 17.87 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 CA-C-N 115.585 -0.734 . . . . 1.03 110.727 -176.707 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -98.88 -32.6 11.25 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.905 -0.589 . . . . 1.7 109.848 176.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 7.1 ptm180 -158.68 163.09 37.18 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.083 -0.508 . . . . 2.48 110.963 178.426 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.566 ' CE2' ' HG ' ' A' ' 42' ' ' LEU . 42.0 m-85 -111.18 139.12 46.82 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.534 -0.757 . . . . 0.35 109.78 176.051 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.584 ' HA ' HE21 ' A' ' 26' ' ' GLN . 0.0 OUTLIER -120.59 128.99 53.56 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 109.559 -0.534 . . . . 1.64 109.559 176.178 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.47 ' HG ' HD21 ' A' ' 38' ' ' LEU . 3.8 mm? -102.65 129.52 49.27 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.278 0.561 . . . . 1.03 110.013 -179.007 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 40.8 t -121.04 121.67 38.44 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.535 -0.757 . . . . 1.57 110.227 -177.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 101.51 -7.46 56.03 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.835 -0.698 . . . . 0.27 112.295 -179.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 20.6 p-10 -77.49 123.34 26.44 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.139 0.495 . . . . 0.58 110.935 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.42 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 30.1 mmm180 -124.33 -26.71 3.89 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.043 -0.526 . . . . 3.08 110.226 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -81.34 -36.02 30.21 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.886 -0.597 . . . . 2.59 110.835 -179.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.438 ' HD2' ' CZ ' ' A' ' 66' ' ' TYR . 78.3 m-85 -130.92 135.39 47.62 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.139 -0.482 . . . . 0.29 110.336 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.576 ' OD1' ' HB3' ' A' ' 36' ' ' ARG . 1.7 p30 -77.04 169.45 18.32 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.904 -0.589 . . . . 0.62 111.16 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.505 ' O ' HD13 ' A' ' 39' ' ' LEU . 4.2 m-20 -52.81 -52.58 56.35 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 123.284 0.365 . . . . 0.59 110.387 -179.348 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.576 ' HB3' ' OD1' ' A' ' 34' ' ' ASP . 6.7 ttp180 -45.32 -49.57 12.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.467 -0.788 . . . . 4.12 111.975 179.456 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -59.77 -41.96 92.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.175 -0.466 . . . . 3.02 111.372 -179.207 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.47 HD21 ' HG ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -82.51 -25.15 33.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.3 -0.409 . . . . 1.03 111.445 -175.799 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.505 HD13 ' O ' ' A' ' 35' ' ' ASP . 2.5 mp -63.11 -34.6 77.94 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.363 -0.38 . . . . 2.38 111.806 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.91 -21.99 66.42 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.478 -0.328 . . . . 1.11 111.211 178.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.465 ' HB2' ' O ' ' A' ' 38' ' ' LEU . 6.4 mt -69.87 -25.41 63.7 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.072 0.463 . . . . 0.99 110.202 175.033 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.566 ' HG ' ' CE2' ' A' ' 25' ' ' PHE . 0.5 OUTLIER -108.04 14.21 25.39 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.799 -0.637 . . . . 1.07 110.171 -179.29 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 13.0 p80 -47.53 -27.02 1.61 Allowed 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 113.489 0.922 . . . . 0.66 113.489 -174.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -104.21 11.29 35.14 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.486 0.55 . . . . 0.6 112.486 -173.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 81.6 mt -102.38 -56.95 0.11 Allowed Pre-proline 0 C--N 1.323 -0.577 0 N-CA-C 114.005 1.113 . . . . 1.53 114.005 -173.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.451 ' HB3' HG11 ' A' ' 22' ' ' VAL . 74.1 Cg_endo -72.26 164.07 36.75 Favored 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 121.36 1.373 . . . . 0.33 113.145 -166.229 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 91.96 -0.36 72.7 Favored Glycine 0 N--CA 1.446 -0.684 0 N-CA-C 110.331 -1.108 . . . . 0.31 110.331 -170.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.411 ' HA ' HG21 ' A' ' 9' ' ' VAL . 44.0 mt-30 -129.57 171.33 12.71 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.075 -0.562 . . . . 2.2 109.77 -179.189 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.487 ' OE2' ' HB2' ' A' ' 5' ' ' HIS . 49.5 mt-10 -99.15 92.15 5.33 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.481 0.658 . . . . 1.12 110.168 178.446 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -83.18 135.81 34.66 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 114.876 -1.056 . . . . 1.08 109.477 -179.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.569 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 28.2 p-10 -83.78 170.7 13.88 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.586 -0.524 . . . . 1.77 109.586 178.15 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.512 ' O ' ' HD2' ' A' ' 56' ' ' HIS . 3.6 mm? -55.33 -42.19 73.46 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.644 0.259 . . . . 1.6 111.07 -176.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 11.5 m -59.48 -45.74 90.81 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.335 -0.393 . . . . 1.26 111.193 -178.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -66.78 -33.95 76.75 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.891 0.377 . . . . 1.74 110.767 176.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 82.2 mt -63.36 -42.68 98.91 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.021 -0.536 . . . . 1.81 110.854 177.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.512 ' HD2' ' O ' ' A' ' 52' ' ' LEU . 55.3 m-70 -69.76 -35.75 75.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.82 0.343 . . . . 3.73 110.416 177.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.4 -33.86 76.83 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.24 -0.436 . . . . 1.07 110.934 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -57.45 -39.13 75.64 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.827 -0.624 . . . . 1.03 111.012 177.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.44 -30.71 69.65 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.778 -0.646 . . . . 1.0 111.322 -178.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.91 -32.03 73.55 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.213 -0.449 . . . . 1.08 110.838 -179.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 77.5 mtt180 -58.84 -42.08 88.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.828 -0.623 . . . . 0.42 110.172 176.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.462 HD11 HD22 ' A' ' 42' ' ' LEU . 62.3 mt -77.37 -35.86 22.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.363 -0.835 . . . . 1.1 110.761 -175.642 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.513 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -60.97 -36.17 91.79 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.859 -0.686 . . . . 0.22 112.197 178.456 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -80.61 -31.81 36.53 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.883 0.373 . . . . 2.17 110.47 177.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.434 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 90.8 t80 -54.45 -50.75 66.94 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.825 -0.625 . . . . 0.25 110.627 177.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . 0.438 ' CZ ' ' HD2' ' A' ' 33' ' ' PHE . 8.5 m-85 -59.53 -39.64 84.59 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.589 -0.732 . . . . 0.66 111.313 178.704 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . 0.513 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 77.3 mt-30 -60.39 -38.29 83.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.252 -0.431 . . . . 1.96 111.267 -177.713 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -73.08 -19.35 61.18 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.031 0.443 . . . . 1.69 111.071 -179.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.434 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 73.6 mmtt -88.38 -4.43 58.66 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.147 -0.479 . . . . 1.23 110.058 178.079 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.31 -8.27 30.76 Favored Glycine 0 N--CA 1.448 -0.53 0 CA-C-N 115.84 -0.618 . . . . 0.34 112.402 178.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . 0.438 ' HB2' ' HB3' ' A' ' 66' ' ' TYR . 44.3 m-85 -90.53 72.51 6.89 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.235 0.541 . . . . 0.8 109.795 -179.452 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 21.2 t -72.53 -24.63 21.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.735 -0.666 . . . . 1.13 110.85 -175.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 96.1 mt -80.72 -9.89 59.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.837 -0.619 . . . . 2.34 110.849 178.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.544 ' HA ' ' O ' ' A' ' 93' ' ' LEU . . . -85.94 139.95 30.77 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.065 -0.516 . . . . 1.08 111.437 -176.166 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 13.4 tpt180 -147.32 131.42 17.31 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.765 -0.652 . . . . 2.16 110.044 177.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -102.02 132.88 47.61 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.806 -0.442 . . . . 0.99 109.806 175.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 48.1 p90 -139.55 142.84 37.18 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.688 0.28 . . . . 0.43 110.316 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.492 HD23 ' H ' ' A' ' 80' ' ' ALA . 7.0 tt -92.98 106.95 21.26 Favored Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 109.167 -0.679 . . . . 1.15 109.167 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -77.28 -8.2 17.33 Favored 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 123.029 2.486 . . . . 1.12 113.009 -172.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.492 ' H ' HD23 ' A' ' 78' ' ' LEU . . . 66.2 -91.31 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 O-C-N 123.904 0.752 . . . . 2.0 110.719 -177.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 52.74 53.37 12.27 Favored 'General case' 0 C--O 1.235 0.297 0 O-C-N 123.424 0.453 . . . . 4.28 110.564 178.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 58.9 82.24 0.15 Allowed 'General case' 0 C--O 1.233 0.205 0 CA-C-O 121.518 0.675 . . . . 3.76 110.805 -177.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 55.6 mt -69.34 145.05 13.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.246 -0.888 . . . . 1.82 111.067 -176.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -67.11 153.87 42.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.014 -0.539 . . . . 1.71 109.74 178.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -80.07 52.44 1.53 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.484 0.659 . . . . 1.54 110.999 -179.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . 0.408 ' HA2' ' O ' ' A' ' 21' ' ' LEU . . . 162.24 -45.11 0.36 Allowed Glycine 0 N--CA 1.444 -0.777 0 CA-C-N 115.566 -0.743 . . . . 0.72 111.638 -179.437 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 17.8 m -95.85 121.65 37.8 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.034 0.445 . . . . 1.12 110.424 176.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 35.0 m -104.0 137.33 33.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 109.283 -0.636 . . . . 1.1 109.283 174.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . 0.464 ' O ' ' HG ' ' A' ' 78' ' ' LEU . 27.4 ttm180 -114.38 135.29 54.25 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.447 -0.501 . . . . 3.51 111.404 -176.4 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.413 ' HB ' HD11 ' A' ' 27' ' ' LEU . 59.4 mt -120.26 136.68 56.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.564 -0.744 . . . . 0.99 110.239 179.013 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 44.9 mm-40 -92.97 120.49 33.34 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.862 -0.422 . . . . 1.33 109.862 179.022 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 40.0 t -102.07 102.05 13.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 116.113 -0.494 . . . . 1.04 110.72 -179.023 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.544 ' O ' ' HA ' ' A' ' 74' ' ' ALA . 61.3 tp -86.48 88.66 7.68 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.968 -0.56 . . . . 1.2 109.497 175.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.42 ' CD ' ' H ' ' A' ' 31' ' ' ARG . 50.1 mt-10 -74.22 -34.21 63.62 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.207 0.527 . . . . 0.49 110.389 -178.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.184 0 CA-C-O 118.322 -1.265 . . . . 1.39 111.118 -178.864 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.3 ttp . . . . . 0 N--CA 1.478 0.969 0 CA-C-O 120.592 0.234 . . . . 15.98 110.869 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 52.3 54.55 10.53 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 113.183 0.809 . . . . 13.23 113.183 172.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 7.3 m-70 -94.61 53.66 1.68 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.089 0.471 . . . . 13.93 110.719 176.034 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 7.2 p80 -166.88 131.24 2.0 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.479 -0.782 . . . . 11.29 109.314 176.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 74.8 t60 -155.87 78.82 0.99 Allowed 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.648 -0.501 . . . . 9.64 109.648 -179.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 15.0 t-80 -88.86 -37.54 15.26 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.981 -0.554 . . . . 10.58 110.224 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 30.5 m80 -67.54 136.96 55.34 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.996 -0.547 . . . . 8.21 110.337 178.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 64.7 t60 -130.75 -26.56 2.2 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.551 -0.75 . . . . 7.27 109.973 -178.009 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 52.1 t -133.64 -61.21 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.004 -0.544 . . . . 2.46 110.187 -178.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 35.8 t70 48.21 52.93 12.55 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.854 0.835 . . . . 4.2 110.548 -177.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -132.53 46.9 2.57 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.282 -0.872 . . . . 4.33 109.107 -179.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -132.77 149.47 52.27 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.328 -0.851 . . . . 4.37 109.825 -177.356 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -61.62 99.85 0.13 Allowed 'General case' 0 C--N 1.329 -0.296 0 O-C-N 123.577 0.548 . . . . 5.36 110.876 -177.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 4.6 tmmm? -95.18 72.83 3.35 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.888 -0.596 . . . . 3.85 109.477 -176.404 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 53.1 ttm -114.17 -42.28 3.38 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.888 -0.596 . . . . 4.76 110.444 178.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -78.99 -12.64 83.92 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.883 -0.675 . . . . 3.71 112.602 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.447 ' O ' ' HG2' ' A' ' 14' ' ' LYS . . . 160.17 166.18 18.51 Favored Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 120.87 -0.681 . . . . 2.09 111.905 179.086 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -57.37 150.9 56.2 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 123.433 2.756 . . . . 1.35 112.519 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.519 ' HA ' ' HA ' ' A' ' 51' ' ' ASN . 24.2 p -80.73 139.32 36.17 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.207 0.527 . . . . 1.2 111.335 -178.263 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 59.1 t -115.63 119.56 62.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.626 -0.716 . . . . 1.22 110.034 178.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.434 ' HB2' ' HG2' ' A' ' 49' ' ' GLU . 48.7 tp -65.82 115.99 6.52 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.353 -0.385 . . . . 1.53 110.081 175.41 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.567 HG12 ' CE1' ' A' ' 25' ' ' PHE . 51.7 t -100.69 136.52 31.83 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 CA-C-N 115.902 -0.59 . . . . 1.03 109.692 177.368 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -118.64 -24.46 6.72 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 109.797 -0.446 . . . . 1.7 109.797 176.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 16.3 ptp180 -162.69 154.3 18.01 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.06 -0.518 . . . . 2.48 110.67 175.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.567 ' CE1' HG12 ' A' ' 22' ' ' VAL . 33.2 m-85 -106.32 145.54 31.53 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.909 -0.587 . . . . 0.35 110.498 178.093 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.457 ' O ' ' HA ' ' A' ' 89' ' ' ARG . 50.1 tp60 -125.08 129.39 50.14 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 109.371 -0.603 . . . . 1.64 109.371 176.401 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.423 HD13 ' HB ' ' A' ' 90' ' ' ILE . 4.1 mm? -103.31 136.93 42.16 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.675 -0.491 . . . . 1.03 109.675 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.5 t -124.76 128.98 49.6 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.384 -0.371 . . . . 1.57 110.05 -179.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 96.48 -11.07 67.03 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.632 -0.794 . . . . 0.27 112.562 178.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 6.2 p-10 -67.67 144.95 55.25 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.906 0.384 . . . . 0.58 110.61 178.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.443 ' HB3' ' OE1' ' A' ' 94' ' ' GLU . 21.8 tpp180 -143.57 -37.72 0.34 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.795 -0.639 . . . . 3.08 110.161 179.355 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -68.62 -43.67 75.87 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.669 -0.696 . . . . 2.59 110.517 179.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -125.08 151.94 45.0 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.991 -0.744 . . . . 0.29 108.991 175.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -96.78 172.45 7.88 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.199 -0.297 . . . . 0.62 110.199 -178.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.516 ' O ' HD13 ' A' ' 39' ' ' LEU . 4.9 m-20 -50.7 -51.35 50.43 Favored 'General case' 0 C--O 1.221 -0.404 0 O-C-N 123.31 0.381 . . . . 0.59 110.785 -178.649 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 72.9 mtp180 -55.38 -33.67 63.66 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.946 -0.57 . . . . 4.12 111.967 -175.038 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 31.5 tpt85 -77.22 -41.91 39.46 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.683 -0.235 . . . . 3.02 110.829 -178.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.419 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -76.17 -27.37 56.92 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.983 0.421 . . . . 1.03 110.8 -178.515 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.516 HD13 ' O ' ' A' ' 35' ' ' ASP . 3.8 mp -60.9 -30.4 70.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.868 -0.605 . . . . 2.38 111.053 176.297 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.63 -23.32 65.97 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.727 -0.67 . . . . 1.11 111.633 178.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.432 HD11 ' HA ' ' A' ' 62' ' ' ILE . 2.3 mt -75.05 -26.65 59.56 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.344 0.592 . . . . 0.99 110.3 176.574 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.484 ' HG ' ' CE2' ' A' ' 25' ' ' PHE . 0.4 OUTLIER -105.49 14.26 28.9 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.648 -0.706 . . . . 1.07 109.886 -179.086 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 8.3 p80 -51.5 -22.86 3.43 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.408 0.892 . . . . 0.66 113.408 -171.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -107.83 -0.4 21.62 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.816 0.302 . . . . 0.6 111.816 -174.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 64.1 mt -84.45 -54.05 0.49 Allowed Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 113.462 0.912 . . . . 1.53 113.462 -173.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.438 ' HB3' HG11 ' A' ' 22' ' ' VAL . 73.8 Cg_endo -74.22 155.45 46.74 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 121.275 1.316 . . . . 0.33 112.051 -170.275 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 99.23 -17.14 58.36 Favored Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 109.444 -1.462 . . . . 0.31 109.444 -167.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 16.4 mt-30 -116.4 173.3 6.68 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.267 -0.966 . . . . 2.2 109.532 176.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.434 ' HG2' ' HB2' ' A' ' 21' ' ' LEU . 43.0 mt-10 -107.51 106.93 17.55 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.234 0.54 . . . . 1.12 109.972 178.554 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.473 HD13 ' NE2' ' A' ' 54' ' ' GLN . 2.6 mm? -93.56 126.46 38.73 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.911 -1.04 . . . . 1.08 110.318 -173.646 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.529 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 4.0 p30 -77.25 167.79 21.13 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 121.266 -0.174 . . . . 1.77 110.597 178.57 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.408 ' HA ' HD12 ' A' ' 55' ' ' LEU . 4.2 mm? -46.43 -45.06 17.8 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.453 0.538 . . . . 1.6 112.453 -176.181 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 33.2 m -56.59 -46.77 80.64 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.697 0.284 . . . . 1.26 111.032 -178.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.473 ' NE2' HD13 ' A' ' 50' ' ' LEU . 9.8 mt-30 -77.47 -23.72 50.34 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.422 -0.354 . . . . 1.74 111.348 -178.62 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 78.8 mt -61.41 -53.42 56.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.658 0.266 . . . . 1.81 110.366 176.369 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 34.6 p80 -77.38 -23.65 50.73 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.392 -0.523 . . . . 3.73 111.125 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.21 -32.15 73.62 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.139 0.495 . . . . 1.07 110.044 174.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.02 -41.36 92.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.62 -0.718 . . . . 1.03 110.253 175.007 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.16 -36.79 82.56 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.529 -0.76 . . . . 1.0 110.659 178.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.56 -34.6 78.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.911 -0.586 . . . . 1.08 111.09 179.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -57.31 -41.54 80.06 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.419 0.628 . . . . 0.42 110.034 175.021 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.46 HD13 HD23 ' A' ' 42' ' ' LEU . 76.9 mt -75.9 -36.72 33.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.154 -0.93 . . . . 1.1 110.717 -177.031 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.577 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -58.9 -47.98 87.88 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.688 -0.767 . . . . 0.22 111.689 177.038 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -68.35 -30.92 69.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.711 0.291 . . . . 2.17 110.552 178.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.418 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 86.9 t80 -57.79 -49.37 76.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.998 -0.546 . . . . 0.25 110.376 177.751 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 -61.58 -46.66 88.95 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.686 -0.688 . . . . 0.66 111.169 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . 0.577 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 15.7 mt-30 -56.84 -40.42 76.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.16 0.505 . . . . 1.96 110.536 179.452 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -63.72 -30.07 71.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.264 -0.88 . . . . 1.69 110.73 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.418 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 75.8 mmtt -90.04 6.8 40.76 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.902 -0.59 . . . . 1.23 110.927 -178.681 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 104.31 -12.18 51.49 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.953 -0.641 . . . . 0.34 112.914 176.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -88.76 70.16 8.72 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.212 0.529 . . . . 0.8 109.602 -179.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 26.1 t -71.1 -24.33 24.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.759 -0.655 . . . . 1.13 110.579 -176.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 50.3 tp -80.75 -7.16 59.29 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.668 -0.696 . . . . 2.34 110.389 178.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -99.92 134.86 42.21 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.183 0.516 . . . . 1.08 111.466 -176.234 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 16.7 mmm180 -141.86 164.28 30.63 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.553 -0.749 . . . . 2.16 109.509 176.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -127.53 137.5 52.64 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.971 -0.381 . . . . 0.99 109.971 179.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 48.1 p90 -132.39 143.16 49.64 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.9 0.381 . . . . 0.43 110.298 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 8.1 tt -96.18 110.83 54.21 Favored Pre-proline 0 C--N 1.32 -0.705 0 N-CA-C 109.164 -0.68 . . . . 1.15 109.164 178.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -57.83 111.32 0.81 Allowed 'Trans proline' 0 N--CA 1.463 -0.282 0 C-N-CA 122.677 2.251 . . . . 1.12 111.701 177.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -87.69 -1.5 58.0 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.877 -0.601 . . . . 2.0 111.547 -175.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -81.64 100.39 9.41 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.796 -0.446 . . . . 4.28 109.796 178.058 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 62.31 71.24 0.54 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.344 -0.844 . . . . 3.76 110.499 -177.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 21.2 mt -71.81 141.91 16.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.325 -0.852 . . . . 1.82 110.336 177.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 -89.02 159.58 17.52 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.332 -0.395 . . . . 1.71 109.973 177.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -107.24 149.65 27.51 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.697 -0.482 . . . . 1.54 109.697 179.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 78.18 -66.02 3.23 Favored Glycine 0 N--CA 1.445 -0.709 0 N-CA-C 111.271 -0.732 . . . . 0.72 111.271 -175.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 25.8 m -100.65 120.57 40.26 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.288 -0.634 . . . . 1.12 109.288 173.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 29.6 m -116.36 131.43 68.94 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.938 0 N-CA-C 109.847 -0.427 . . . . 1.1 109.847 179.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . 0.457 ' HA ' ' O ' ' A' ' 26' ' ' GLN . 25.0 ttp180 -106.26 128.71 54.16 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.351 0.596 . . . . 3.51 111.221 -174.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.423 ' HB ' HD13 ' A' ' 27' ' ' LEU . 63.1 mt -113.89 134.83 55.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.042 -0.981 . . . . 0.99 109.187 177.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -96.49 128.26 43.26 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.216 0.531 . . . . 1.33 110.693 -179.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.406 ' CG2' HD11 ' A' ' 27' ' ' LEU . 47.7 t -102.63 124.55 56.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.445 -0.798 . . . . 1.04 110.259 -178.464 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 56.7 tp -107.85 99.93 9.35 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.525 -0.546 . . . . 1.2 109.525 177.021 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.443 ' OE1' ' HB3' ' A' ' 31' ' ' ARG . 69.4 mt-10 -87.61 33.64 0.7 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.889 -0.596 . . . . 0.49 111.045 -175.535 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.901 0 CA-C-O 118.65 -1.084 . . . . 1.39 112.13 179.882 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 88.3 mmm . . . . . 0 N--CA 1.479 1.021 0 CA-C-O 120.794 0.33 . . . . 15.98 110.622 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -80.44 102.18 9.5 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.184 -0.462 . . . . 13.23 110.366 178.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 12.8 p-80 -104.61 41.78 1.28 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.961 -0.563 . . . . 13.93 110.974 -177.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 36.9 t-80 -65.14 124.43 22.11 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.275 -0.421 . . . . 11.29 110.295 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 78.0 t60 -59.26 127.68 33.35 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.862 -0.608 . . . . 9.64 110.735 -179.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 40.0 m80 -97.41 152.07 19.32 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.544 -0.753 . . . . 10.58 109.321 178.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 17.7 t-80 -67.3 -26.52 66.56 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.17 -0.678 . . . . 8.21 109.17 174.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 32.6 m170 -83.02 86.47 6.99 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.717 -0.846 . . . . 7.27 108.717 171.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.451 ' HB ' ' HA ' ' A' ' 48' ' ' GLN . 46.5 t -67.92 113.41 3.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.496 -0.32 . . . . 2.46 111.187 -175.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 17.2 t70 55.17 70.07 0.67 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.257 -0.883 . . . . 4.2 110.739 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -98.17 151.73 20.11 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.584 -0.734 . . . . 4.33 111.023 -177.074 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.505 ' H ' HG22 ' A' ' 19' ' ' THR . 10.2 m-20 -113.91 153.67 28.84 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.556 -0.747 . . . . 4.37 109.311 176.063 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -55.94 -71.6 0.09 Allowed 'General case' 0 C--N 1.327 -0.396 0 O-C-N 123.265 0.353 . . . . 5.36 110.96 -177.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.487 ' HD2' ' O ' ' A' ' 14' ' ' LYS . 1.4 tmmt? -166.22 72.87 0.16 Allowed 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.083 -0.71 . . . . 3.85 109.083 177.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 47.4 ttp -98.53 91.33 5.11 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.819 -0.628 . . . . 4.76 109.954 -179.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . 0.407 ' HA3' ' OG ' ' A' ' 53' ' ' SER . . . 86.35 -9.47 70.22 Favored Glycine 0 N--CA 1.448 -0.562 0 CA-C-N 115.619 -0.719 . . . . 3.71 111.445 -175.448 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 147.78 158.2 7.8 Favored Glycine 0 N--CA 1.443 -0.844 0 N-CA-C 111.372 -0.691 . . . . 2.09 111.372 -179.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -59.31 138.43 84.5 Favored 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.998 2.465 . . . . 1.35 112.142 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.532 ' HB ' ' HB3' ' A' ' 49' ' ' GLU . 32.5 p -71.84 140.93 49.58 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.944 -0.571 . . . . 1.2 111.918 -174.487 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 32.8 t -109.86 127.61 66.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 115.591 -0.731 . . . . 1.22 110.189 178.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.497 ' O ' ' HA2' ' A' ' 86' ' ' GLY . 24.7 tp -72.91 92.0 1.59 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.081 -0.711 . . . . 1.53 109.081 174.261 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.552 ' HA ' ' O ' ' A' ' 86' ' ' GLY . 98.8 t -70.66 123.8 25.46 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.048 0 CA-C-N 115.295 -0.866 . . . . 1.03 111.149 -174.745 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.405 ' HG2' ' HA3' ' A' ' 86' ' ' GLY . 10.7 mmtp -80.84 -40.45 24.86 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.544 -0.753 . . . . 1.7 109.449 176.1 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 4.6 ptp180 -174.59 169.57 3.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 114.493 -1.23 . . . . 2.48 109.392 -179.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.537 ' CE1' HG11 ' A' ' 22' ' ' VAL . 33.6 m-85 -106.04 125.1 50.58 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.002 -0.544 . . . . 0.35 110.525 178.527 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.4 ' O ' ' HA ' ' A' ' 89' ' ' ARG . 11.9 tp60 -104.63 127.51 52.4 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.325 -0.852 . . . . 1.64 108.721 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.423 HD11 ' HB ' ' A' ' 90' ' ' ILE . 3.7 mm? -102.97 134.91 45.62 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.148 0.499 . . . . 1.03 110.321 -177.591 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.444 ' HB2' ' HD3' ' A' ' 89' ' ' ARG . 28.4 t -127.76 135.04 49.59 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.763 -0.653 . . . . 1.57 109.797 -178.504 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 91.11 -11.36 72.4 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.672 -0.775 . . . . 0.27 112.646 179.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 15.5 p-10 -75.17 137.64 41.46 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.75 0.31 . . . . 0.58 110.688 179.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 30.1 tpt180 -128.2 -44.58 1.42 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.406 -0.361 . . . . 3.08 110.942 177.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.451 ' HG2' ' HH ' ' A' ' 71' ' ' TYR . 21.8 tp60 -64.85 -40.85 95.81 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.972 0.415 . . . . 2.59 110.612 -177.598 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 -125.63 133.37 52.24 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.936 -0.764 . . . . 0.29 108.936 177.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -88.76 178.08 6.56 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.613 -0.435 . . . . 0.62 110.629 -178.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -47.61 -48.83 28.2 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 123.743 0.652 . . . . 0.59 111.909 -176.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 79.0 mtm180 -55.17 -38.22 68.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.835 -0.621 . . . . 4.12 111.799 -173.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 37.1 tpt85 -77.57 -38.65 47.99 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.346 -0.388 . . . . 3.02 110.883 -176.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.447 ' HA ' HD13 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -81.67 -32.57 31.74 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 111.982 0.364 . . . . 1.03 111.982 -174.319 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.5 pp -68.19 -18.83 64.69 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.913 -0.315 . . . . 2.38 110.92 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.46 -24.04 63.74 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.248 -0.433 . . . . 1.11 110.653 177.16 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.447 HD13 ' HA ' ' A' ' 38' ' ' LEU . 1.9 mt -67.44 -22.84 65.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.331 0.586 . . . . 0.99 110.143 175.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.451 ' CD1' ' HD2' ' A' ' 61' ' ' ARG . 0.7 OUTLIER -111.93 13.26 20.83 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.712 -0.676 . . . . 1.07 110.403 -179.041 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 5.4 p80 -51.11 -21.87 2.16 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 113.488 0.921 . . . . 0.66 113.488 -172.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -94.88 -8.89 35.9 Favored 'General case' 0 C--N 1.328 -0.359 0 O-C-N 122.261 -0.274 . . . . 0.6 111.643 -175.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.403 ' O ' HD23 ' A' ' 50' ' ' LEU . 87.7 mt -87.21 -58.18 0.29 Allowed Pre-proline 0 C--N 1.325 -0.495 0 N-CA-C 113.601 0.963 . . . . 1.53 113.601 -171.188 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.417 ' HB3' HG13 ' A' ' 22' ' ' VAL . 61.0 Cg_endo -68.81 156.46 65.36 Favored 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 121.406 1.404 . . . . 0.33 112.439 -168.613 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 96.67 -14.89 63.59 Favored Glycine 0 N--CA 1.446 -0.69 0 N-CA-C 109.895 -1.282 . . . . 0.31 109.895 -168.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.451 ' HA ' ' HB ' ' A' ' 9' ' ' VAL . 28.5 mt-30 -120.23 172.95 7.42 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 114.802 -0.699 . . . . 2.2 109.699 176.203 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.532 ' HB3' ' HB ' ' A' ' 19' ' ' THR . 4.4 mt-10 -97.21 108.92 21.75 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.902 -0.59 . . . . 1.12 110.307 177.279 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.44 HD22 ' N ' ' A' ' 50' ' ' LEU . 2.6 mm? -99.12 131.78 44.91 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.902 -0.59 . . . . 1.08 109.763 -179.472 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.532 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 8.1 p30 -75.31 163.38 27.53 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.157 -0.474 . . . . 1.77 110.819 179.486 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.4 HD11 HD12 ' A' ' 55' ' ' LEU . 4.4 mm? -52.03 -43.03 63.54 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 123.258 0.349 . . . . 1.6 111.77 -176.755 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.407 ' OG ' ' HA3' ' A' ' 16' ' ' GLY . 5.1 m -56.87 -49.18 76.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.882 0.372 . . . . 1.26 110.303 178.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 11.7 mt-30 -68.0 -29.19 68.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.011 -0.54 . . . . 1.74 111.467 178.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.532 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 77.4 mt -65.42 -43.05 91.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.998 0.428 . . . . 1.81 110.236 176.323 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -72.35 -33.97 67.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.512 -0.313 . . . . 3.73 110.465 178.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.25 -30.98 72.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.076 0.465 . . . . 1.07 110.617 177.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.53 -42.15 98.39 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.775 -0.648 . . . . 1.03 110.74 176.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.61 -34.41 78.16 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.916 -0.584 . . . . 1.0 110.821 178.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.32 -36.52 82.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.915 -0.584 . . . . 1.08 111.128 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.451 ' HD2' ' CD1' ' A' ' 42' ' ' LEU . 94.0 mtt180 -57.89 -41.41 82.48 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.107 -0.497 . . . . 0.42 110.428 177.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.418 ' O ' ' HB3' ' A' ' 65' ' ' PHE . 68.3 mt -78.42 -34.9 18.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.526 -0.761 . . . . 1.1 110.533 -176.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.435 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -59.85 -47.39 91.23 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.765 -0.731 . . . . 0.22 111.692 176.279 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -71.28 -24.25 62.12 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.505 0.193 . . . . 2.17 110.917 177.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.427 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 93.1 t80 -60.36 -49.41 77.7 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.116 0.484 . . . . 0.25 110.019 176.673 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 8.1 m-85 -62.2 -42.27 99.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.593 -0.73 . . . . 0.66 110.721 176.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . 0.435 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 49.8 mt-30 -61.06 -36.0 78.45 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.109 -0.496 . . . . 1.96 111.093 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -62.22 -35.47 78.98 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.1 0.476 . . . . 1.69 110.347 176.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.427 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 73.1 mmtt -83.23 4.75 25.53 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.845 -0.616 . . . . 1.23 110.98 -176.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 98.97 -2.99 58.39 Favored Glycine 0 N--CA 1.449 -0.494 0 CA-C-N 116.01 -0.541 . . . . 0.34 112.706 177.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . 0.451 ' HH ' ' HG2' ' A' ' 32' ' ' GLN . 45.9 m-85 -88.58 75.18 8.35 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.336 0.588 . . . . 0.8 109.721 -179.828 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 21.9 t -74.07 -23.87 18.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.561 -0.745 . . . . 1.13 110.313 -177.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 86.0 mt -81.31 -3.03 51.31 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.848 -0.615 . . . . 2.34 110.806 178.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -102.23 147.16 26.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.918 -0.583 . . . . 1.08 110.996 -178.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 26.1 tpt180 -160.19 136.15 8.52 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.944 -0.571 . . . . 2.16 109.73 177.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -99.11 140.54 33.11 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.646 -0.252 . . . . 0.99 110.438 179.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 46.3 p90 -137.3 155.07 49.89 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.909 0.385 . . . . 0.43 110.407 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 9.9 tt -110.84 107.07 57.93 Favored Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 109.778 -0.453 . . . . 1.15 109.778 -178.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -76.91 83.39 2.12 Favored 'Trans proline' 0 C--O 1.233 0.268 0 C-N-CA 123.004 2.469 . . . . 1.12 112.298 -178.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -76.75 78.19 3.37 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.173 -0.467 . . . . 2.0 111.303 -176.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -145.78 -54.86 0.28 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.09 -0.505 . . . . 4.28 111.109 178.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 45.8 mm-40 -119.01 35.7 4.72 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.859 0.362 . . . . 3.76 110.921 -178.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 56.4 mt -92.67 127.88 44.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.26 -0.427 . . . . 1.82 110.437 178.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . 0.4 ' H ' ' CD ' ' A' ' 84' ' ' GLN . 5.0 pm0 -64.46 164.83 10.83 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.603 -0.726 . . . . 1.71 110.705 177.703 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -81.24 149.42 29.03 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.066 -0.515 . . . . 1.54 110.053 178.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . 0.552 ' O ' ' HA ' ' A' ' 22' ' ' VAL . . . 89.58 -90.3 1.62 Allowed Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 121.03 -0.605 . . . . 0.72 111.78 -176.731 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 85.5 m -72.87 120.96 19.23 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 117.191 0.496 . . . . 1.12 110.315 177.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 34.2 m -102.33 138.16 27.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 109.858 -0.423 . . . . 1.1 109.858 179.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . 0.444 ' HD3' ' HB2' ' A' ' 28' ' ' SER . 23.0 ttm180 -107.19 129.01 54.91 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.15 0.5 . . . . 3.51 111.107 -177.476 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.423 ' HB ' HD11 ' A' ' 27' ' ' LEU . 56.6 mt -113.65 130.74 67.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.543 -0.753 . . . . 0.99 109.413 176.596 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -95.22 125.4 39.84 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.373 0.606 . . . . 1.33 110.36 -179.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 71.7 t -98.71 103.47 14.74 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 115.287 -0.869 . . . . 1.04 110.434 -177.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 52.3 tp -85.93 93.62 8.99 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.396 -0.594 . . . . 1.2 109.396 176.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -72.17 -18.98 61.82 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.121 -0.491 . . . . 0.49 110.423 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.157 0 CA-C-O 117.976 -1.458 . . . . 1.39 111.037 179.398 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.6 ttm . . . . . 0 N--CA 1.478 0.975 0 CA-C-O 120.895 0.378 . . . . 15.98 110.71 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -88.09 86.16 7.06 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.901 0.381 . . . . 13.23 111.066 -176.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 46.6 m80 -84.3 87.64 7.21 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.216 -0.447 . . . . 13.93 110.698 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 49.3 m-70 -76.18 -37.02 58.41 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.991 0.424 . . . . 11.29 110.16 178.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -86.27 126.71 34.5 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.911 -0.586 . . . . 9.64 110.135 177.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . 0.455 ' O ' HD22 ' A' ' 21' ' ' LEU . 88.1 m-70 -115.05 -179.75 3.72 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.64 -0.504 . . . . 10.58 109.64 -179.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 46.1 m80 57.96 66.14 1.17 Allowed 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.192 0.52 . . . . 8.21 110.028 -175.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 68.9 m-70 -70.78 141.21 51.42 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.362 -0.835 . . . . 7.27 112.497 -170.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 53.8 t -113.4 -39.64 3.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.761 0 CA-C-N 114.417 -1.265 . . . . 2.46 108.327 173.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.5 t70 171.61 121.61 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 114.926 -1.034 . . . . 4.2 109.856 175.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -116.65 25.2 10.74 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 122.017 0.913 . . . . 4.33 109.616 -179.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -82.76 -36.8 25.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.537 -0.756 . . . . 4.37 110.207 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -76.75 67.83 2.89 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.149 -0.478 . . . . 5.36 109.868 173.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 15.0 ttmm -100.24 -74.69 0.6 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.916 -0.584 . . . . 3.85 111.288 -175.074 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 64.8 mtm 52.54 76.62 0.18 Allowed 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.49 -0.777 . . . . 4.76 111.38 -177.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 106.33 -100.35 1.62 Allowed Glycine 0 N--CA 1.444 -0.768 0 C-N-CA 120.721 -0.752 . . . . 3.71 112.195 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -85.36 136.91 14.84 Favored Glycine 0 N--CA 1.444 -0.798 0 C-N-CA 120.705 -0.76 . . . . 2.09 112.455 -178.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -55.52 147.48 58.17 Favored 'Trans proline' 0 C--O 1.236 0.376 0 C-N-CA 123.355 2.703 . . . . 1.35 112.014 177.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.526 ' HA ' ' HA ' ' A' ' 51' ' ' ASN . 40.6 p -64.28 140.41 58.87 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.919 -0.582 . . . . 1.2 111.418 -176.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 75.1 t -99.05 121.07 49.21 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-N 115.581 -0.736 . . . . 1.22 109.67 176.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.589 ' O ' ' HA2' ' A' ' 86' ' ' GLY . 50.8 tp -71.3 91.85 1.0 Allowed 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.574 -0.528 . . . . 1.53 109.574 176.175 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.581 HG11 ' CE1' ' A' ' 25' ' ' PHE . 61.7 t -68.71 113.54 4.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.932 0 CA-C-N 115.339 -0.846 . . . . 1.03 110.582 -178.132 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -92.84 -32.36 14.65 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.545 -0.752 . . . . 1.7 109.168 175.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 12.5 ptp180 -163.87 158.5 19.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.562 -0.745 . . . . 2.48 110.342 -179.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.581 ' CE1' HG11 ' A' ' 22' ' ' VAL . 31.9 m-85 -105.25 142.0 35.79 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.985 -0.552 . . . . 0.35 109.822 176.018 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 45.0 tp60 -123.16 128.27 49.83 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.198 -0.667 . . . . 1.64 109.198 178.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.422 HD13 ' HB ' ' A' ' 90' ' ' ILE . 3.9 mm? -103.36 133.39 48.5 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.124 0.488 . . . . 1.03 110.436 -177.814 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.469 ' O ' ' HA ' ' A' ' 91' ' ' GLU . 23.1 t -127.51 126.2 41.81 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.899 -0.592 . . . . 1.57 109.929 -178.332 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 100.97 -15.17 58.31 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.545 -0.836 . . . . 0.27 112.372 179.086 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 15.1 p-10 -72.38 136.21 46.06 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.754 0.312 . . . . 0.58 110.663 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.8 tpp180 -130.12 -39.28 1.37 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.248 -0.433 . . . . 3.08 110.708 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 24.0 tp60 -68.41 -40.24 81.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.012 0.434 . . . . 2.59 110.634 -179.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -126.59 134.66 50.75 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.027 -0.533 . . . . 0.29 109.64 179.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -79.31 176.19 9.91 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.943 -0.571 . . . . 0.62 111.593 -176.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.508 ' O ' HD13 ' A' ' 39' ' ' LEU . 6.4 m-20 -55.99 -57.01 13.9 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 116.147 -0.479 . . . . 0.59 110.991 -178.502 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 74.2 mtp180 -58.03 -34.77 70.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.233 -0.439 . . . . 4.12 111.502 -175.147 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 15.0 tpt180 -62.26 -46.14 90.14 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.096 -0.502 . . . . 3.02 110.684 176.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.444 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -78.08 -27.54 48.59 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.138 -0.483 . . . . 1.03 111.311 -178.139 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.508 HD13 ' O ' ' A' ' 35' ' ' ASP . 1.8 mp -57.18 -35.15 69.24 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.085 -0.507 . . . . 2.38 111.318 177.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.5 -25.51 66.13 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.042 -0.526 . . . . 1.11 111.697 178.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.444 HD12 ' HA ' ' A' ' 38' ' ' LEU . 4.0 mt -69.62 -28.06 65.61 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.155 0.503 . . . . 0.99 110.45 177.014 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.497 ' HG ' ' CE2' ' A' ' 25' ' ' PHE . 0.4 OUTLIER -106.53 13.27 28.55 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.898 -0.592 . . . . 1.07 110.164 -178.299 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 9.3 p80 -48.86 -26.11 2.26 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.821 1.045 . . . . 0.66 113.821 -172.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -105.08 5.97 32.89 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 111.98 0.363 . . . . 0.6 111.98 -174.101 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 84.3 mt -94.67 -52.19 0.24 Allowed Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 113.84 1.052 . . . . 1.53 113.84 -173.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.426 ' HB3' HG13 ' A' ' 22' ' ' VAL . 71.8 Cg_endo -74.61 157.41 44.41 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 121.233 1.289 . . . . 0.33 112.254 -169.665 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 98.44 -5.9 60.86 Favored Glycine 0 N--CA 1.446 -0.648 0 N-CA-C 110.023 -1.231 . . . . 0.31 110.023 -169.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -121.15 170.52 9.48 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.733 -0.734 . . . . 2.2 109.085 176.253 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -100.07 107.56 19.5 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.477 -0.564 . . . . 1.12 109.477 176.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -101.01 122.91 44.36 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.595 -0.729 . . . . 1.08 110.376 -175.068 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.596 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 31.2 p-10 -72.26 166.3 22.71 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.553 -0.294 . . . . 1.77 110.805 177.587 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.452 ' HA ' HD11 ' A' ' 55' ' ' LEU . 4.6 mm? -48.34 -46.06 36.08 Favored 'General case' 0 C--N 1.329 -0.3 0 O-C-N 123.461 0.476 . . . . 1.6 111.585 -177.26 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.424 ' HA ' ' NE2' ' A' ' 56' ' ' HIS . 13.1 m -50.61 -53.53 30.01 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.878 -0.601 . . . . 1.26 111.113 178.605 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -72.7 -23.83 60.92 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.005 -0.543 . . . . 1.74 111.679 -178.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.596 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 85.5 mt -65.1 -53.0 52.18 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.579 -0.282 . . . . 1.81 110.9 179.426 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.424 ' NE2' ' HA ' ' A' ' 53' ' ' SER . 31.5 p80 -74.34 -23.46 59.04 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.396 -0.522 . . . . 3.73 111.203 -179.448 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.12 -33.85 75.23 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.989 0.423 . . . . 1.07 110.516 175.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.87 -34.87 76.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.782 -0.644 . . . . 1.03 110.854 176.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.98 -30.37 69.63 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.942 -0.572 . . . . 1.0 110.887 -179.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.85 -28.9 69.87 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.98 -0.555 . . . . 1.08 110.829 179.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 78.0 mtt180 -63.06 -39.84 95.91 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.161 0.505 . . . . 0.42 110.129 176.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.44 HD11 HD22 ' A' ' 42' ' ' LEU . 78.6 mt -79.05 -36.32 18.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.467 -0.788 . . . . 1.1 110.726 -177.294 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.629 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -59.94 -46.9 93.32 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.389 -0.91 . . . . 0.22 111.038 174.579 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.419 ' O ' ' HG3' ' A' ' 68' ' ' GLU . 21.6 t70 -63.51 -37.52 87.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.624 -0.288 . . . . 2.17 110.653 176.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.404 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 82.8 t80 -53.22 -53.5 49.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.918 -0.583 . . . . 0.25 110.834 177.003 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -59.63 -40.52 87.89 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.709 -0.678 . . . . 0.66 111.184 178.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . 0.629 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 78.4 mt-30 -61.69 -37.89 85.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.483 -0.326 . . . . 1.96 111.226 -178.451 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.419 ' HG3' ' O ' ' A' ' 64' ' ' ASP . 44.0 mt-10 -70.27 -19.67 63.1 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.058 0.456 . . . . 1.69 110.658 178.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.404 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 75.3 mmtt -90.74 6.47 43.98 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.022 -0.536 . . . . 1.23 110.326 177.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 97.54 -8.95 64.38 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 121.06 -0.59 . . . . 0.34 112.555 177.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -88.46 73.29 8.75 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.381 0.61 . . . . 0.8 109.8 -178.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 23.8 t -71.31 -28.57 32.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.45 -0.795 . . . . 1.13 110.927 -176.039 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 10.8 mp -82.4 -3.47 55.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.282 -0.417 . . . . 2.34 110.92 179.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -91.39 136.24 33.25 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.073 -0.512 . . . . 1.08 110.494 179.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 17.1 tpt180 -149.03 131.73 15.94 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.945 -0.57 . . . . 2.16 110.071 -179.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.75 138.36 36.02 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.029 -0.532 . . . . 0.99 109.93 176.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 52.9 p90 -137.45 155.49 49.26 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.555 -0.535 . . . . 0.43 109.555 179.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.8 tt -111.59 108.91 56.1 Favored Pre-proline 0 C--N 1.318 -0.782 0 N-CA-C 109.64 -0.504 . . . . 1.15 109.64 -179.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.492 ' HG3' ' OE2' ' A' ' 91' ' ' GLU . 36.8 Cg_endo -64.66 105.12 0.6 Allowed 'Trans proline' 0 C--O 1.234 0.319 0 C-N-CA 122.768 2.312 . . . . 1.12 112.165 -179.459 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -80.85 64.13 5.5 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.341 0.591 . . . . 2.0 110.81 -178.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -116.9 78.45 1.21 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.634 -0.712 . . . . 4.28 109.921 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 60.27 62.34 1.61 Allowed 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.964 -0.562 . . . . 3.76 110.716 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 56.4 mt -62.49 137.82 23.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.367 -0.833 . . . . 1.82 111.087 -178.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . 0.433 ' HB2' ' O ' ' A' ' 87' ' ' THR . 38.9 mt-30 -59.63 146.21 41.83 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.378 -0.828 . . . . 1.71 110.107 177.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -79.69 34.18 0.27 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.098 0.475 . . . . 1.54 111.525 -176.063 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . 0.589 ' HA2' ' O ' ' A' ' 21' ' ' LEU . . . -170.75 -51.06 0.04 OUTLIER Glycine 0 N--CA 1.445 -0.754 0 C-N-CA 121.032 -0.604 . . . . 0.72 111.94 -178.448 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.433 ' O ' ' HB2' ' A' ' 84' ' ' GLN . 12.5 m -98.32 121.16 39.91 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.772 0.32 . . . . 1.12 110.736 179.318 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 34.8 m -103.51 134.98 43.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 N-CA-C 109.658 -0.497 . . . . 1.1 109.658 176.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . 0.484 ' O ' ' HD2' ' A' ' 79' ' ' PRO . 37.4 ttp180 -111.54 115.3 28.95 Favored 'General case' 0 C--N 1.32 -0.713 0 C-N-CA 120.554 -0.458 . . . . 3.51 110.968 -177.289 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.422 ' HB ' HD13 ' A' ' 27' ' ' LEU . 60.9 mt -101.88 126.21 55.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.789 -0.641 . . . . 0.99 109.779 177.813 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.492 ' OE2' ' HG3' ' A' ' 79' ' ' PRO . 53.8 mt-10 -94.76 125.23 39.28 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.17 0.509 . . . . 1.33 110.271 -179.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 40.2 t -101.63 100.97 11.43 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-N 115.513 -0.767 . . . . 1.04 110.588 -175.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 57.7 tp -86.18 90.05 8.02 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.359 -0.608 . . . . 1.2 109.359 176.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -68.47 -27.42 66.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.685 -0.688 . . . . 0.49 110.689 -176.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.153 0 CA-C-O 118.47 -1.183 . . . . 1.39 111.584 178.695 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 92.4 mmm . . . . . 0 N--CA 1.479 1.009 0 CA-C-O 120.985 0.422 . . . . 15.98 110.191 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -135.04 10.64 3.58 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.289 0.566 . . . . 13.23 110.292 178.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 13.7 m170 -82.1 150.69 27.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.718 -0.674 . . . . 13.93 109.908 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 37.8 m80 58.95 40.86 21.97 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.315 0.578 . . . . 11.29 109.886 -172.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 13.9 t-80 -165.77 -33.94 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.284 -0.871 . . . . 9.64 110.375 179.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -64.13 -36.5 84.24 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.313 -0.403 . . . . 10.58 110.342 178.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 11.9 p80 -137.37 117.26 13.22 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.11 0.481 . . . . 8.21 110.506 173.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 29.2 p80 -88.78 -6.66 57.25 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.318 0.58 . . . . 7.27 109.479 176.221 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.459 HG11 ' HA ' ' A' ' 48' ' ' GLN . 11.6 p -85.86 146.77 6.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.214 -0.903 . . . . 2.46 110.107 177.121 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -132.76 -173.02 3.06 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.443 -0.577 . . . . 4.2 109.443 176.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -66.61 87.76 0.13 Allowed 'General case' 0 C--O 1.234 0.278 0 CA-C-O 120.81 0.338 . . . . 4.33 110.971 178.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -78.29 -47.44 17.84 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.268 -0.424 . . . . 4.37 110.197 178.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -135.51 108.83 7.8 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.128 -0.487 . . . . 5.36 110.534 179.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -134.61 83.71 2.05 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.216 -0.661 . . . . 3.85 109.216 179.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 87.5 mtp -123.38 -47.23 2.0 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.17 -0.468 . . . . 4.76 110.989 179.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -82.49 -14.71 75.53 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.807 -0.711 . . . . 3.71 112.179 -178.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 172.5 163.09 25.76 Favored Glycine 0 N--CA 1.443 -0.835 0 N-CA-C 111.478 -0.649 . . . . 2.09 111.478 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -58.31 155.12 36.85 Favored 'Trans proline' 0 C--O 1.232 0.217 0 C-N-CA 123.186 2.591 . . . . 1.35 112.213 178.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 77.9 p -93.03 139.28 30.7 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-O 121.045 0.45 . . . . 1.2 110.41 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 41.3 t -117.9 121.87 68.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 116.104 -0.498 . . . . 1.22 109.671 177.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.401 ' HB2' ' HG2' ' A' ' 49' ' ' GLU . 45.4 tp -68.51 97.52 0.78 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.189 0.518 . . . . 1.53 110.02 177.249 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.537 HG13 ' CE1' ' A' ' 25' ' ' PHE . 57.7 t -75.68 120.33 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.996 0 CA-C-N 115.43 -0.804 . . . . 1.03 109.798 178.503 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 66.7 mttt -104.13 -22.39 13.42 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.789 -0.641 . . . . 1.7 109.362 179.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -169.34 160.09 9.19 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.56 -0.745 . . . . 2.48 110.623 178.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.537 ' CE1' HG13 ' A' ' 22' ' ' VAL . 21.4 m-85 -111.31 148.06 33.75 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.742 -0.663 . . . . 0.35 109.231 176.034 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 60.4 tp60 -129.74 134.59 47.7 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 109.541 -0.54 . . . . 1.64 109.541 174.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.412 ' HG ' HD23 ' A' ' 38' ' ' LEU . 3.4 mm? -103.62 135.09 45.85 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 121.052 0.453 . . . . 1.03 109.995 -178.527 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.526 ' O ' ' HA ' ' A' ' 91' ' ' GLU . 45.2 m -129.35 120.49 25.67 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.902 -0.59 . . . . 1.57 110.255 177.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 111.86 -11.04 27.47 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.927 -0.654 . . . . 0.27 112.038 -179.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 17.7 p-10 -84.67 139.65 31.88 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.137 0.494 . . . . 0.58 110.802 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.9 tpp180 -136.67 -32.82 0.81 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.389 -0.823 . . . . 3.08 109.898 177.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -66.48 -40.14 89.16 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.985 -0.552 . . . . 2.59 111.307 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.421 ' CZ ' ' HG3' ' A' ' 69' ' ' LYS . 82.4 m-85 -126.34 137.39 53.46 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 110.104 -0.332 . . . . 0.29 110.104 179.197 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -72.91 168.1 19.64 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.972 -0.558 . . . . 0.62 110.923 -178.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.633 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 58.1 m-20 -53.61 -55.87 22.09 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 123.402 0.439 . . . . 0.59 111.326 -175.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 61.0 ttp180 -57.73 -37.48 73.64 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.354 -0.384 . . . . 4.12 111.581 -175.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 17.1 tpt180 -59.35 -36.0 74.91 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.107 0.479 . . . . 3.02 110.452 177.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.436 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -87.14 -24.51 24.49 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.952 -0.567 . . . . 1.03 110.929 179.57 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.633 ' HG ' ' O ' ' A' ' 35' ' ' ASP . 83.4 mt -66.07 -34.59 78.41 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.6 -0.273 . . . . 2.38 111.187 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.8 -23.46 63.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.172 -0.467 . . . . 1.11 111.311 178.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.45 HD11 ' HA ' ' A' ' 62' ' ' ILE . 5.7 mt -68.22 -29.6 68.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.026 0.441 . . . . 0.99 110.581 176.026 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.491 HD22 HD13 ' A' ' 62' ' ' ILE . 0.4 OUTLIER -107.34 13.14 27.38 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.076 -0.511 . . . . 1.07 110.347 -177.629 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 5.3 p80 -50.43 -26.32 4.91 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 113.047 0.758 . . . . 0.66 113.047 -173.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -97.94 0.99 47.51 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.216 0.45 . . . . 0.6 112.216 -173.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.466 ' O ' HD22 ' A' ' 50' ' ' LEU . 79.6 mt -93.51 -56.28 0.23 Allowed Pre-proline 0 C--N 1.324 -0.538 0 N-CA-C 113.731 1.012 . . . . 1.53 113.731 -173.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.445 ' HB3' HG12 ' A' ' 22' ' ' VAL . 87.5 Cg_endo -74.54 154.8 45.11 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 121.35 1.367 . . . . 0.33 112.587 -167.291 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 103.38 -8.68 52.74 Favored Glycine 0 N--CA 1.447 -0.583 0 N-CA-C 109.95 -1.26 . . . . 0.31 109.95 -169.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.459 ' HA ' HG11 ' A' ' 9' ' ' VAL . 27.7 mt-30 -122.87 167.5 13.46 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 114.637 -0.782 . . . . 2.2 109.458 176.174 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.401 ' HG2' ' HB2' ' A' ' 21' ' ' LEU . 39.4 mt-10 -98.86 89.75 4.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.532 0.682 . . . . 1.12 109.502 176.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.466 HD22 ' O ' ' A' ' 45' ' ' LEU . 1.9 mm? -79.52 135.69 36.7 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.739 -1.119 . . . . 1.08 109.946 -177.666 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -81.51 161.48 23.59 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.215 -0.661 . . . . 1.77 109.215 175.2 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -46.67 -40.49 13.26 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 113.137 0.791 . . . . 1.6 113.137 -173.061 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.7 m -58.1 -38.06 75.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.931 0.396 . . . . 1.26 111.044 -178.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -72.49 -38.34 68.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.072 -0.513 . . . . 1.74 110.827 178.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.423 ' HB3' HD13 ' A' ' 78' ' ' LEU . 9.8 mp -60.56 -44.64 95.93 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.261 -0.427 . . . . 1.81 111.421 176.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 77.9 m-70 -68.35 -31.79 71.42 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.893 -0.323 . . . . 3.73 110.73 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.13 -28.89 69.74 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.23 0.538 . . . . 1.07 110.453 177.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.81 -39.58 94.72 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.519 -0.764 . . . . 1.03 111.06 177.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.22 -34.72 78.66 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.858 -0.61 . . . . 1.0 111.231 -178.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.88 -35.87 82.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 1.08 110.947 -179.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 -58.82 -38.77 79.38 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.879 -0.6 . . . . 0.42 110.446 178.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.491 HD13 HD22 ' A' ' 42' ' ' LEU . 66.2 mt -79.52 -37.77 18.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.285 -0.871 . . . . 1.1 110.871 -175.094 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -61.5 -44.65 97.72 Favored Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 120.389 -0.91 . . . . 0.22 111.65 177.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -73.96 -24.23 59.61 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.619 0.247 . . . . 2.17 110.874 178.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.459 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 91.3 t80 -59.78 -48.8 80.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.121 0.486 . . . . 0.25 109.862 174.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . 0.422 ' HB3' ' HB2' ' A' ' 71' ' ' TYR . 10.0 m-85 -59.82 -46.03 90.53 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.463 -0.79 . . . . 0.66 111.173 177.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 17.6 mt-30 -59.83 -38.61 82.54 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.464 -0.334 . . . . 1.96 111.083 -179.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -61.91 -35.58 78.8 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.554 -0.535 . . . . 1.69 109.554 178.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.459 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 69.6 mmtt -82.58 2.6 32.39 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.837 -0.619 . . . . 1.23 111.113 -179.314 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 106.51 -7.78 39.91 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 121.047 -0.597 . . . . 0.34 112.936 175.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . 0.422 ' HB2' ' HB3' ' A' ' 66' ' ' TYR . 70.5 m-85 -89.26 73.68 8.01 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.153 0.502 . . . . 0.8 109.805 -179.702 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 43.8 t -69.04 -29.02 41.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.779 -0.646 . . . . 1.13 111.204 -175.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 67.3 mt -91.38 22.68 3.78 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.026 0.441 . . . . 2.34 111.042 177.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -121.22 120.29 34.77 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.068 -0.515 . . . . 1.08 110.547 178.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 19.5 mmm180 -128.95 170.82 12.97 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.073 -0.512 . . . . 2.16 109.739 177.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -133.18 132.75 41.93 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 109.707 -0.479 . . . . 0.99 109.707 178.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 51.0 p90 -129.3 143.39 50.83 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.847 0.356 . . . . 0.43 110.171 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.451 HD21 ' N ' ' A' ' 80' ' ' ALA . 6.6 tt -93.7 107.43 27.17 Favored Pre-proline 0 C--N 1.319 -0.732 0 N-CA-C 108.948 -0.76 . . . . 1.15 108.948 178.841 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -55.8 -34.7 91.97 Favored 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 123.534 2.823 . . . . 1.12 112.881 -175.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.451 ' N ' HD21 ' A' ' 78' ' ' LEU . . . 63.75 -96.23 0.05 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.259 -0.882 . . . . 2.0 111.215 178.364 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 67.58 -64.84 0.26 Allowed 'General case' 0 N--CA 1.467 0.376 0 O-C-N 123.889 0.743 . . . . 4.28 110.724 -177.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.429 ' O ' ' HB ' ' A' ' 83' ' ' ILE . 34.0 tt0 -139.95 -49.19 0.47 Allowed 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.536 -0.542 . . . . 3.76 109.536 177.865 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.429 ' HB ' ' O ' ' A' ' 82' ' ' GLU . 39.4 mt 75.07 142.16 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 CA-C-N 115.714 -0.675 . . . . 1.82 111.485 179.397 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -87.64 157.28 19.14 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.393 -0.821 . . . . 1.71 110.593 -176.045 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -76.82 85.54 3.41 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.141 0.496 . . . . 1.54 110.417 177.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 128.61 -58.71 0.7 Allowed Glycine 0 N--CA 1.443 -0.838 0 C-N-CA 120.661 -0.781 . . . . 0.72 112.352 177.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 19.6 m -91.91 120.66 32.79 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 120.925 0.393 . . . . 1.12 110.627 179.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 31.0 m -108.53 132.52 56.19 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 N-CA-C 109.258 -0.645 . . . . 1.1 109.258 175.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . 0.485 ' HD3' ' OG ' ' A' ' 28' ' ' SER . 27.2 ttm180 -109.32 128.79 55.37 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 121.13 0.49 . . . . 3.51 110.9 -176.233 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 59.5 mt -113.45 135.06 54.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.399 -0.819 . . . . 0.99 109.696 178.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.526 ' HA ' ' O ' ' A' ' 28' ' ' SER . 45.8 mt-10 -94.91 122.46 37.56 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.227 0.537 . . . . 1.33 110.318 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 60.0 t -98.35 123.75 51.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 115.493 -0.776 . . . . 1.04 110.103 -178.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 47.6 tp -108.97 94.8 5.24 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 109.315 -0.624 . . . . 1.2 109.315 178.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -77.4 2.56 15.64 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.628 -0.715 . . . . 0.49 111.035 -174.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.782 0 CA-C-O 118.818 -0.99 . . . . 1.39 112.08 177.212 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 83.5 mtp . . . . . 0 N--CA 1.478 0.947 0 N-CA-C 110.262 -0.273 . . . . 15.98 110.262 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -68.03 109.3 3.42 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.27 -0.423 . . . . 13.23 110.584 -178.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 57.8 m80 -88.66 31.98 0.81 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.146 -0.479 . . . . 13.93 111.194 -176.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 7.3 p80 -148.97 115.99 6.04 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.207 0.527 . . . . 11.29 110.024 177.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 62.2 m80 -86.33 -14.75 42.66 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.248 0.547 . . . . 9.64 109.767 177.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 21.3 m-70 -86.22 123.89 32.0 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.525 -0.761 . . . . 10.58 109.669 175.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 79.4 m80 -100.75 -1.67 34.41 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.245 -0.434 . . . . 8.21 110.491 -179.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 31.2 m170 -105.9 40.8 1.5 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.07 -0.514 . . . . 7.27 110.11 177.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 47' ' ' GLY . 60.2 t -65.83 121.62 15.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.113 0.483 . . . . 2.46 110.145 178.523 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.475 ' H ' ' HG2' ' A' ' 48' ' ' GLN . 53.3 m-20 -109.24 148.03 31.63 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.622 -0.717 . . . . 4.2 110.823 -175.457 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -80.57 -15.88 55.56 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 108.688 -0.856 . . . . 4.33 108.688 172.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 17.6 t70 66.57 -79.55 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 114.455 -1.248 . . . . 4.37 111.237 176.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -169.69 90.75 0.2 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.95 0.405 . . . . 5.36 110.095 178.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 4.7 tmmm? -75.07 82.79 2.28 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.943 -0.572 . . . . 3.85 110.218 -179.031 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 87.9 mmm -136.63 136.05 38.83 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.733 -0.667 . . . . 4.76 109.609 175.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 85.19 -2.64 88.1 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.716 -0.754 . . . . 3.71 111.91 -176.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 160.67 145.51 4.31 Favored Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 121.23 -0.51 . . . . 2.09 112.246 178.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -54.01 157.03 11.46 Favored 'Trans proline' 0 C--O 1.235 0.343 0 C-N-CA 123.83 3.02 . . . . 1.35 113.21 175.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.472 ' HA ' ' HA ' ' A' ' 51' ' ' ASN . 25.1 p -98.47 140.15 33.15 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.707 -0.679 . . . . 1.2 111.529 -177.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 50.0 t -117.27 121.48 67.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.806 -0.633 . . . . 1.22 109.787 177.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.479 ' HA ' ' HA ' ' A' ' 49' ' ' GLU . 55.3 tp -65.66 115.76 6.17 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.021 0.439 . . . . 1.53 110.247 177.729 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.457 HG11 ' CE1' ' A' ' 25' ' ' PHE . 48.5 t -95.54 121.67 46.3 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 CA-C-N 115.842 -0.617 . . . . 1.03 110.353 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 80.2 mttt -107.35 -27.22 10.61 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.589 -0.732 . . . . 1.7 109.704 177.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.8 ptp180 -161.74 161.71 29.39 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.837 -0.619 . . . . 2.48 110.876 177.303 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.509 ' CE2' ' HG ' ' A' ' 42' ' ' LEU . 29.2 m-85 -110.72 137.04 48.9 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.715 -0.675 . . . . 0.35 109.799 176.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 19.2 tp60 -119.12 129.45 55.05 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.409 -0.589 . . . . 1.64 109.409 177.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.459 HD13 ' HB ' ' A' ' 90' ' ' ILE . 3.8 mm? -103.02 132.68 49.11 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.259 0.552 . . . . 1.03 110.113 -179.63 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 48.1 t -121.71 122.16 38.92 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.495 -0.775 . . . . 1.57 109.667 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 103.79 -16.11 51.53 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.625 -0.798 . . . . 0.27 112.331 179.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 20.7 p-10 -69.18 126.53 30.08 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.051 0.453 . . . . 0.58 110.367 179.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.566 ' NE ' ' HA ' ' A' ' 31' ' ' ARG . 1.9 mmp_? -125.97 -34.64 2.55 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.266 -0.425 . . . . 3.08 110.678 179.435 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.423 ' HG2' ' CZ ' ' A' ' 71' ' ' TYR . 57.5 tp60 -75.17 -38.29 60.94 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.258 -0.428 . . . . 2.59 110.598 -179.697 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -123.44 146.91 47.65 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.605 -0.517 . . . . 0.29 109.605 178.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -92.41 169.71 10.35 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.27 -0.423 . . . . 0.62 111.233 -176.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.526 ' O ' HD13 ' A' ' 39' ' ' LEU . 4.1 m-20 -56.07 -52.87 62.74 Favored 'General case' 0 CA--C 1.517 -0.323 0 O-C-N 123.258 0.349 . . . . 0.59 110.616 -177.579 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 61.9 ttp180 -52.79 -39.61 62.46 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.307 -0.406 . . . . 4.12 111.1 -177.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 15.4 tpt180 -63.75 -50.09 70.45 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.925 -0.58 . . . . 3.02 111.094 178.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.44 HD22 ' HG ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -73.56 -26.79 61.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.844 0.354 . . . . 1.03 111.261 -176.736 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.526 HD13 ' O ' ' A' ' 35' ' ' ASP . 2.3 mp -60.14 -32.93 71.48 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.154 -0.475 . . . . 2.38 111.781 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.54 -25.58 66.25 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.146 -0.479 . . . . 1.11 111.452 179.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.415 HD12 ' HA ' ' A' ' 38' ' ' LEU . 1.7 mt -70.12 -27.49 64.62 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.888 0.375 . . . . 0.99 110.431 176.826 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.509 ' HG ' ' CE2' ' A' ' 25' ' ' PHE . 0.4 OUTLIER -107.55 13.32 26.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.94 -0.573 . . . . 1.07 110.447 -177.184 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 6.5 p80 -51.92 -24.77 6.85 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.798 -0.637 . . . . 0.66 112.554 -173.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -101.02 3.38 41.43 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.369 0.507 . . . . 0.6 112.369 -172.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 86.9 mt -95.53 -54.87 0.22 Allowed Pre-proline 0 C--N 1.323 -0.556 0 N-CA-C 113.932 1.086 . . . . 1.53 113.932 -172.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.446 ' HB3' HG13 ' A' ' 22' ' ' VAL . 75.3 Cg_endo -73.41 161.38 42.69 Favored 'Trans proline' 0 C--N 1.351 0.697 0 C-N-CA 121.318 1.345 . . . . 0.33 112.678 -168.205 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.452 ' O ' HG23 ' A' ' 9' ' ' VAL . . . 100.87 3.98 54.63 Favored Glycine 0 N--CA 1.449 -0.477 0 N-CA-C 110.594 -1.002 . . . . 0.31 110.594 -170.275 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.475 ' HG2' ' H ' ' A' ' 10' ' ' ASP . 78.2 mt-30 -143.07 170.23 16.11 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.858 -0.671 . . . . 2.2 109.282 177.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.479 ' HA ' ' HA ' ' A' ' 21' ' ' LEU . 35.9 mt-10 -98.46 96.04 7.73 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.384 0.611 . . . . 1.12 109.679 178.235 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.407 ' HA ' ' OE1' ' A' ' 54' ' ' GLN . 2.7 mm? -83.72 140.77 31.91 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.068 -0.969 . . . . 1.08 109.604 -178.216 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.472 ' HA ' ' HA ' ' A' ' 19' ' ' THR . 9.6 p30 -88.87 161.55 16.63 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.484 -0.561 . . . . 1.77 109.484 178.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -45.08 -43.4 9.52 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.462 0.912 . . . . 1.6 113.462 -172.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.648 ' HA ' ' NE2' ' A' ' 56' ' ' HIS . 50.0 m -58.61 -37.12 75.17 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.929 0.395 . . . . 1.26 110.971 179.562 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.407 ' OE1' ' HA ' ' A' ' 50' ' ' LEU . 99.5 mt-30 -72.2 -38.67 69.0 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.656 -0.702 . . . . 1.74 110.56 179.043 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.496 ' HB3' HD11 ' A' ' 78' ' ' LEU . 9.4 mp -58.87 -54.78 43.23 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 112.62 0.6 . . . . 1.81 112.62 179.206 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.648 ' NE2' ' HA ' ' A' ' 53' ' ' SER . 32.7 p80 -72.76 -23.48 60.83 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.014 -0.674 . . . . 3.73 111.294 -177.579 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.07 -32.94 73.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.288 0.565 . . . . 1.07 109.976 173.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.63 -37.79 88.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.392 -0.822 . . . . 1.03 110.638 175.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.07 -34.03 77.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.733 -0.667 . . . . 1.0 110.686 179.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.58 -35.0 78.12 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.929 -0.578 . . . . 1.08 111.013 178.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 88.6 mtt180 -59.06 -42.38 90.18 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.24 0.543 . . . . 0.42 109.976 177.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.488 HD11 HD21 ' A' ' 42' ' ' LEU . 80.9 mt -77.6 -37.39 24.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.398 -0.819 . . . . 1.1 110.3 -177.349 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.606 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -57.55 -46.48 91.99 Favored Glycine 0 N--CA 1.442 -0.909 0 CA-C-N 115.447 -0.797 . . . . 0.22 111.583 176.168 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -68.97 -33.51 73.8 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.61 0.243 . . . . 2.17 110.395 177.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.573 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 76.8 t80 -54.68 -49.38 70.79 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.016 -0.538 . . . . 0.25 110.508 177.577 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -62.12 -47.16 85.85 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.004 -0.544 . . . . 0.66 111.159 178.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . 0.606 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 14.3 mt-30 -57.48 -41.72 81.2 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.359 0.599 . . . . 1.96 110.45 179.49 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -58.37 -38.55 77.48 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.135 -0.939 . . . . 1.69 110.798 178.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.573 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 68.9 mmtt -82.33 2.88 30.1 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.937 -0.574 . . . . 1.23 111.058 -177.302 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.31 -14.6 30.57 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 121.017 -0.611 . . . . 0.34 112.683 176.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . 0.423 ' CZ ' ' HG2' ' A' ' 32' ' ' GLN . 60.7 m-85 -83.33 69.49 9.99 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.182 0.515 . . . . 0.8 110.239 -177.37 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 41.1 t -69.89 -23.95 26.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.776 -0.647 . . . . 1.13 110.841 -177.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 95.0 mt -83.04 -3.2 57.0 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 2.34 110.811 178.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -101.08 144.12 30.37 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.914 -0.585 . . . . 1.08 110.867 -178.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 20.7 tpt180 -154.33 137.33 15.49 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.015 -0.539 . . . . 2.16 110.033 178.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -102.41 135.49 43.94 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.271 -0.422 . . . . 0.99 110.141 177.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 48.7 p90 -135.6 151.06 49.9 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.722 -0.473 . . . . 0.43 109.722 179.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.496 HD11 ' HB3' ' A' ' 55' ' ' LEU . 6.7 tt -107.54 109.47 62.53 Favored Pre-proline 0 C--N 1.32 -0.704 0 N-CA-C 109.5 -0.556 . . . . 1.15 109.5 -179.487 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.69 116.78 4.85 Favored 'Trans proline' 0 N--CA 1.46 -0.469 0 C-N-CA 122.609 2.206 . . . . 1.12 112.06 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.76 54.85 2.82 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.269 0.557 . . . . 2.0 110.217 178.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -93.65 -49.98 5.61 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.563 -0.744 . . . . 4.28 111.0 -175.072 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -132.25 -70.06 0.57 Allowed 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.449 -0.574 . . . . 3.76 109.449 -177.044 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 38.6 mt 58.2 80.09 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.367 0 CA-C-N 115.593 -0.73 . . . . 1.82 111.127 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . 0.469 ' H ' ' NE2' ' A' ' 84' ' ' GLN . 0.5 OUTLIER -57.28 130.03 44.41 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.414 -0.812 . . . . 1.71 110.159 174.754 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -52.56 122.53 9.11 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.303 0.573 . . . . 1.54 110.786 -177.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 109.91 -41.89 2.11 Favored Glycine 0 N--CA 1.444 -0.816 0 C-N-CA 120.843 -0.694 . . . . 0.72 112.469 -178.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 20.4 m -117.81 120.77 38.92 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 120.866 0.365 . . . . 1.12 110.802 -177.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 34.3 m -103.1 137.02 32.93 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 109.638 -0.504 . . . . 1.1 109.638 176.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 30.4 ttm180 -113.58 117.6 32.07 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.122 0.486 . . . . 3.51 110.778 -177.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.459 ' HB ' HD13 ' A' ' 27' ' ' LEU . 70.0 mt -103.83 129.73 55.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.465 -0.789 . . . . 0.99 109.605 177.609 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -94.7 123.61 38.24 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.147 0.499 . . . . 1.33 110.266 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 40.6 t -101.8 108.28 23.38 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 115.552 -0.749 . . . . 1.04 110.256 -178.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 62.0 tp -90.11 96.57 10.73 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.236 -0.653 . . . . 1.2 109.236 175.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.443 ' OE1' ' HB2' ' A' ' 31' ' ' ARG . 43.6 mt-10 -76.68 -31.13 57.06 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.016 0.436 . . . . 0.49 110.461 -177.219 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.869 0 CA-C-O 118.244 -1.309 . . . . 1.39 111.562 178.246 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.8 ptp . . . . . 0 N--CA 1.483 1.222 0 CA-C-O 120.457 0.17 . . . . 15.98 111.194 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.23 -35.1 73.63 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.017 0.437 . . . . 13.23 110.293 179.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 9.8 t-80 -82.23 86.45 6.65 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.791 -0.64 . . . . 13.93 109.357 177.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 50.6 m80 -70.33 120.66 16.33 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.38 -0.827 . . . . 11.29 111.499 -173.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 28.8 p-80 -94.09 98.17 10.81 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.588 0.708 . . . . 9.64 110.508 177.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 43.1 t-80 -86.21 -28.68 23.72 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.61 -0.723 . . . . 10.58 110.243 -179.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -143.2 81.24 1.71 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.347 0.594 . . . . 8.21 111.07 -178.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 28.7 t-80 -73.67 89.78 1.78 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.863 -0.608 . . . . 7.27 109.874 176.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 60.4 t -75.68 87.57 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-O 121.396 0.617 . . . . 2.46 110.399 179.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -68.86 125.34 26.29 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.187 -0.915 . . . . 4.2 109.529 177.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -54.09 120.37 6.34 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.491 0.662 . . . . 4.33 111.507 -175.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -107.25 -2.33 20.89 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.36 -0.836 . . . . 4.37 110.938 -178.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -137.79 137.7 38.48 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.219 -0.446 . . . . 5.36 110.631 -177.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.444 ' HD2' ' O ' ' A' ' 14' ' ' LYS . 1.1 tmmm? -148.5 48.36 1.03 Allowed 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 107.914 -1.143 . . . . 3.85 107.914 170.038 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 87.0 mtp -105.79 -26.03 11.93 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.359 -0.837 . . . . 4.76 109.844 178.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . 0.447 ' O ' ' HB2' ' A' ' 52' ' ' LEU . . . -108.81 47.35 1.05 Allowed Glycine 0 N--CA 1.444 -0.831 0 CA-C-N 115.544 -0.753 . . . . 3.71 111.383 176.69 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 89.09 161.93 37.99 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 121.041 -0.599 . . . . 2.09 112.241 -179.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -63.46 132.43 35.72 Favored 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 122.57 2.18 . . . . 1.35 111.709 176.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.531 ' HB ' ' HB3' ' A' ' 49' ' ' GLU . 29.6 p -73.01 145.5 46.62 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.401 0.619 . . . . 1.2 112.229 -175.239 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.426 HG13 ' HA ' ' A' ' 85' ' ' ASP . 38.3 t -113.89 123.22 69.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 115.114 -0.948 . . . . 1.22 109.61 175.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.431 ' O ' ' HA2' ' A' ' 86' ' ' GLY . 42.8 tp -71.99 90.66 1.17 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.233 0.539 . . . . 1.53 110.194 176.417 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.493 HG12 ' CE1' ' A' ' 25' ' ' PHE . 56.7 t -72.85 129.33 35.99 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 CA-C-N 115.27 -0.877 . . . . 1.03 110.77 -177.314 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 54.5 mttp -112.48 -25.15 9.32 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.654 -0.703 . . . . 1.7 109.586 177.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 13.1 ptp180 -163.22 157.43 20.36 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.791 -0.64 . . . . 2.48 110.811 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.499 ' CE2' ' HG ' ' A' ' 42' ' ' LEU . 22.4 m-85 -111.27 149.03 31.63 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.664 -0.698 . . . . 0.35 109.915 177.561 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 59.6 tp60 -130.27 135.38 48.05 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 109.454 -0.573 . . . . 1.64 109.454 176.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -103.73 143.43 32.8 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.004 0.431 . . . . 1.03 110.058 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 28.5 t -128.83 133.88 48.14 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.95 -0.568 . . . . 1.57 109.996 -179.607 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 84.74 -3.77 86.17 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.714 -0.755 . . . . 0.27 112.575 178.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 20.6 p-10 -76.06 130.36 38.23 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.964 0.411 . . . . 0.58 110.954 179.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.465 ' NE ' ' HA ' ' A' ' 31' ' ' ARG . 4.7 tpm_? -137.15 -33.42 0.75 Allowed 'General case' 0 C--N 1.321 -0.63 0 CA-C-N 116.291 -0.413 . . . . 3.08 110.639 178.419 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -68.14 -36.8 80.27 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.207 -0.452 . . . . 2.59 110.396 177.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.438 ' CZ ' ' HG3' ' A' ' 69' ' ' LYS . 86.7 m-85 -129.48 137.41 50.82 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.084 -0.507 . . . . 0.29 109.993 176.371 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.597 ' OD1' ' HB3' ' A' ' 36' ' ' ARG . 4.1 p30 -74.61 164.26 26.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.122 -0.49 . . . . 0.62 110.839 -179.414 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.663 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 3.8 m-20 -50.46 -55.24 16.79 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 123.393 0.433 . . . . 0.59 110.804 -177.553 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.597 ' HB3' ' OD1' ' A' ' 34' ' ' ASP . 6.0 ttp180 -46.25 -48.17 17.95 Favored 'General case' 0 C--N 1.33 -0.278 0 O-C-N 123.814 0.696 . . . . 4.12 111.999 178.385 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -59.04 -35.46 73.35 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.964 -0.562 . . . . 3.02 110.96 -178.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.475 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -87.22 -26.23 23.62 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.21 -0.45 . . . . 1.03 111.085 -179.913 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.663 ' HG ' ' O ' ' A' ' 35' ' ' ASP . 92.9 mt -62.98 -34.39 77.41 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.763 0.316 . . . . 2.38 111.204 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.29 -23.46 65.71 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.027 -0.533 . . . . 1.11 111.305 178.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.475 HD12 ' HA ' ' A' ' 38' ' ' LEU . 5.2 mt -70.0 -26.98 64.33 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.864 0.364 . . . . 0.99 110.659 177.366 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.499 ' HG ' ' CE2' ' A' ' 25' ' ' PHE . 0.4 OUTLIER -109.08 12.9 24.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.237 -0.438 . . . . 1.07 110.39 -178.026 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -51.39 -26.55 8.04 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.768 0.655 . . . . 0.66 112.768 -174.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -104.84 11.82 33.3 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.137 0.421 . . . . 0.6 112.137 -173.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 81.5 mt -99.56 -54.54 0.17 Allowed Pre-proline 0 C--N 1.324 -0.501 0 N-CA-C 113.723 1.008 . . . . 1.53 113.723 -176.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.416 ' HB3' HG11 ' A' ' 22' ' ' VAL . 72.5 Cg_endo -73.37 165.75 31.71 Favored 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 121.324 1.349 . . . . 0.33 112.845 -168.441 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 97.74 -12.42 64.38 Favored Glycine 0 N--CA 1.446 -0.682 0 N-CA-C 110.371 -1.092 . . . . 0.31 110.371 -171.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 53.3 mt-30 -117.11 175.06 5.77 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.66 -0.77 . . . . 2.2 109.559 176.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.531 ' HB3' ' HB ' ' A' ' 19' ' ' THR . 17.9 mt-10 -99.5 101.18 12.34 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 121.283 0.563 . . . . 1.12 109.816 174.358 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.51 131.97 35.28 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.189 -0.914 . . . . 1.08 110.097 -176.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.627 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 33.4 p30 -80.84 170.52 16.18 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 121.124 -0.23 . . . . 1.77 110.452 178.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.46 ' HA ' HD11 ' A' ' 55' ' ' LEU . 4.4 mm? -50.73 -43.38 58.06 Favored 'General case' 0 N--CA 1.465 0.298 0 O-C-N 123.141 0.275 . . . . 1.6 111.235 -177.535 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.475 ' HA ' ' NE2' ' A' ' 56' ' ' HIS . 14.9 m -54.39 -55.71 25.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.021 -0.536 . . . . 1.26 110.619 178.375 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -62.62 -34.24 76.64 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.831 -0.622 . . . . 1.74 111.223 -179.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.627 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 89.8 mt -59.65 -57.0 14.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 1.81 111.167 179.566 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.475 ' NE2' ' HA ' ' A' ' 53' ' ' SER . 34.5 p80 -74.0 -23.86 59.5 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.314 -0.554 . . . . 3.73 110.867 -178.407 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.1 -30.95 72.0 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.98 0.419 . . . . 1.07 110.491 174.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.61 -38.94 86.35 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.885 -0.598 . . . . 1.03 110.335 174.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.56 -32.93 74.03 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.622 -0.717 . . . . 1.0 110.841 179.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.91 -32.16 73.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.965 -0.562 . . . . 1.08 110.897 178.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 74.8 mtt180 -62.68 -39.51 94.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.915 -0.584 . . . . 0.42 110.175 176.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.49 HD11 HD21 ' A' ' 42' ' ' LEU . 68.7 mt -79.8 -37.29 18.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.453 -0.794 . . . . 1.1 110.99 -175.338 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.568 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -59.66 -47.88 88.75 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.615 -0.803 . . . . 0.22 111.556 177.39 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.419 ' O ' ' HG3' ' A' ' 68' ' ' GLU . 28.5 t70 -68.86 -31.62 70.69 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.731 0.301 . . . . 2.17 110.57 178.556 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.445 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 90.7 t80 -57.54 -51.37 69.75 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.092 -0.504 . . . . 0.25 110.267 176.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . 0.408 ' HB3' ' HB2' ' A' ' 71' ' ' TYR . 4.3 m-85 -57.65 -42.54 83.65 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.537 -0.756 . . . . 0.66 110.749 177.162 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . 0.568 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 91.0 mt-30 -62.07 -35.32 78.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 1.96 111.347 -178.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.419 ' HG3' ' O ' ' A' ' 64' ' ' ASP . 43.6 mt-10 -71.19 -23.31 62.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.873 0.368 . . . . 1.69 110.837 179.309 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.445 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 74.5 mmtt -91.41 1.88 56.8 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.061 -0.518 . . . . 1.23 110.676 -179.583 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.25 -14.17 28.26 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.734 -0.745 . . . . 0.34 112.86 176.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . 0.408 ' HB2' ' HB3' ' A' ' 66' ' ' TYR . 55.0 m-85 -87.06 67.66 9.8 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.243 0.544 . . . . 0.8 109.852 -178.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 22.0 t -68.93 -23.43 27.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.735 -0.666 . . . . 1.13 110.889 -175.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 97.8 mt -86.09 -8.54 57.82 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.04 -0.527 . . . . 2.34 111.111 179.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -82.98 140.45 32.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.17 -0.468 . . . . 1.08 110.574 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 5.0 tpp180 -144.54 131.71 20.59 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.166 -0.47 . . . . 2.16 109.884 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -102.51 136.28 42.62 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.97 -0.381 . . . . 0.99 109.97 177.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 52.8 p90 -137.75 151.54 48.27 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.869 -0.419 . . . . 0.43 109.869 179.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.405 ' HA ' ' HD2' ' A' ' 79' ' ' PRO . 7.1 tt -105.89 113.04 64.2 Favored Pre-proline 0 C--N 1.32 -0.681 0 N-CA-C 109.908 -0.404 . . . . 1.15 109.908 -178.509 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.461 ' HD2' ' O ' ' A' ' 89' ' ' ARG . 35.3 Cg_endo -64.94 100.54 0.36 Allowed 'Trans proline' 0 C--O 1.234 0.317 0 C-N-CA 122.748 2.299 . . . . 1.12 111.459 176.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -95.27 33.68 1.53 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.944 -0.571 . . . . 2.0 111.654 -173.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 54.8 tp60 -76.79 -52.78 8.91 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.502 -0.555 . . . . 4.28 109.502 177.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -137.5 120.11 16.11 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.853 -0.612 . . . . 3.76 109.73 175.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 45.5 mt -125.85 111.77 28.14 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-N 116.316 -0.402 . . . . 1.82 110.714 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . 0.443 ' CD ' ' H ' ' A' ' 84' ' ' GLN . 1.9 pm0 -64.51 145.5 56.02 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.598 -0.728 . . . . 1.71 109.938 174.034 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.426 ' HA ' HG13 ' A' ' 20' ' ' VAL . 9.8 p-10 -75.53 74.85 2.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.777 0.799 . . . . 1.54 111.553 -175.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . 0.431 ' HA2' ' O ' ' A' ' 21' ' ' LEU . . . 162.92 -57.42 0.29 Allowed Glycine 0 N--CA 1.444 -0.831 0 CA-C-N 115.699 -0.682 . . . . 0.72 111.572 176.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 24.3 m -96.33 120.87 37.42 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-O 120.84 0.352 . . . . 1.12 110.676 177.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 35.0 m -111.4 134.94 52.16 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 N-CA-C 109.201 -0.666 . . . . 1.1 109.201 175.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . 0.461 ' O ' ' HD2' ' A' ' 79' ' ' PRO . 15.6 ttp180 -113.11 131.0 56.0 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 120.177 -0.609 . . . . 3.51 110.666 -177.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 72.4 mt -112.63 131.05 65.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 115.354 -0.839 . . . . 0.99 109.696 179.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -94.07 126.33 39.23 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.43 0.633 . . . . 1.33 109.986 179.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 66.0 t -100.76 101.45 12.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 CA-C-N 115.161 -0.927 . . . . 1.04 110.562 -176.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 63.1 tp -83.93 92.39 7.8 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.898 -0.779 . . . . 1.2 108.898 175.019 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 57.8 mt-10 -69.47 -17.33 63.61 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.217 -0.447 . . . . 0.49 111.017 -175.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.787 -1.007 . . . . 1.39 112.643 174.656 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.2 mtm . . . . . 0 N--CA 1.482 1.138 0 CA-C-O 120.688 0.28 . . . . 15.98 110.893 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -138.41 107.28 5.96 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.761 0.315 . . . . 13.23 110.306 -178.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 69.6 m80 -99.46 -14.58 19.04 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.271 -0.422 . . . . 13.93 110.923 -178.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 65.2 m80 -102.43 68.17 1.05 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.301 -0.408 . . . . 11.29 111.27 -175.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 39.5 m80 -88.17 -61.61 1.68 Allowed 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.705 -0.85 . . . . 9.64 108.705 172.353 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 15.2 m-70 -131.38 2.5 4.2 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.902 -0.59 . . . . 10.58 110.519 174.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 25.1 m170 -81.52 128.62 34.1 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.763 -0.458 . . . . 8.21 109.763 176.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . 0.415 ' O ' ' HB ' ' A' ' 9' ' ' VAL . 81.6 t60 63.91 93.12 0.06 Allowed 'General case' 0 C--N 1.332 -0.155 0 O-C-N 123.885 0.741 . . . . 7.27 109.814 -172.078 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.415 ' HB ' ' O ' ' A' ' 8' ' ' HIS . 87.1 t 72.77 116.46 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 115.774 -0.648 . . . . 2.46 111.576 -179.405 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -121.67 155.0 36.09 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.624 -0.717 . . . . 4.2 109.559 176.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -105.89 16.83 24.59 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.441 -0.345 . . . . 4.33 111.095 -177.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 62.58 21.98 13.02 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 115.836 -0.62 . . . . 4.37 111.653 -179.03 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 58.62 56.95 3.97 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 116.256 -0.429 . . . . 5.36 111.099 -179.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 56.39 74.6 0.39 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.467 0.651 . . . . 3.85 110.324 -178.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 52.9 ttm -118.94 128.3 54.28 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.76 -0.654 . . . . 4.76 109.882 178.085 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 77.95 36.95 30.67 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.548 -0.834 . . . . 3.71 111.369 -177.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 91.48 175.39 43.24 Favored Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 120.76 -0.733 . . . . 2.09 111.917 -176.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_endo -58.66 146.97 89.79 Favored 'Trans proline' 0 CA--C 1.53 0.287 0 C-N-CA 122.826 2.351 . . . . 1.35 112.165 176.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 14.7 p -111.83 142.16 44.56 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.303 -0.408 . . . . 1.2 111.402 -177.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 23.8 t -118.85 122.81 70.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.043 -0.526 . . . . 1.22 110.24 178.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 56.8 tp -71.44 106.07 3.8 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.385 0.612 . . . . 1.53 109.609 174.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.453 HG12 ' CE1' ' A' ' 25' ' ' PHE . 56.4 t -91.64 118.72 37.62 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 CA-C-N 115.435 -0.802 . . . . 1.03 109.973 179.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -98.08 -26.03 14.74 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 109.111 -0.7 . . . . 1.7 109.111 174.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 13.9 ptp180 -162.75 162.87 26.92 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.369 -0.832 . . . . 2.48 110.712 -178.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.466 ' CE2' ' HG ' ' A' ' 42' ' ' LEU . 29.6 m-85 -111.12 154.87 23.68 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.694 -0.685 . . . . 0.35 109.967 177.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.478 ' O ' ' HA ' ' A' ' 89' ' ' ARG . 8.1 tp-100 -137.3 140.1 41.33 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 109.065 -0.717 . . . . 1.64 109.065 177.497 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.458 HD12 HD13 ' A' ' 62' ' ' ILE . 3.8 mm? -108.36 152.16 25.02 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 120.935 0.397 . . . . 1.03 110.403 -179.215 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 23.1 t -132.9 125.83 30.77 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.127 -0.488 . . . . 1.57 110.254 177.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 90.86 -2.09 79.2 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.8 -0.714 . . . . 0.27 113.009 175.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 14.7 p-10 -74.04 123.05 23.64 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.183 0.516 . . . . 0.58 111.072 179.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 29.8 mmm180 -121.43 -33.57 3.62 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.828 -0.624 . . . . 3.08 110.514 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -70.92 -42.25 70.13 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.007 -0.542 . . . . 2.59 110.551 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 86.2 m-85 -128.68 137.08 51.43 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.033 -0.53 . . . . 0.29 109.749 179.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.64 ' OD2' ' HB3' ' A' ' 36' ' ' ARG . 4.6 p-10 -79.72 167.5 20.56 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.234 -0.439 . . . . 0.62 111.028 -177.636 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.469 ' O ' HD12 ' A' ' 39' ' ' LEU . 2.8 m-20 -54.22 -52.8 60.15 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 123.084 0.24 . . . . 0.59 110.959 -176.836 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.64 ' HB3' ' OD2' ' A' ' 34' ' ' ASP . 8.7 ttp180 -45.25 -45.51 11.95 Favored 'General case' 0 C--N 1.327 -0.394 0 O-C-N 123.763 0.664 . . . . 4.12 111.536 177.403 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 22.0 tpt85 -65.21 -42.88 93.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.803 -0.635 . . . . 3.02 111.476 -178.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.506 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -79.91 -24.9 40.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.723 0.297 . . . . 1.03 111.377 -177.545 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.469 HD12 ' O ' ' A' ' 35' ' ' ASP . 2.2 mp -62.15 -36.37 81.6 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.339 -0.392 . . . . 2.38 111.328 178.506 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.59 -26.26 66.83 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.062 -0.517 . . . . 1.11 111.051 178.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.506 ' HB2' ' O ' ' A' ' 38' ' ' LEU . 5.9 mt -64.88 -30.51 71.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.008 0.432 . . . . 0.99 110.98 176.165 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.494 HD21 HD12 ' A' ' 62' ' ' ILE . 0.4 OUTLIER -105.36 12.86 31.16 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.139 -0.482 . . . . 1.07 110.271 -177.713 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 7.1 p80 -47.3 -29.83 2.73 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.5 0.926 . . . . 0.66 113.5 -173.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -104.2 11.25 35.22 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.246 0.461 . . . . 0.6 112.246 -174.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 80.0 mt -97.08 -53.03 0.21 Allowed Pre-proline 0 C--N 1.323 -0.573 0 N-CA-C 113.591 0.96 . . . . 1.53 113.591 -176.353 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.415 ' HB3' HG11 ' A' ' 22' ' ' VAL . 77.6 Cg_endo -75.9 175.59 11.12 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 121.428 1.418 . . . . 0.33 113.023 -168.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 89.18 -6.78 83.26 Favored Glycine 0 N--CA 1.445 -0.712 0 N-CA-C 110.629 -0.989 . . . . 0.31 110.629 -172.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -124.75 175.48 7.21 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.979 -0.611 . . . . 2.2 109.72 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -100.59 96.36 7.31 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.402 0.62 . . . . 1.12 109.83 176.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.439 HD23 ' CG2' ' A' ' 22' ' ' VAL . 2.7 mm? -84.42 134.55 34.46 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.016 -0.993 . . . . 1.08 110.231 -174.5 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.577 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 8.5 p30 -85.03 171.37 12.13 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.727 -0.472 . . . . 1.77 109.727 177.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.456 ' HA ' HD11 ' A' ' 55' ' ' LEU . 4.0 mm? -48.8 -45.17 39.87 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.512 0.56 . . . . 1.6 112.512 -175.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.557 ' HA ' ' NE2' ' A' ' 56' ' ' HIS . 69.1 m -57.46 -46.0 84.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.622 0.249 . . . . 1.26 110.929 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.407 ' NE2' HD13 ' A' ' 50' ' ' LEU . 55.2 mt-30 -66.42 -32.64 74.14 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.982 0.42 . . . . 1.74 110.522 179.546 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.577 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 79.7 mt -62.67 -55.58 25.57 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.766 -0.652 . . . . 1.81 111.279 -178.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.557 ' NE2' ' HA ' ' A' ' 53' ' ' SER . 34.0 p80 -74.76 -23.42 58.53 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.324 -0.55 . . . . 3.73 111.184 -178.094 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.14 -31.97 70.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.184 0.516 . . . . 1.07 110.192 173.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.33 -45.57 92.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.624 -0.716 . . . . 1.03 110.477 175.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.48 -34.99 78.98 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.662 -0.699 . . . . 1.0 110.82 179.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.3 -42.51 99.42 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.872 -0.604 . . . . 1.08 110.93 178.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 77.2 mtt180 -54.19 -40.9 67.98 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 121.183 0.516 . . . . 0.42 110.642 177.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.494 HD12 HD21 ' A' ' 42' ' ' LEU . 67.4 mt -78.45 -37.5 21.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.53 -0.759 . . . . 1.1 110.579 -176.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.461 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -60.32 -42.11 98.68 Favored Glycine 0 N--CA 1.442 -0.913 0 CA-C-N 115.651 -0.704 . . . . 0.22 111.89 177.818 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -75.98 -26.48 56.82 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.54 0.209 . . . . 2.17 110.551 177.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -59.97 -50.33 74.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.936 0.398 . . . . 0.25 110.277 178.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . 0.418 ' HB3' ' HB2' ' A' ' 71' ' ' TYR . 10.3 m-85 -58.58 -44.97 89.98 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.729 -0.669 . . . . 0.66 110.453 176.193 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . 0.461 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 79.7 mt-30 -59.97 -38.06 81.44 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.966 -0.561 . . . . 1.96 111.218 -179.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -69.42 -26.59 64.69 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.152 -0.477 . . . . 1.69 110.632 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -88.97 4.78 46.98 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.004 -0.544 . . . . 1.23 110.932 178.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 106.32 -14.96 43.22 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.819 -0.705 . . . . 0.34 112.881 176.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . 0.418 ' HB2' ' HB3' ' A' ' 66' ' ' TYR . 80.5 m-85 -82.3 71.56 9.36 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.191 0.52 . . . . 0.8 110.186 -178.448 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 40.5 t -67.77 -28.69 42.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.629 -0.714 . . . . 1.13 110.992 -176.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 43.4 tp -78.84 -8.93 59.26 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.038 -0.528 . . . . 2.34 110.908 -179.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -93.15 141.07 28.82 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.076 0.465 . . . . 1.08 111.241 -177.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 30.3 tpt180 -151.28 131.5 13.6 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.959 -0.564 . . . . 2.16 109.603 177.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.22 138.16 35.9 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.378 -0.374 . . . . 0.99 110.203 178.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 49.0 p90 -135.78 142.59 44.95 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.415 -0.357 . . . . 0.43 110.053 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.8 tt -95.79 115.42 65.51 Favored Pre-proline 0 C--N 1.318 -0.784 0 N-CA-C 109.211 -0.663 . . . . 1.15 109.211 179.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.403 ' HD2' ' O ' ' A' ' 89' ' ' ARG . 55.7 Cg_endo -70.57 93.23 0.59 Allowed 'Trans proline' 0 N--CA 1.462 -0.374 0 C-N-CA 122.39 2.06 . . . . 1.12 111.796 178.315 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -89.46 63.65 6.44 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.254 -0.43 . . . . 2.0 110.884 -178.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -97.77 -33.46 11.26 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.933 -0.576 . . . . 4.28 110.007 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -149.31 -62.12 0.22 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.359 -0.837 . . . . 3.76 109.704 -177.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 50.3 mt 66.39 106.37 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.297 0 CA-C-N 115.56 -0.745 . . . . 1.82 112.387 178.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . 0.406 ' CD ' ' H ' ' A' ' 84' ' ' GLN . 4.1 pm0 -61.0 140.8 57.74 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.745 -0.661 . . . . 1.71 109.678 171.086 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -77.57 140.63 39.73 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.993 -0.373 . . . . 1.54 109.993 -178.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 102.16 -45.32 1.38 Allowed Glycine 0 N--CA 1.446 -0.688 0 C-N-CA 120.836 -0.697 . . . . 0.72 112.077 -178.086 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 25.8 m -127.04 121.67 32.23 Favored 'General case' 0 C--N 1.322 -0.595 0 O-C-N 122.692 -0.299 . . . . 1.12 110.717 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 31.7 m -102.84 131.66 50.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 N-CA-C 109.716 -0.476 . . . . 1.1 109.716 175.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . 0.478 ' HA ' ' O ' ' A' ' 26' ' ' GLN . 51.8 ttt180 -110.52 130.87 55.46 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.268 0.556 . . . . 3.51 110.901 -177.316 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.4 ' HB ' HD13 ' A' ' 27' ' ' LEU . 67.2 mt -110.86 134.34 53.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.046 -0.979 . . . . 0.99 109.868 -179.249 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -94.14 123.75 37.72 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.342 0.591 . . . . 1.33 110.13 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 57.9 t -98.63 110.6 26.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 115.367 -0.833 . . . . 1.04 110.501 -176.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 56.2 tp -94.35 95.13 8.69 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.356 -0.609 . . . . 1.2 109.356 176.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 55.7 mt-10 -78.56 -9.9 59.52 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.895 -0.593 . . . . 0.49 110.816 -176.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.934 -0.926 . . . . 1.39 111.723 178.189 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.8 ptt? . . . . . 0 N--CA 1.48 1.058 0 CA-C-O 120.56 0.219 . . . . 15.98 111.157 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -93.02 -20.57 20.43 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.085 0.469 . . . . 13.23 110.899 -179.108 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -80.83 80.37 7.31 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.839 -0.619 . . . . 13.93 109.561 178.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 49.7 m80 69.74 169.18 0.3 Allowed 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.226 -0.897 . . . . 11.29 111.064 -176.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 62.9 m80 -135.81 58.59 1.74 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.748 -0.66 . . . . 9.64 109.458 179.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 25.5 p80 -103.86 31.76 4.3 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.361 -0.836 . . . . 10.58 111.581 -172.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 28.8 m170 -75.25 63.04 1.31 Allowed 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 121.257 0.551 . . . . 8.21 110.521 176.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 41.2 m80 -141.76 84.78 1.91 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.993 -0.743 . . . . 7.27 108.993 -178.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.41 ' HB ' ' HG2' ' A' ' 48' ' ' GLN . 45.2 t -72.07 100.74 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 116.056 -0.52 . . . . 2.46 111.317 -174.53 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -95.64 12.91 28.05 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.681 -0.69 . . . . 4.2 109.907 176.028 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -87.59 2.09 51.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.798 -0.637 . . . . 4.33 111.126 -178.298 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -88.33 108.89 19.57 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.999 0.428 . . . . 4.37 109.986 177.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -76.98 170.33 16.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.737 -0.665 . . . . 5.36 112.107 -172.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.6 pptp? -145.44 156.07 43.52 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.35 -0.841 . . . . 3.85 110.33 178.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 26.1 ttt -139.1 -52.7 0.56 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.472 -0.331 . . . . 4.76 110.535 179.164 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -66.22 -42.56 94.18 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.753 -0.737 . . . . 3.71 112.096 178.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -158.97 150.37 20.92 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.839 -0.696 . . . . 2.09 111.73 178.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -55.05 139.15 79.94 Favored 'Trans proline' 0 C--O 1.235 0.344 0 C-N-CA 123.336 2.691 . . . . 1.35 113.234 179.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 3.3 p -87.79 153.91 20.97 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.711 -0.677 . . . . 1.2 110.599 179.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 60.3 t -114.56 125.53 71.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.768 0.318 . . . . 1.22 110.555 178.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.435 ' HA ' ' HA ' ' A' ' 49' ' ' GLU . 51.8 tp -69.46 101.37 1.56 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.047 0.451 . . . . 1.53 110.478 177.427 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.419 HG11 ' HB3' ' A' ' 46' ' ' PRO . 60.8 t -80.68 126.54 39.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.704 -0.68 . . . . 1.03 110.172 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -108.52 -35.49 6.46 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.98 -0.555 . . . . 1.7 110.289 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 12.6 ptp180 -155.11 160.96 41.36 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.231 -0.44 . . . . 2.48 111.016 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.546 ' CE2' ' HG ' ' A' ' 42' ' ' LEU . 40.7 m-85 -114.78 141.02 48.42 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.735 -0.666 . . . . 0.35 110.228 178.569 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 29.9 tp60 -129.08 127.56 41.76 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.355 -0.609 . . . . 1.64 109.355 179.215 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.418 HD13 ' HB ' ' A' ' 90' ' ' ILE . 3.5 mm? -101.93 136.53 41.61 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.113 0.483 . . . . 1.03 109.8 -178.578 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.479 ' O ' ' HA ' ' A' ' 91' ' ' GLU . 74.1 m -132.16 131.25 42.07 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.757 -0.656 . . . . 1.57 110.414 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 99.18 -11.71 61.96 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.764 -0.732 . . . . 0.27 111.803 -177.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 17.3 p-10 -77.88 131.97 37.75 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.975 0.417 . . . . 0.58 110.58 179.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 28.5 mmm180 -126.23 -38.37 2.15 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.133 -0.485 . . . . 3.08 110.252 179.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 49.3 tp60 -68.5 -44.61 74.32 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.046 -0.524 . . . . 2.59 110.67 -177.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.436 ' HD2' ' CZ ' ' A' ' 66' ' ' TYR . 83.1 m-85 -122.98 136.19 54.76 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.016 -0.538 . . . . 0.29 109.69 179.583 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -82.48 175.72 9.98 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.027 -0.533 . . . . 0.62 111.046 -175.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.428 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 72.5 m-20 -54.73 -48.8 72.08 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 116.222 -0.444 . . . . 0.59 111.296 -177.489 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -62.34 -25.69 68.03 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.193 -0.458 . . . . 4.12 111.319 -174.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.2 tpt180 -79.89 -36.35 36.65 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.874 -0.603 . . . . 3.02 110.718 179.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -87.45 -34.35 18.74 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.053 0.39 . . . . 1.03 112.053 -176.456 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 35' ' ' ASP . 4.1 pp -67.0 -18.15 65.25 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 120.917 -0.313 . . . . 2.38 110.896 -179.065 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.49 -23.44 66.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.061 0.458 . . . . 1.11 110.37 176.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.492 HD11 ' HA ' ' A' ' 62' ' ' ILE . 2.4 mt -70.46 -23.09 62.64 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.871 -0.604 . . . . 0.99 110.45 175.636 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.546 ' HG ' ' CE2' ' A' ' 25' ' ' PHE . 0.7 OUTLIER -110.21 13.79 22.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.859 -0.61 . . . . 1.07 110.116 -179.444 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.9 p80 -56.19 -25.34 46.53 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.451 0.537 . . . . 0.66 112.451 -172.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -103.57 9.57 37.4 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.659 0.266 . . . . 0.6 111.152 -176.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 10.5 tp -97.52 -55.75 0.19 Allowed Pre-proline 0 C--N 1.32 -0.689 0 N-CA-C 113.792 1.034 . . . . 1.53 113.792 -169.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.419 ' HB3' HG11 ' A' ' 22' ' ' VAL . 82.7 Cg_endo -76.03 172.83 15.54 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 121.567 1.512 . . . . 0.33 112.825 -170.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.26 -0.67 64.01 Favored Glycine 0 N--CA 1.445 -0.728 0 N-CA-C 110.435 -1.066 . . . . 0.31 110.435 -172.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.41 ' HG2' ' HB ' ' A' ' 9' ' ' VAL . 53.6 mt-30 -131.33 174.62 9.88 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.954 -0.623 . . . . 2.2 109.621 178.301 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.435 ' HA ' ' HA ' ' A' ' 21' ' ' LEU . 37.4 mt-10 -95.58 95.56 8.46 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.385 0.612 . . . . 1.12 110.178 175.572 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -85.39 136.12 33.59 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.256 -0.884 . . . . 1.08 109.408 178.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.8 t-20 -80.39 156.47 26.67 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.452 -0.573 . . . . 1.77 109.452 178.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -49.76 -43.1 47.89 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 117.945 0.338 . . . . 1.6 111.738 -175.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 11.2 m -52.25 -45.03 65.21 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.092 0.472 . . . . 1.26 110.659 175.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -68.3 -39.2 82.11 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.629 -0.714 . . . . 1.74 111.152 179.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.495 ' HB3' HD13 ' A' ' 78' ' ' LEU . 10.9 mp -56.85 -46.99 81.4 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 120.719 0.295 . . . . 1.81 111.265 173.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 80.8 m-70 -65.95 -34.82 79.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.883 0.373 . . . . 3.73 110.451 178.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.7 -27.84 67.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.178 -0.464 . . . . 1.07 110.962 178.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.0 -38.49 91.28 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.193 0.521 . . . . 1.03 110.233 175.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.18 -30.85 71.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.596 -0.729 . . . . 1.0 110.546 177.427 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -66.16 -36.72 83.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.965 -0.562 . . . . 1.08 110.895 179.056 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 80.7 mtt180 -55.35 -42.06 73.36 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.299 0.571 . . . . 0.42 110.001 175.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.492 ' HA ' HD11 ' A' ' 41' ' ' LEU . 66.0 mt -77.91 -35.17 20.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.111 -0.949 . . . . 1.1 111.151 -175.626 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.616 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -58.89 -49.59 76.49 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.376 -0.916 . . . . 0.22 111.624 176.471 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -66.45 -28.32 68.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.541 0.21 . . . . 2.17 110.957 178.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.535 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 87.7 t80 -58.99 -50.38 74.29 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.019 0.437 . . . . 0.25 110.183 177.022 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . 0.436 ' CZ ' ' HD2' ' A' ' 33' ' ' PHE . 8.6 m-85 -61.66 -44.46 96.93 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.651 -0.704 . . . . 0.66 110.964 177.658 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . 0.616 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 42.0 mt-30 -61.16 -35.49 77.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.11 -0.496 . . . . 1.96 111.033 -178.621 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -64.49 -35.66 81.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.219 0.533 . . . . 1.69 110.589 176.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.535 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 69.6 mmtt -79.16 -4.12 48.91 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.982 -0.554 . . . . 1.23 110.829 -177.284 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.67 -6.99 27.94 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.953 -0.642 . . . . 0.34 112.302 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 -92.37 65.78 4.59 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.324 -0.621 . . . . 0.8 109.324 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 43.8 t -66.0 -28.1 42.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.699 -0.682 . . . . 1.13 110.836 -175.52 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 55.6 tp -73.66 -25.32 60.21 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.832 -0.622 . . . . 2.34 110.349 178.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -79.68 131.64 36.01 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.824 -0.626 . . . . 1.08 111.438 -175.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 20.5 mmm180 -140.37 155.13 46.88 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.645 -0.707 . . . . 2.16 109.918 176.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -113.51 135.05 54.32 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.954 -0.566 . . . . 0.99 109.754 178.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 47.4 p90 -130.33 149.71 51.89 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.511 -0.551 . . . . 0.43 109.511 179.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.495 HD13 ' HB3' ' A' ' 55' ' ' LEU . 7.5 tt -106.24 108.43 61.73 Favored Pre-proline 0 C--N 1.316 -0.88 0 N-CA-C 110.018 -0.364 . . . . 1.15 110.018 -178.008 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -59.8 105.81 0.29 Allowed 'Trans proline' 0 C--O 1.233 0.271 0 C-N-CA 122.891 2.394 . . . . 1.12 112.163 176.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.89 160.54 29.81 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.89 -0.596 . . . . 2.0 110.83 -179.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 64.06 13.05 7.44 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 123.502 0.501 . . . . 4.28 111.51 -178.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -133.56 33.36 3.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 122.176 0.989 . . . . 3.76 108.561 178.157 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 53.5 mt -108.58 149.52 11.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 114.595 -1.184 . . . . 1.82 110.615 -174.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 14.6 mp0 -102.67 161.4 13.76 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.156 -0.683 . . . . 1.71 109.156 177.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -75.95 63.32 1.72 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.949 0.88 . . . . 1.54 111.361 -173.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 147.48 -35.76 1.21 Allowed Glycine 0 N--CA 1.444 -0.832 0 CA-C-N 115.206 -0.906 . . . . 0.72 111.436 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 25.0 m -102.31 122.29 43.96 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 120.814 0.34 . . . . 1.12 110.211 178.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 33.2 m -108.21 128.07 63.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 109.918 -0.401 . . . . 1.1 109.918 176.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 14.3 ttt180 -103.94 114.29 28.44 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 120.494 -0.482 . . . . 3.51 110.43 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.418 ' HB ' HD13 ' A' ' 27' ' ' LEU . 49.1 mt -103.56 131.43 52.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 115.888 -0.596 . . . . 0.99 109.772 178.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.479 ' HA ' ' O ' ' A' ' 28' ' ' SER . 38.6 mt-10 -96.75 125.95 41.57 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.36 0.6 . . . . 1.33 110.591 -179.028 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 57.8 t -98.76 111.43 28.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.435 -0.802 . . . . 1.04 110.215 -178.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 30.9 tp -94.63 89.02 5.61 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.076 -0.713 . . . . 1.2 109.076 178.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 57.6 mt-10 -67.22 -15.67 63.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.508 -0.769 . . . . 0.49 111.725 -174.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.964 0 CA-C-O 118.929 -0.928 . . . . 1.39 111.764 178.904 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 mmt . . . . . 0 N--CA 1.482 1.168 0 CA-C-O 120.631 0.253 . . . . 15.98 110.809 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -79.43 -66.58 0.85 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.429 -0.35 . . . . 13.23 111.078 -178.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 60.2 m170 -65.22 -61.65 2.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.959 0.409 . . . . 13.93 110.202 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 31.3 m170 -83.22 90.72 7.14 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.283 -0.636 . . . . 11.29 109.283 173.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 61.2 t60 -106.23 -44.26 4.59 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.671 -0.695 . . . . 9.64 109.936 -179.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 64.0 m80 -74.19 108.59 7.09 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.814 -0.63 . . . . 10.58 110.281 177.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 53.4 m80 -65.58 117.27 7.81 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.775 -0.648 . . . . 8.21 109.981 179.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 33.3 p-80 -126.84 47.44 2.32 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.569 0.7 . . . . 7.27 110.189 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 58.1 t -112.92 132.11 62.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.366 -0.834 . . . . 2.46 109.573 177.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -111.4 129.26 56.07 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.073 0.464 . . . . 4.2 111.074 -176.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -90.53 -26.35 19.79 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.496 -0.928 . . . . 4.33 108.496 172.291 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 19.1 t70 48.89 79.14 0.08 Allowed 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 114.606 -1.179 . . . . 4.37 112.194 171.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 38.5 t70 64.56 102.67 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.675 -0.693 . . . . 5.36 110.801 -178.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.54 ' HD2' ' O ' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -53.9 115.3 1.94 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.753 -0.658 . . . . 3.85 111.608 -179.394 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 27.8 ttt -119.75 126.87 52.11 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.849 -0.614 . . . . 4.76 109.43 177.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 94.3 31.34 8.04 Favored Glycine 0 N--CA 1.447 -0.63 0 N-CA-C 110.659 -0.976 . . . . 3.71 110.659 -174.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 99.39 163.57 29.47 Favored Glycine 0 N--CA 1.444 -0.823 0 N-CA-C 111.226 -0.75 . . . . 2.09 111.226 -176.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -58.64 132.35 47.65 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.571 2.181 . . . . 1.35 111.713 177.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 11.4 p -81.94 140.02 34.28 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.344 0.592 . . . . 1.2 111.218 -176.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 21.8 t -118.19 125.0 73.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-N 115.587 -0.733 . . . . 1.22 109.846 179.206 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -71.72 126.76 30.55 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.028 -0.73 . . . . 1.53 109.028 175.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.489 HG13 ' CE1' ' A' ' 25' ' ' PHE . 63.9 t -108.36 116.89 52.69 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 CA-C-N 115.909 -0.587 . . . . 1.03 110.498 -176.138 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -97.85 -26.17 14.78 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.335 -0.848 . . . . 1.7 109.382 178.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 4.3 ptp180 -168.05 161.9 12.89 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.839 -0.619 . . . . 2.48 110.685 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.565 ' CE2' ' HG ' ' A' ' 42' ' ' LEU . 26.7 m-85 -110.91 137.14 48.92 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.696 -0.684 . . . . 0.35 109.731 178.033 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 7.2 tp-100 -114.72 129.18 56.65 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 109.544 -0.539 . . . . 1.64 109.544 177.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -103.7 127.29 51.18 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.007 0.432 . . . . 1.03 110.098 -178.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.0 t -115.08 119.47 36.56 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.938 -0.574 . . . . 1.57 110.164 -178.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 99.27 0.63 56.97 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.756 -0.735 . . . . 0.27 112.758 178.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 20.0 p-10 -81.23 124.29 29.17 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.361 0.6 . . . . 0.58 111.259 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 31' ' ' ARG . 15.3 mmm180 -128.22 -34.03 2.12 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.782 -0.645 . . . . 3.08 110.575 177.782 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -69.35 -32.68 71.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.108 -0.497 . . . . 2.59 110.543 179.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 -136.94 141.68 42.66 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.406 -0.59 . . . . 0.29 109.406 175.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -81.06 169.7 17.13 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.433 -0.349 . . . . 0.62 110.721 -178.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.508 ' O ' HD11 ' A' ' 39' ' ' LEU . 1.0 OUTLIER -55.4 -54.99 36.79 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-N 116.455 -0.339 . . . . 0.59 111.344 -176.048 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 62.8 ttt180 -58.69 -32.79 69.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.764 0.316 . . . . 4.12 110.853 -175.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 20.2 tpt180 -64.59 -42.94 95.26 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.212 -0.449 . . . . 3.02 110.575 176.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.449 ' HA ' HD11 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -78.79 -26.14 44.36 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.91 0.386 . . . . 1.03 110.916 179.651 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.508 HD11 ' O ' ' A' ' 35' ' ' ASP . 1.4 mp -60.3 -31.47 70.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.145 -0.48 . . . . 2.38 111.116 177.668 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.73 -24.06 65.41 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.903 -0.59 . . . . 1.11 111.403 176.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.471 HD13 ' HA ' ' A' ' 62' ' ' ILE . 3.8 mt -74.69 -24.49 58.78 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.123 0.487 . . . . 0.99 110.513 176.366 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.565 ' HG ' ' CE2' ' A' ' 25' ' ' PHE . 0.4 OUTLIER -107.67 14.27 25.79 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.989 -0.551 . . . . 1.07 110.12 -179.041 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 8.1 p80 -53.9 -19.94 5.29 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 113.161 0.8 . . . . 0.66 113.161 -171.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -110.65 11.0 22.85 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.082 0.401 . . . . 0.6 112.082 -175.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 84.8 mt -100.31 -54.72 0.16 Allowed Pre-proline 0 CA--C 1.539 0.519 0 N-CA-C 113.823 1.046 . . . . 1.53 113.823 -174.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.419 ' HB3' HG12 ' A' ' 22' ' ' VAL . 41.3 Cg_endo -69.92 165.82 29.88 Favored 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 121.345 1.363 . . . . 0.33 112.788 -170.384 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.26 -24.26 29.75 Favored Glycine 0 N--CA 1.447 -0.567 0 N-CA-C 110.711 -0.955 . . . . 0.31 110.711 -171.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -109.08 169.79 8.46 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.284 -0.458 . . . . 2.2 110.165 175.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -97.93 110.74 23.25 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.705 -0.68 . . . . 1.12 109.894 177.189 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -96.85 140.74 30.96 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.293 -0.867 . . . . 1.08 110.402 -174.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.658 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 36.1 p30 -85.44 171.34 11.88 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.938 -0.394 . . . . 1.77 109.938 177.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.427 ' HA ' HD12 ' A' ' 55' ' ' LEU . 3.8 mm? -50.69 -45.01 58.08 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.515 0.197 . . . . 1.6 111.521 -178.506 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.45 ' HA ' ' NE2' ' A' ' 56' ' ' HIS . 22.5 m -55.42 -51.1 67.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.327 -0.397 . . . . 1.26 111.069 179.3 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -67.28 -30.83 70.8 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.111 -0.495 . . . . 1.74 111.185 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.658 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 84.3 mt -60.78 -55.03 38.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.404 -0.362 . . . . 1.81 111.027 178.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.45 ' NE2' ' HA ' ' A' ' 53' ' ' SER . 34.8 p80 -75.88 -22.91 55.66 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.493 -0.483 . . . . 3.73 111.183 -178.125 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.32 -33.31 72.21 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.132 0.492 . . . . 1.07 110.403 174.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.86 -39.7 90.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.676 -0.693 . . . . 1.03 110.662 176.345 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.48 -34.99 78.3 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.802 -0.635 . . . . 1.0 110.729 179.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.06 -39.19 94.0 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.873 -0.603 . . . . 1.08 110.962 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 80.6 mtt180 -55.45 -42.59 74.46 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.266 0.555 . . . . 0.42 110.334 176.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ILE . . . . . 0.504 HD12 HD22 ' A' ' 42' ' ' LEU . 72.6 mt -78.34 -37.52 21.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.533 -0.758 . . . . 1.1 110.699 -176.238 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.654 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -59.1 -45.36 95.41 Favored Glycine 0 N--CA 1.442 -0.929 0 C-N-CA 120.67 -0.776 . . . . 0.22 111.645 176.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -68.25 -33.41 74.34 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.818 0.342 . . . . 2.17 110.52 178.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.438 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 90.4 t80 -57.27 -51.32 69.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.889 -0.596 . . . . 0.25 110.628 178.231 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -59.61 -41.42 90.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.97 -0.559 . . . . 0.66 111.157 178.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . 0.654 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 21.2 mt-30 -58.73 -44.8 90.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.034 -0.53 . . . . 1.96 111.087 -178.146 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -70.44 -17.27 62.99 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.84 0.352 . . . . 1.69 111.339 -179.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.438 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 75.5 mmtt -91.2 4.89 51.1 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.802 0.334 . . . . 1.23 110.642 179.704 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 102.61 -11.54 56.47 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.769 -0.729 . . . . 0.34 112.489 176.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -89.72 74.24 7.53 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.426 0.631 . . . . 0.8 109.387 -179.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 28.7 t -74.34 -25.77 19.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.434 -0.803 . . . . 1.13 111.091 -174.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 60.8 tp -78.19 -16.77 57.56 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.134 0.492 . . . . 2.34 110.029 176.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.503 ' HA ' ' O ' ' A' ' 93' ' ' LEU . . . -82.7 137.3 34.48 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.957 -0.565 . . . . 1.08 111.504 -178.286 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 21.5 tpt180 -152.12 132.6 13.81 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.7 -0.682 . . . . 2.16 109.602 176.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -95.81 135.13 37.94 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 110.288 -0.264 . . . . 0.99 110.288 178.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 51.0 p90 -135.36 149.39 49.68 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.86 0.362 . . . . 0.43 110.27 179.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.5 tt -104.21 118.4 56.99 Favored Pre-proline 0 C--N 1.318 -0.791 0 N-CA-C 108.997 -0.742 . . . . 1.15 108.997 178.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -69.14 80.89 0.68 Allowed 'Trans proline' 0 C--O 1.234 0.292 0 C-N-CA 122.654 2.236 . . . . 1.12 112.095 179.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.58 119.63 13.33 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.005 -0.543 . . . . 2.0 110.853 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.492 ' OE1' ' HA ' ' A' ' 81' ' ' GLN . 6.3 tp60 -171.13 -51.79 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.035 -0.529 . . . . 4.28 110.252 -179.508 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -132.17 -64.04 0.79 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.606 -0.725 . . . . 3.76 109.592 178.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 65.3 mt 67.17 136.4 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-N 115.574 -0.739 . . . . 1.82 111.724 -178.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -72.19 114.57 10.45 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.085 -0.709 . . . . 1.71 109.085 176.772 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -62.29 107.25 0.87 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.756 0.788 . . . . 1.54 110.044 -178.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 124.03 -40.72 1.88 Allowed Glycine 0 N--CA 1.445 -0.703 0 CA-C-N 115.423 -0.808 . . . . 0.72 111.599 -175.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 87.0 m -128.86 119.76 25.03 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.904 0.383 . . . . 1.12 110.397 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 32.6 m -95.91 132.97 38.74 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 N-CA-C 109.676 -0.49 . . . . 1.1 109.676 178.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 34.4 ttp180 -111.34 117.32 32.8 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.287 0.565 . . . . 3.51 110.707 -177.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 71.9 mt -100.98 131.47 48.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 115.223 -0.899 . . . . 0.99 109.669 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -94.21 117.95 30.86 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.371 0.605 . . . . 1.33 110.068 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 55.4 t -92.85 109.57 21.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 115.426 -0.806 . . . . 1.04 110.263 -177.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.503 ' O ' ' HA ' ' A' ' 74' ' ' ALA . 57.5 tp -89.9 90.72 8.3 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.47 -0.567 . . . . 1.2 109.47 176.589 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -77.79 -12.32 59.96 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.203 0.525 . . . . 0.49 110.465 -178.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.232 0 CA-C-O 118.279 -1.289 . . . . 1.39 111.22 178.277 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 39.2 t . . . . . 0 N--CA 1.448 -0.527 0 N-CA-C 110.021 -0.363 . . . . 0.52 110.021 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.411 ' O ' ' HA2' ' A' ' 86' ' ' GLY . 35.9 tp -71.32 102.27 2.56 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.138 -0.689 . . . . 0.91 109.138 174.114 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.602 HG12 ' HB3' ' A' ' 46' ' ' PRO . 75.7 t -76.15 115.54 17.87 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 CA-C-N 115.585 -0.734 . . . . 0.31 110.727 -176.707 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -98.88 -32.6 11.25 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.905 -0.589 . . . . 1.16 109.848 176.595 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 7.1 ptm180 -158.68 163.09 37.18 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.083 -0.508 . . . . 2.16 110.963 178.426 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.58 ' CE2' ' HG ' ' A' ' 42' ' ' LEU . 42.0 m-85 -111.18 139.12 46.82 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.534 -0.757 . . . . 0.35 109.78 176.051 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -120.59 128.99 53.56 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 109.559 -0.534 . . . . 1.37 109.559 176.178 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.61 ' HG ' HD23 ' A' ' 38' ' ' LEU . 3.8 mm? -102.65 129.52 49.27 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.278 0.561 . . . . 0.25 110.013 -179.007 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 40.8 t -121.04 121.67 38.44 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.535 -0.757 . . . . 0.95 110.227 -177.288 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 101.51 -7.46 56.03 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.835 -0.698 . . . . 0.21 112.295 -179.25 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 20.6 p-10 -77.49 123.34 26.44 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.139 0.495 . . . . 0.44 110.935 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.451 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 30.1 mmm180 -124.33 -26.71 3.89 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.043 -0.526 . . . . 2.48 110.226 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -81.34 -36.02 30.21 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.886 -0.597 . . . . 1.91 110.835 -179.464 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.437 ' HD2' ' CZ ' ' A' ' 66' ' ' TYR . 78.3 m-85 -130.92 135.39 47.62 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.139 -0.482 . . . . 0.25 110.336 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.582 ' OD1' ' HB3' ' A' ' 36' ' ' ARG . 1.7 p30 -77.04 169.45 18.32 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.904 -0.589 . . . . 0.62 111.16 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.505 ' O ' HD13 ' A' ' 39' ' ' LEU . 4.2 m-20 -52.81 -52.58 56.35 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 123.284 0.365 . . . . 0.59 110.387 -179.348 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.582 ' HB3' ' OD1' ' A' ' 34' ' ' ASP . 6.7 ttp180 -45.32 -49.57 12.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.467 -0.788 . . . . 3.66 111.975 179.456 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -59.77 -41.96 92.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.175 -0.466 . . . . 2.3 111.372 -179.207 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.61 HD23 ' HG ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -82.51 -25.15 33.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.3 -0.409 . . . . 0.19 111.445 -175.799 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.505 HD13 ' O ' ' A' ' 35' ' ' ASP . 2.5 mp -63.11 -34.6 77.94 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.363 -0.38 . . . . 1.77 111.806 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.91 -21.99 66.42 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.478 -0.328 . . . . 0.3 111.211 178.392 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.612 HD13 HG12 ' A' ' 62' ' ' ILE . 6.4 mt -69.87 -25.41 63.7 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.072 0.463 . . . . 0.2 110.202 175.033 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.58 ' HG ' ' CE2' ' A' ' 25' ' ' PHE . 0.5 OUTLIER -108.04 14.21 25.39 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.799 -0.637 . . . . 0.22 110.171 -179.29 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 13.0 p80 -47.53 -27.02 1.61 Allowed 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 113.489 0.922 . . . . 0.55 113.489 -174.756 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -104.21 11.29 35.14 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.486 0.55 . . . . 0.6 112.486 -173.648 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 81.6 mt -102.38 -56.95 0.11 Allowed Pre-proline 0 C--N 1.323 -0.577 0 N-CA-C 114.005 1.113 . . . . 0.83 114.005 -173.376 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.602 ' HB3' HG12 ' A' ' 22' ' ' VAL . 74.1 Cg_endo -72.26 164.07 36.75 Favored 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 121.36 1.373 . . . . 0.33 113.145 -166.229 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 91.96 -0.36 72.7 Favored Glycine 0 N--CA 1.446 -0.684 0 N-CA-C 110.331 -1.108 . . . . 0.31 110.331 -170.231 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -129.57 171.33 12.71 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.075 -0.562 . . . . 1.46 109.77 -179.189 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -99.15 92.15 5.33 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.481 0.658 . . . . 1.12 110.168 178.446 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -83.18 135.81 34.66 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 114.876 -1.056 . . . . 0.38 109.477 -179.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.584 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 28.2 p-10 -83.78 170.7 13.88 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.586 -0.524 . . . . 1.39 109.586 178.15 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.517 HD13 HD12 ' A' ' 55' ' ' LEU . 3.6 mm? -55.33 -42.19 73.46 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.644 0.259 . . . . 0.92 111.07 -176.411 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 11.5 m -59.48 -45.74 90.81 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.335 -0.393 . . . . 0.69 111.193 -178.927 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -66.78 -33.95 76.75 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.891 0.377 . . . . 1.74 110.767 176.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.584 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 82.2 mt -63.36 -42.68 98.91 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.021 -0.536 . . . . 1.15 110.854 177.526 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 71.6 m80 -69.76 -35.75 75.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.82 0.343 . . . . 2.83 110.416 177.571 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.4 -33.86 76.83 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.24 -0.436 . . . . 0.31 110.934 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -57.45 -39.13 75.64 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.827 -0.624 . . . . 0.21 111.012 177.054 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.44 -30.71 69.65 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.778 -0.646 . . . . 0.14 111.322 -178.323 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.91 -32.03 73.55 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.213 -0.449 . . . . 0.17 110.838 -179.138 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 77.5 mtt180 -58.84 -42.08 88.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.828 -0.623 . . . . 0.36 110.172 176.471 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.612 HG12 HD13 ' A' ' 41' ' ' LEU . 62.3 mt -77.37 -35.86 22.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.363 -0.835 . . . . 0.16 110.761 -175.642 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.518 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -60.97 -36.17 91.79 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.859 -0.686 . . . . 0.22 112.197 178.456 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -80.61 -31.81 36.53 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.883 0.373 . . . . 2.17 110.47 177.422 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.444 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 90.8 t80 -54.45 -50.75 66.94 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.825 -0.625 . . . . 0.21 110.627 177.544 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' TYR . . . . . 0.46 ' HB3' ' HB2' ' A' ' 71' ' ' TYR . 8.5 m-85 -59.53 -39.64 84.59 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.589 -0.732 . . . . 0.21 111.313 178.704 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLN . . . . . 0.518 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 77.3 mt-30 -60.39 -38.29 83.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.252 -0.431 . . . . 1.21 111.267 -177.713 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -73.08 -19.35 61.18 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.031 0.443 . . . . 1.68 111.071 -179.174 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.444 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 73.6 mmtt -88.38 -4.43 58.66 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.147 -0.479 . . . . 0.57 110.058 178.079 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.31 -8.27 30.76 Favored Glycine 0 N--CA 1.448 -0.53 0 CA-C-N 115.84 -0.618 . . . . 0.31 112.402 178.735 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' TYR . . . . . 0.46 ' HB2' ' HB3' ' A' ' 66' ' ' TYR . 44.3 m-85 -90.53 72.51 6.89 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.235 0.541 . . . . 0.39 109.795 -179.452 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 21.2 t -72.53 -24.63 21.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.735 -0.666 . . . . 0.41 110.85 -175.583 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 96.1 mt -80.72 -9.89 59.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.837 -0.619 . . . . 1.76 110.849 178.544 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.554 ' HA ' ' O ' ' A' ' 93' ' ' LEU . . . -85.94 139.95 30.77 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.065 -0.516 . . . . 0.37 111.437 -176.166 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 13.4 tpt180 -147.32 131.42 17.31 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.765 -0.652 . . . . 1.8 110.044 177.941 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -102.02 132.88 47.61 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.806 -0.442 . . . . 0.18 109.806 175.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 48.1 p90 -139.55 142.84 37.18 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.688 0.28 . . . . 0.38 110.316 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.511 HD13 ' HB3' ' A' ' 55' ' ' LEU . 7.0 tt -92.98 106.95 21.26 Favored Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 109.167 -0.679 . . . . 0.39 109.167 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo . . . . . 0 C--N 1.342 0.215 0 C-N-CA 123.029 2.486 . . . . 1.12 113.009 -172.593 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 86' ' ' GLY . . . . . 0.411 ' HA2' ' O ' ' A' ' 21' ' ' LEU . . . . . . . . 0 N--CA 1.444 -0.777 0 N-CA-C 111.638 -0.585 . . . . 0.58 111.638 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 17.8 m -95.85 121.65 37.8 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.034 0.445 . . . . 0.47 110.424 176.706 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 35.0 m -104.0 137.33 33.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 109.283 -0.636 . . . . 0.31 109.283 174.334 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.472 ' O ' ' HG ' ' A' ' 78' ' ' LEU . 27.4 ttm180 -114.38 135.29 54.25 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.447 -0.501 . . . . 2.92 111.404 -176.4 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.441 ' HB ' HD13 ' A' ' 27' ' ' LEU . 59.4 mt -120.26 136.68 56.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.564 -0.744 . . . . 0.23 110.239 179.013 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 44.9 mm-40 -92.97 120.49 33.34 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.862 -0.422 . . . . 1.33 109.862 179.022 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 40.0 t -102.07 102.05 13.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 116.113 -0.494 . . . . 0.27 110.72 -179.023 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.554 ' O ' ' HA ' ' A' ' 74' ' ' ALA . 61.3 tp -86.48 88.66 7.68 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.968 -0.56 . . . . 0.36 109.497 175.788 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.451 ' CD ' ' H ' ' A' ' 31' ' ' ARG . 50.1 mt-10 -74.22 -34.21 63.62 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.207 0.527 . . . . 0.49 110.389 -178.991 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.184 0 CA-C-O 118.322 -1.265 . . . . 1.39 111.118 -178.864 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 59.1 t . . . . . 0 N--CA 1.448 -0.534 0 N-CA-C 110.034 -0.358 . . . . 0.52 110.034 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.438 ' HB2' ' HG2' ' A' ' 49' ' ' GLU . 48.7 tp -65.82 115.99 6.52 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.353 -0.385 . . . . 0.91 110.081 175.41 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.545 HG11 ' CE1' ' A' ' 25' ' ' PHE . 51.7 t -100.69 136.52 31.83 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 CA-C-N 115.902 -0.59 . . . . 0.31 109.692 177.368 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -118.64 -24.46 6.72 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 109.797 -0.446 . . . . 1.16 109.797 176.829 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 16.3 ptp180 -162.69 154.3 18.01 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.06 -0.518 . . . . 2.16 110.67 175.192 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.545 ' CE1' HG11 ' A' ' 22' ' ' VAL . 33.2 m-85 -106.32 145.54 31.53 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.909 -0.587 . . . . 0.35 110.498 178.093 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.469 ' O ' ' HA ' ' A' ' 89' ' ' ARG . 50.1 tp60 -125.08 129.39 50.14 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 109.371 -0.603 . . . . 1.37 109.371 176.401 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.478 HD13 ' HB ' ' A' ' 90' ' ' ILE . 4.1 mm? -103.31 136.93 42.16 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.675 -0.491 . . . . 0.25 109.675 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.5 t -124.76 128.98 49.6 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.384 -0.371 . . . . 0.95 110.05 -179.08 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 96.48 -11.07 67.03 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.632 -0.794 . . . . 0.21 112.562 178.445 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 6.2 p-10 -67.67 144.95 55.25 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.906 0.384 . . . . 0.44 110.61 178.843 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.458 ' HB3' ' OE1' ' A' ' 94' ' ' GLU . 21.8 tpp180 -143.57 -37.72 0.34 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.795 -0.639 . . . . 2.48 110.161 179.355 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -68.62 -43.67 75.87 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.669 -0.696 . . . . 1.91 110.517 179.269 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -125.08 151.94 45.0 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.991 -0.744 . . . . 0.25 108.991 175.427 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -96.78 172.45 7.88 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.199 -0.297 . . . . 0.62 110.199 -178.387 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.529 ' O ' HD13 ' A' ' 39' ' ' LEU . 4.9 m-20 -50.7 -51.35 50.43 Favored 'General case' 0 C--O 1.221 -0.404 0 O-C-N 123.31 0.381 . . . . 0.59 110.785 -178.649 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 72.9 mtp180 -55.38 -33.67 63.66 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.946 -0.57 . . . . 3.66 111.967 -175.038 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 31.5 tpt85 -77.22 -41.91 39.46 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.683 -0.235 . . . . 2.3 110.829 -178.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.501 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -76.17 -27.37 56.92 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.983 0.421 . . . . 0.19 110.8 -178.515 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.529 HD13 ' O ' ' A' ' 35' ' ' ASP . 3.8 mp -60.9 -30.4 70.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.868 -0.605 . . . . 1.77 111.053 176.297 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.63 -23.32 65.97 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.727 -0.67 . . . . 0.3 111.633 178.535 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.549 HD13 HG12 ' A' ' 62' ' ' ILE . 2.3 mt -75.05 -26.65 59.56 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.344 0.592 . . . . 0.2 110.3 176.574 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.546 HD21 HD11 ' A' ' 62' ' ' ILE . 0.4 OUTLIER -105.49 14.26 28.9 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.648 -0.706 . . . . 0.22 109.886 -179.086 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 8.3 p80 -51.5 -22.86 3.43 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.408 0.892 . . . . 0.55 113.408 -171.802 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -107.83 -0.4 21.62 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.816 0.302 . . . . 0.6 111.816 -174.762 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 64.1 mt -84.45 -54.05 0.49 Allowed Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 113.462 0.912 . . . . 0.83 113.462 -173.43 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.514 ' HB3' HG12 ' A' ' 22' ' ' VAL . 73.8 Cg_endo -74.22 155.45 46.74 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 121.275 1.316 . . . . 0.33 112.051 -170.275 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 99.23 -17.14 58.36 Favored Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 109.444 -1.462 . . . . 0.31 109.444 -167.261 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -116.4 173.3 6.68 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.267 -0.966 . . . . 1.46 109.532 176.761 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.438 ' HG2' ' HB2' ' A' ' 21' ' ' LEU . 43.0 mt-10 -107.51 106.93 17.55 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.234 0.54 . . . . 1.12 109.972 178.554 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.428 HD23 ' CG2' ' A' ' 22' ' ' VAL . 2.6 mm? -93.56 126.46 38.73 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.911 -1.04 . . . . 0.38 110.318 -173.646 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.542 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 4.0 p30 -77.25 167.79 21.13 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 121.266 -0.174 . . . . 1.39 110.597 178.57 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.446 ' HA ' HD12 ' A' ' 55' ' ' LEU . 4.2 mm? -46.43 -45.06 17.8 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.453 0.538 . . . . 0.92 112.453 -176.181 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.409 ' HA ' ' NE2' ' A' ' 56' ' ' HIS . 33.2 m -56.59 -46.77 80.64 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.697 0.284 . . . . 0.69 111.032 -178.21 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -77.47 -23.72 50.34 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.422 -0.354 . . . . 1.74 111.348 -178.62 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 78.8 mt -61.41 -53.42 56.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.658 0.266 . . . . 1.15 110.366 176.369 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.409 ' NE2' ' HA ' ' A' ' 53' ' ' SER . 34.6 p80 -77.38 -23.65 50.73 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.392 -0.523 . . . . 2.83 111.125 -179.333 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.21 -32.15 73.62 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.139 0.495 . . . . 0.31 110.044 174.679 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.02 -41.36 92.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.62 -0.718 . . . . 0.21 110.253 175.007 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.16 -36.79 82.56 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.529 -0.76 . . . . 0.14 110.659 178.049 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.56 -34.6 78.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.911 -0.586 . . . . 0.17 111.09 179.361 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -57.31 -41.54 80.06 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.419 0.628 . . . . 0.36 110.034 175.021 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.549 HG12 HD13 ' A' ' 41' ' ' LEU . 76.9 mt -75.9 -36.72 33.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.154 -0.93 . . . . 0.16 110.717 -177.031 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.575 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -58.9 -47.98 87.88 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.688 -0.767 . . . . 0.22 111.689 177.038 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -68.35 -30.92 69.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.711 0.291 . . . . 2.17 110.552 178.426 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.437 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 86.9 t80 -57.79 -49.37 76.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.998 -0.546 . . . . 0.21 110.376 177.751 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 -61.58 -46.66 88.95 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.686 -0.688 . . . . 0.21 111.169 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLN . . . . . 0.575 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 15.7 mt-30 -56.84 -40.42 76.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.16 0.505 . . . . 1.21 110.536 179.452 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -63.72 -30.07 71.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.264 -0.88 . . . . 1.68 110.73 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.437 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 75.8 mmtt -90.04 6.8 40.76 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.902 -0.59 . . . . 0.57 110.927 -178.681 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 104.31 -12.18 51.49 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.953 -0.641 . . . . 0.31 112.914 176.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -88.76 70.16 8.72 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.212 0.529 . . . . 0.39 109.602 -179.301 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 26.1 t -71.1 -24.33 24.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.759 -0.655 . . . . 0.41 110.579 -176.568 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 50.3 tp -80.75 -7.16 59.29 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.668 -0.696 . . . . 1.76 110.389 178.632 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -99.92 134.86 42.21 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.183 0.516 . . . . 0.37 111.466 -176.234 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 16.7 mmm180 -141.86 164.28 30.63 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.553 -0.749 . . . . 1.8 109.509 176.334 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -127.53 137.5 52.64 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.971 -0.381 . . . . 0.18 109.971 179.551 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 48.1 p90 -132.39 143.16 49.64 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.9 0.381 . . . . 0.38 110.298 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.433 ' HA ' ' HD2' ' A' ' 79' ' ' PRO . 8.1 tt -96.18 110.83 54.21 Favored Pre-proline 0 C--N 1.32 -0.705 0 N-CA-C 109.164 -0.68 . . . . 0.39 109.164 178.046 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 0.433 ' HD2' ' HA ' ' A' ' 78' ' ' LEU . 11.8 Cg_endo . . . . . 0 N--CA 1.463 -0.282 0 C-N-CA 122.677 2.251 . . . . 1.12 111.701 177.569 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.709 0 N-CA-C 111.271 -0.732 . . . . 0.58 111.271 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 25.8 m -100.65 120.57 40.26 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.288 -0.634 . . . . 0.47 109.288 173.74 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 29.6 m -116.36 131.43 68.94 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.938 0 N-CA-C 109.847 -0.427 . . . . 0.31 109.847 179.66 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.469 ' HA ' ' O ' ' A' ' 26' ' ' GLN . 25.0 ttp180 -106.26 128.71 54.16 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.351 0.596 . . . . 2.92 111.221 -174.875 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.478 ' HB ' HD13 ' A' ' 27' ' ' LEU . 63.1 mt -113.89 134.83 55.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.042 -0.981 . . . . 0.23 109.187 177.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -96.49 128.26 43.26 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.216 0.531 . . . . 1.33 110.693 -179.322 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.424 ' CG2' HD12 ' A' ' 27' ' ' LEU . 47.7 t -102.63 124.55 56.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.445 -0.798 . . . . 0.27 110.259 -178.464 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 56.7 tp -107.85 99.93 9.35 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.525 -0.546 . . . . 0.36 109.525 177.021 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.458 ' OE1' ' HB3' ' A' ' 31' ' ' ARG . 69.4 mt-10 -87.61 33.64 0.7 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.889 -0.596 . . . . 0.49 111.045 -175.535 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.901 0 CA-C-O 118.65 -1.084 . . . . 1.39 112.13 179.882 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 32.8 t . . . . . 0 N--CA 1.45 -0.437 0 N-CA-C 110.189 -0.301 . . . . 0.52 110.189 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.499 ' O ' ' HA2' ' A' ' 86' ' ' GLY . 24.7 tp -72.91 92.0 1.59 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.081 -0.711 . . . . 0.91 109.081 174.261 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.56 ' HA ' ' O ' ' A' ' 86' ' ' GLY . 98.8 t -70.66 123.8 25.46 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.048 0 CA-C-N 115.295 -0.866 . . . . 0.31 111.149 -174.745 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.424 ' HG2' ' HA3' ' A' ' 86' ' ' GLY . 10.7 mmtp -80.84 -40.45 24.86 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.544 -0.753 . . . . 1.16 109.449 176.1 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.424 ' HG3' HG23 ' A' ' 87' ' ' THR . 4.6 ptp180 -174.59 169.57 3.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 114.493 -1.23 . . . . 2.16 109.392 -179.111 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.525 ' CE1' HG11 ' A' ' 22' ' ' VAL . 33.6 m-85 -106.04 125.1 50.58 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.002 -0.544 . . . . 0.35 110.525 178.527 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.408 ' O ' ' HA ' ' A' ' 89' ' ' ARG . 11.9 tp60 -104.63 127.51 52.4 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.325 -0.852 . . . . 1.37 108.721 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.453 HD13 ' HB ' ' A' ' 90' ' ' ILE . 3.7 mm? -102.97 134.91 45.62 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.148 0.499 . . . . 0.25 110.321 -177.591 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.462 ' HB2' ' HD3' ' A' ' 89' ' ' ARG . 28.4 t -127.76 135.04 49.59 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.763 -0.653 . . . . 0.95 109.797 -178.504 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 91.11 -11.36 72.4 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.672 -0.775 . . . . 0.21 112.646 179.259 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 15.5 p-10 -75.17 137.64 41.46 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.75 0.31 . . . . 0.44 110.688 179.018 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 30.1 tpt180 -128.2 -44.58 1.42 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.406 -0.361 . . . . 2.48 110.942 177.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 21.8 tp60 -64.85 -40.85 95.81 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.972 0.415 . . . . 1.91 110.612 -177.598 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 -125.63 133.37 52.24 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.936 -0.764 . . . . 0.25 108.936 177.677 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -88.76 178.08 6.56 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.613 -0.435 . . . . 0.62 110.629 -178.508 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -47.61 -48.83 28.2 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 123.743 0.652 . . . . 0.59 111.909 -176.733 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 79.0 mtm180 -55.17 -38.22 68.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.835 -0.621 . . . . 3.66 111.799 -173.275 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 37.1 tpt85 -77.57 -38.65 47.99 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.346 -0.388 . . . . 2.3 110.883 -176.809 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.59 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -81.67 -32.57 31.74 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 111.982 0.364 . . . . 0.19 111.982 -174.319 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.5 pp -68.19 -18.83 64.69 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.913 -0.315 . . . . 1.77 110.92 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.46 -24.04 63.74 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.248 -0.433 . . . . 0.3 110.653 177.16 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.675 HD13 HG12 ' A' ' 62' ' ' ILE . 1.9 mt -67.44 -22.84 65.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.331 0.586 . . . . 0.2 110.143 175.275 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.505 HD21 HD11 ' A' ' 62' ' ' ILE . 0.7 OUTLIER -111.93 13.26 20.83 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.712 -0.676 . . . . 0.22 110.403 -179.041 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 5.4 p80 -51.11 -21.87 2.16 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 113.488 0.921 . . . . 0.55 113.488 -172.552 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -94.88 -8.89 35.9 Favored 'General case' 0 C--N 1.328 -0.359 0 O-C-N 122.261 -0.274 . . . . 0.6 111.643 -175.903 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.401 ' O ' HD21 ' A' ' 50' ' ' LEU . 87.7 mt -87.21 -58.18 0.29 Allowed Pre-proline 0 C--N 1.325 -0.495 0 N-CA-C 113.601 0.963 . . . . 0.83 113.601 -171.188 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.525 ' HB3' HG12 ' A' ' 22' ' ' VAL . 61.0 Cg_endo -68.81 156.46 65.36 Favored 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 121.406 1.404 . . . . 0.33 112.439 -168.613 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 96.67 -14.89 63.59 Favored Glycine 0 N--CA 1.446 -0.69 0 N-CA-C 109.895 -1.282 . . . . 0.31 109.895 -168.453 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -120.23 172.95 7.42 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 114.802 -0.699 . . . . 1.46 109.699 176.203 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -97.21 108.92 21.75 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.902 -0.59 . . . . 1.12 110.307 177.279 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.418 HD22 ' N ' ' A' ' 50' ' ' LEU . 2.6 mm? -99.12 131.78 44.91 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.902 -0.59 . . . . 0.38 109.763 -179.472 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.551 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 8.1 p30 -75.31 163.38 27.53 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.157 -0.474 . . . . 1.39 110.819 179.486 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.44 HD13 HD12 ' A' ' 55' ' ' LEU . 4.4 mm? -52.03 -43.03 63.54 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 123.258 0.349 . . . . 0.92 111.77 -176.755 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.1 m -56.87 -49.18 76.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.882 0.372 . . . . 0.69 110.303 178.825 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -68.0 -29.19 68.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.011 -0.54 . . . . 1.74 111.467 178.673 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.551 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 77.4 mt -65.42 -43.05 91.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.998 0.428 . . . . 1.15 110.236 176.323 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 71.0 m80 -72.35 -33.97 67.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.512 -0.313 . . . . 2.83 110.465 178.396 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.25 -30.98 72.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.076 0.465 . . . . 0.31 110.617 177.339 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.53 -42.15 98.39 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.775 -0.648 . . . . 0.21 110.74 176.225 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.61 -34.41 78.16 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.916 -0.584 . . . . 0.14 110.821 178.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.32 -36.52 82.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.915 -0.584 . . . . 0.17 111.128 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.472 ' HD2' ' CD1' ' A' ' 42' ' ' LEU . 94.0 mtt180 -57.89 -41.41 82.48 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.107 -0.497 . . . . 0.36 110.428 177.543 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.675 HG12 HD13 ' A' ' 41' ' ' LEU . 68.3 mt -78.42 -34.9 18.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.526 -0.761 . . . . 0.16 110.533 -176.722 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.438 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -59.85 -47.39 91.23 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.765 -0.731 . . . . 0.22 111.692 176.279 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -71.28 -24.25 62.12 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.505 0.193 . . . . 2.17 110.917 177.222 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.439 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 93.1 t80 -60.36 -49.41 77.7 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.116 0.484 . . . . 0.21 110.019 176.673 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 8.1 m-85 -62.2 -42.27 99.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.593 -0.73 . . . . 0.21 110.721 176.7 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLN . . . . . 0.438 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 49.8 mt-30 -61.06 -36.0 78.45 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.109 -0.496 . . . . 1.21 111.093 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -62.22 -35.47 78.98 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.1 0.476 . . . . 1.68 110.347 176.55 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.439 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 73.1 mmtt -83.23 4.75 25.53 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.845 -0.616 . . . . 0.57 110.98 -176.794 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 98.97 -2.99 58.39 Favored Glycine 0 N--CA 1.449 -0.494 0 CA-C-N 116.01 -0.541 . . . . 0.31 112.706 177.041 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 45.9 m-85 -88.58 75.18 8.35 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.336 0.588 . . . . 0.39 109.721 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 21.9 t -74.07 -23.87 18.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.561 -0.745 . . . . 0.41 110.313 -177.45 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 86.0 mt -81.31 -3.03 51.31 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.848 -0.615 . . . . 1.76 110.806 178.767 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -102.23 147.16 26.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.918 -0.583 . . . . 0.37 110.996 -178.044 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 26.1 tpt180 -160.19 136.15 8.52 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.944 -0.571 . . . . 1.8 109.73 177.534 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -99.11 140.54 33.11 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.646 -0.252 . . . . 0.18 110.438 179.026 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 46.3 p90 -137.3 155.07 49.89 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.909 0.385 . . . . 0.38 110.407 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 9.9 tt -110.84 107.07 57.93 Favored Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 109.778 -0.453 . . . . 0.39 109.778 -178.674 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo . . . . . 0 C--O 1.233 0.268 0 C-N-CA 123.004 2.469 . . . . 1.12 112.298 -178.679 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 86' ' ' GLY . . . . . 0.56 ' O ' ' HA ' ' A' ' 22' ' ' VAL . . . . . . . . 0 N--CA 1.449 -0.495 0 N-CA-C 111.78 -0.528 . . . . 0.58 111.78 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' THR . . . . . 0.424 HG23 ' HG3' ' A' ' 24' ' ' ARG . 85.5 m -72.87 120.96 19.23 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 117.191 0.496 . . . . 0.47 110.315 177.193 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 34.2 m -102.33 138.16 27.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 109.858 -0.423 . . . . 0.31 109.858 179.194 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.462 ' HD3' ' HB2' ' A' ' 28' ' ' SER . 23.0 ttm180 -107.19 129.01 54.91 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.15 0.5 . . . . 2.92 111.107 -177.476 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.453 ' HB ' HD13 ' A' ' 27' ' ' LEU . 56.6 mt -113.65 130.74 67.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.543 -0.753 . . . . 0.23 109.413 176.596 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -95.22 125.4 39.84 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.373 0.606 . . . . 1.33 110.36 -179.523 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 71.7 t -98.71 103.47 14.74 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 115.287 -0.869 . . . . 0.27 110.434 -177.893 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 52.3 tp -85.93 93.62 8.99 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.396 -0.594 . . . . 0.36 109.396 176.41 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -72.17 -18.98 61.82 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.121 -0.491 . . . . 0.49 110.423 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.157 0 CA-C-O 117.976 -1.458 . . . . 1.39 111.037 179.398 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 75.1 t . . . . . 0 N--CA 1.443 -0.781 0 N-CA-C 109.67 -0.492 . . . . 0.52 109.67 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.596 ' O ' ' HA2' ' A' ' 86' ' ' GLY . 50.8 tp -71.3 91.85 1.0 Allowed 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.574 -0.528 . . . . 0.91 109.574 176.175 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.596 HG12 ' HB3' ' A' ' 46' ' ' PRO . 61.7 t -68.71 113.54 4.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.932 0 CA-C-N 115.339 -0.846 . . . . 0.31 110.582 -178.132 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -92.84 -32.36 14.65 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.545 -0.752 . . . . 1.16 109.168 175.81 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 12.5 ptp180 -163.87 158.5 19.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.562 -0.745 . . . . 2.16 110.342 -179.362 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.56 ' CE1' HG11 ' A' ' 22' ' ' VAL . 31.9 m-85 -105.25 142.0 35.79 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.985 -0.552 . . . . 0.35 109.822 176.018 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 45.0 tp60 -123.16 128.27 49.83 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.198 -0.667 . . . . 1.37 109.198 178.469 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.52 HD13 ' HB ' ' A' ' 90' ' ' ILE . 3.9 mm? -103.36 133.39 48.5 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.124 0.488 . . . . 0.25 110.436 -177.814 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.485 ' O ' ' HA ' ' A' ' 91' ' ' GLU . 23.1 t -127.51 126.2 41.81 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.899 -0.592 . . . . 0.95 109.929 -178.332 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 100.97 -15.17 58.31 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.545 -0.836 . . . . 0.21 112.372 179.086 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 15.1 p-10 -72.38 136.21 46.06 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.754 0.312 . . . . 0.44 110.663 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.8 tpp180 -130.12 -39.28 1.37 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.248 -0.433 . . . . 2.48 110.708 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 24.0 tp60 -68.41 -40.24 81.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.012 0.434 . . . . 1.91 110.634 -179.022 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -126.59 134.66 50.75 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.027 -0.533 . . . . 0.25 109.64 179.737 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -79.31 176.19 9.91 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.943 -0.571 . . . . 0.62 111.593 -176.316 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.507 ' O ' HD13 ' A' ' 39' ' ' LEU . 6.4 m-20 -55.99 -57.01 13.9 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 116.147 -0.479 . . . . 0.59 110.991 -178.502 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.434 ' HA ' HD22 ' A' ' 39' ' ' LEU . 74.2 mtp180 -58.03 -34.77 70.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.233 -0.439 . . . . 3.66 111.502 -175.147 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 15.0 tpt180 -62.26 -46.14 90.14 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.096 -0.502 . . . . 2.3 110.684 176.699 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.546 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -78.08 -27.54 48.59 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.138 -0.483 . . . . 0.19 111.311 -178.139 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.507 HD13 ' O ' ' A' ' 35' ' ' ASP . 1.8 mp -57.18 -35.15 69.24 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.085 -0.507 . . . . 1.77 111.318 177.846 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.5 -25.51 66.13 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.042 -0.526 . . . . 0.3 111.697 178.884 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.575 HD13 HG12 ' A' ' 62' ' ' ILE . 4.0 mt -69.62 -28.06 65.61 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.155 0.503 . . . . 0.2 110.45 177.014 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.559 HD21 HD11 ' A' ' 62' ' ' ILE . 0.4 OUTLIER -106.53 13.27 28.55 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.898 -0.592 . . . . 0.22 110.164 -178.299 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 38.7 p-80 -48.86 -26.11 2.26 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.821 1.045 . . . . 0.55 113.821 -172.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -105.08 5.97 32.89 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 111.98 0.363 . . . . 0.6 111.98 -174.101 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 84.3 mt -94.67 -52.19 0.24 Allowed Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 113.84 1.052 . . . . 0.83 113.84 -173.657 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.596 ' HB3' HG12 ' A' ' 22' ' ' VAL . 71.8 Cg_endo -74.61 157.41 44.41 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 121.233 1.289 . . . . 0.33 112.254 -169.665 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 98.44 -5.9 60.86 Favored Glycine 0 N--CA 1.446 -0.648 0 N-CA-C 110.023 -1.231 . . . . 0.31 110.023 -169.267 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -121.15 170.52 9.48 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.733 -0.734 . . . . 1.46 109.085 176.253 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -100.07 107.56 19.5 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.477 -0.564 . . . . 1.12 109.477 176.395 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -101.01 122.91 44.36 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.595 -0.729 . . . . 0.38 110.376 -175.068 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.61 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 31.2 p-10 -72.26 166.3 22.71 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.553 -0.294 . . . . 1.39 110.805 177.587 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.485 ' HA ' HD12 ' A' ' 55' ' ' LEU . 4.6 mm? -48.34 -46.06 36.08 Favored 'General case' 0 C--N 1.329 -0.3 0 O-C-N 123.461 0.476 . . . . 0.92 111.585 -177.26 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.443 ' HA ' ' NE2' ' A' ' 56' ' ' HIS . 13.1 m -50.61 -53.53 30.01 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.878 -0.601 . . . . 0.69 111.113 178.605 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -72.7 -23.83 60.92 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.005 -0.543 . . . . 1.74 111.679 -178.202 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.61 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 85.5 mt -65.1 -53.0 52.18 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.579 -0.282 . . . . 1.15 110.9 179.426 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.443 ' NE2' ' HA ' ' A' ' 53' ' ' SER . 31.5 p80 -74.34 -23.46 59.04 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.396 -0.522 . . . . 2.83 111.203 -179.448 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.12 -33.85 75.23 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.989 0.423 . . . . 0.31 110.516 175.217 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.87 -34.87 76.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.782 -0.644 . . . . 0.21 110.854 176.889 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.98 -30.37 69.63 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.942 -0.572 . . . . 0.14 110.887 -179.401 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.85 -28.9 69.87 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.98 -0.555 . . . . 0.17 110.829 179.155 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 78.0 mtt180 -63.06 -39.84 95.91 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.161 0.505 . . . . 0.36 110.129 176.251 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.575 HG12 HD13 ' A' ' 41' ' ' LEU . 78.6 mt -79.05 -36.32 18.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.467 -0.788 . . . . 0.16 110.726 -177.294 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.633 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -59.94 -46.9 93.32 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.389 -0.91 . . . . 0.22 111.038 174.579 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.426 ' O ' ' HG3' ' A' ' 68' ' ' GLU . 21.6 t70 -63.51 -37.52 87.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.624 -0.288 . . . . 2.17 110.653 176.788 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.421 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 82.8 t80 -53.22 -53.5 49.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.918 -0.583 . . . . 0.21 110.834 177.003 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -59.63 -40.52 87.89 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.709 -0.678 . . . . 0.21 111.184 178.61 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLN . . . . . 0.633 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 78.4 mt-30 -61.69 -37.89 85.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.483 -0.326 . . . . 1.21 111.226 -178.451 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 64' ' ' ASP . 44.0 mt-10 -70.27 -19.67 63.1 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.058 0.456 . . . . 1.68 110.658 178.497 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.421 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 75.3 mmtt -90.74 6.47 43.98 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.022 -0.536 . . . . 0.57 110.326 177.931 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 97.54 -8.95 64.38 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 121.06 -0.59 . . . . 0.31 112.555 177.862 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -88.46 73.29 8.75 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.381 0.61 . . . . 0.39 109.8 -178.471 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 23.8 t -71.31 -28.57 32.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.45 -0.795 . . . . 0.41 110.927 -176.039 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 10.8 mp -82.4 -3.47 55.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.282 -0.417 . . . . 1.76 110.92 179.231 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -91.39 136.24 33.25 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.073 -0.512 . . . . 0.37 110.494 179.663 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 17.1 tpt180 -149.03 131.73 15.94 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.945 -0.57 . . . . 1.8 110.071 -179.467 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.75 138.36 36.02 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.029 -0.532 . . . . 0.18 109.93 176.273 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 52.9 p90 -137.45 155.49 49.26 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.555 -0.535 . . . . 0.38 109.555 179.526 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.433 HD13 ' HB3' ' A' ' 55' ' ' LEU . 3.8 tt -111.59 108.91 56.1 Favored Pre-proline 0 C--N 1.318 -0.782 0 N-CA-C 109.64 -0.504 . . . . 0.39 109.64 -179.389 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 0.49 ' HG3' ' OE2' ' A' ' 91' ' ' GLU . 36.8 Cg_endo . . . . . 0 C--O 1.234 0.319 0 C-N-CA 122.768 2.312 . . . . 1.12 112.165 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' GLY . . . . . 0.596 ' HA2' ' O ' ' A' ' 21' ' ' LEU . . . . . . . . 0 N--CA 1.445 -0.754 0 N-CA-C 111.94 -0.464 . . . . 0.58 111.94 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 12.5 m -98.32 121.16 39.91 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.772 0.32 . . . . 0.47 110.736 179.318 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.405 ' HB ' HD11 ' A' ' 78' ' ' LEU . 34.8 m -103.51 134.98 43.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 N-CA-C 109.658 -0.497 . . . . 0.31 109.658 176.407 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.484 ' O ' ' HD2' ' A' ' 79' ' ' PRO . 37.4 ttp180 -111.54 115.3 28.95 Favored 'General case' 0 C--N 1.32 -0.713 0 C-N-CA 120.554 -0.458 . . . . 2.92 110.968 -177.289 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.52 ' HB ' HD13 ' A' ' 27' ' ' LEU . 60.9 mt -101.88 126.21 55.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.789 -0.641 . . . . 0.23 109.779 177.813 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.49 ' OE2' ' HG3' ' A' ' 79' ' ' PRO . 53.8 mt-10 -94.76 125.23 39.28 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.17 0.509 . . . . 1.33 110.271 -179.652 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.402 ' CG2' HD12 ' A' ' 27' ' ' LEU . 40.2 t -101.63 100.97 11.43 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-N 115.513 -0.767 . . . . 0.27 110.588 -175.65 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 57.7 tp -86.18 90.05 8.02 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.359 -0.608 . . . . 0.36 109.359 176.88 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -68.47 -27.42 66.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.685 -0.688 . . . . 0.49 110.689 -176.633 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.153 0 CA-C-O 118.47 -1.183 . . . . 1.39 111.584 178.695 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 41.3 t . . . . . 0 N--CA 1.449 -0.487 0 N-CA-C 109.671 -0.492 . . . . 0.52 109.671 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.408 ' HB2' ' HG2' ' A' ' 49' ' ' GLU . 45.4 tp -68.51 97.52 0.78 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.189 0.518 . . . . 0.91 110.02 177.249 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.583 HG12 ' HB3' ' A' ' 46' ' ' PRO . 57.7 t -75.68 120.33 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.996 0 CA-C-N 115.43 -0.804 . . . . 0.31 109.798 178.503 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 66.7 mttt -104.13 -22.39 13.42 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.789 -0.641 . . . . 1.16 109.362 179.068 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -169.34 160.09 9.19 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.56 -0.745 . . . . 2.16 110.623 178.497 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.512 ' CE1' HG11 ' A' ' 22' ' ' VAL . 21.4 m-85 -111.31 148.06 33.75 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.742 -0.663 . . . . 0.35 109.231 176.034 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 60.4 tp60 -129.74 134.59 47.7 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 109.541 -0.54 . . . . 1.37 109.541 174.77 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.474 ' HG ' HD23 ' A' ' 38' ' ' LEU . 3.4 mm? -103.62 135.09 45.85 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 121.052 0.453 . . . . 0.25 109.995 -178.527 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.538 ' O ' ' HA ' ' A' ' 91' ' ' GLU . 45.2 m -129.35 120.49 25.67 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.902 -0.59 . . . . 0.95 110.255 177.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 111.86 -11.04 27.47 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.927 -0.654 . . . . 0.21 112.038 -179.21 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 17.7 p-10 -84.67 139.65 31.88 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.137 0.494 . . . . 0.44 110.802 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.9 tpp180 -136.67 -32.82 0.81 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.389 -0.823 . . . . 2.48 109.898 177.801 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -66.48 -40.14 89.16 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.985 -0.552 . . . . 1.91 111.307 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.425 ' CZ ' ' HG3' ' A' ' 69' ' ' LYS . 82.4 m-85 -126.34 137.39 53.46 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 110.104 -0.332 . . . . 0.25 110.104 179.197 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -72.91 168.1 19.64 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.972 -0.558 . . . . 0.62 110.923 -178.694 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.65 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 58.1 m-20 -53.61 -55.87 22.09 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 123.402 0.439 . . . . 0.59 111.326 -175.167 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.424 ' HA ' HD12 ' A' ' 39' ' ' LEU . 61.0 ttp180 -57.73 -37.48 73.64 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.354 -0.384 . . . . 3.66 111.581 -175.818 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 17.1 tpt180 -59.35 -36.0 74.91 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.107 0.479 . . . . 2.3 110.452 177.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.605 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -87.14 -24.51 24.49 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.952 -0.567 . . . . 0.19 110.929 179.57 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.65 ' HG ' ' O ' ' A' ' 35' ' ' ASP . 83.4 mt -66.07 -34.59 78.41 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.6 -0.273 . . . . 1.77 111.187 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.8 -23.46 63.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.172 -0.467 . . . . 0.3 111.311 178.709 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.614 HD13 HG12 ' A' ' 62' ' ' ILE . 5.7 mt -68.22 -29.6 68.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.026 0.441 . . . . 0.2 110.581 176.026 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.596 HD21 HD11 ' A' ' 62' ' ' ILE . 0.4 OUTLIER -107.34 13.14 27.38 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.076 -0.511 . . . . 0.22 110.347 -177.629 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 5.3 p80 -50.43 -26.32 4.91 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 113.047 0.758 . . . . 0.55 113.047 -173.114 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -97.94 0.99 47.51 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.216 0.45 . . . . 0.6 112.216 -173.599 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.476 ' O ' HD21 ' A' ' 50' ' ' LEU . 79.6 mt -93.51 -56.28 0.23 Allowed Pre-proline 0 C--N 1.324 -0.538 0 N-CA-C 113.731 1.012 . . . . 0.83 113.731 -173.778 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.583 ' HB3' HG12 ' A' ' 22' ' ' VAL . 87.5 Cg_endo -74.54 154.8 45.11 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 121.35 1.367 . . . . 0.33 112.587 -167.291 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 103.38 -8.68 52.74 Favored Glycine 0 N--CA 1.447 -0.583 0 N-CA-C 109.95 -1.26 . . . . 0.31 109.95 -169.307 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -122.87 167.5 13.46 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 114.637 -0.782 . . . . 1.46 109.458 176.174 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.408 ' HG2' ' HB2' ' A' ' 21' ' ' LEU . 39.4 mt-10 -98.86 89.75 4.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.532 0.682 . . . . 1.12 109.502 176.673 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.476 HD21 ' O ' ' A' ' 45' ' ' LEU . 1.9 mm? -79.52 135.69 36.7 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.739 -1.119 . . . . 0.38 109.946 -177.666 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -81.51 161.48 23.59 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.215 -0.661 . . . . 1.39 109.215 175.2 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -46.67 -40.49 13.26 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 113.137 0.791 . . . . 0.92 113.137 -173.061 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.7 m -58.1 -38.06 75.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.931 0.396 . . . . 0.69 111.044 -178.556 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -72.49 -38.34 68.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.072 -0.513 . . . . 1.74 110.827 178.568 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.463 ' HB3' HD13 ' A' ' 78' ' ' LEU . 9.8 mp -60.56 -44.64 95.93 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.261 -0.427 . . . . 1.15 111.421 176.779 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 73.4 m80 -68.35 -31.79 71.42 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.893 -0.323 . . . . 2.83 110.73 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.13 -28.89 69.74 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.23 0.538 . . . . 0.31 110.453 177.885 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.81 -39.58 94.72 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.519 -0.764 . . . . 0.21 111.06 177.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.22 -34.72 78.66 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.858 -0.61 . . . . 0.14 111.231 -178.797 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.88 -35.87 82.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 0.17 110.947 -179.453 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 -58.82 -38.77 79.38 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.879 -0.6 . . . . 0.36 110.446 178.588 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.614 HG12 HD13 ' A' ' 41' ' ' LEU . 66.2 mt -79.52 -37.77 18.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.285 -0.871 . . . . 0.16 110.871 -175.094 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -61.5 -44.65 97.72 Favored Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 120.389 -0.91 . . . . 0.22 111.65 177.352 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -73.96 -24.23 59.61 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.619 0.247 . . . . 2.17 110.874 178.112 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.468 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 91.3 t80 -59.78 -48.8 80.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.121 0.486 . . . . 0.21 109.862 174.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' TYR . . . . . 0.447 ' HB3' ' HB2' ' A' ' 71' ' ' TYR . 10.0 m-85 -59.82 -46.03 90.53 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.463 -0.79 . . . . 0.21 111.173 177.766 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 17.6 mt-30 -59.83 -38.61 82.54 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.464 -0.334 . . . . 1.21 111.083 -179.0 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -61.91 -35.58 78.8 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.554 -0.535 . . . . 1.68 109.554 178.57 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.468 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 69.6 mmtt -82.58 2.6 32.39 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.837 -0.619 . . . . 0.57 111.113 -179.314 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 106.51 -7.78 39.91 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 121.047 -0.597 . . . . 0.31 112.936 175.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' TYR . . . . . 0.447 ' HB2' ' HB3' ' A' ' 66' ' ' TYR . 70.5 m-85 -89.26 73.68 8.01 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.153 0.502 . . . . 0.39 109.805 -179.702 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 43.8 t -69.04 -29.02 41.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.779 -0.646 . . . . 0.41 111.204 -175.382 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 67.3 mt -91.38 22.68 3.78 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.026 0.441 . . . . 1.76 111.042 177.736 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.416 ' HB1' ' HA ' ' A' ' 94' ' ' GLU . . . -121.22 120.29 34.77 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.068 -0.515 . . . . 0.37 110.547 178.778 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 19.5 mmm180 -128.95 170.82 12.97 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.073 -0.512 . . . . 1.8 109.739 177.71 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -133.18 132.75 41.93 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 109.707 -0.479 . . . . 0.18 109.707 178.056 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 51.0 p90 -129.3 143.39 50.83 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.847 0.356 . . . . 0.38 110.171 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.463 HD13 ' HB3' ' A' ' 55' ' ' LEU . 6.6 tt -93.7 107.43 27.17 Favored Pre-proline 0 C--N 1.319 -0.732 0 N-CA-C 108.948 -0.76 . . . . 0.39 108.948 178.841 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 0.427 ' HD2' ' HA ' ' A' ' 78' ' ' LEU . 12.4 Cg_endo . . . . . 0 C--N 1.348 0.546 0 C-N-CA 123.534 2.823 . . . . 1.12 112.881 -175.766 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.838 0 N-CA-C 112.352 -0.299 . . . . 0.58 112.352 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 19.6 m -91.91 120.66 32.79 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 120.925 0.393 . . . . 0.47 110.627 179.251 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 31.0 m -108.53 132.52 56.19 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 N-CA-C 109.258 -0.645 . . . . 0.31 109.258 175.195 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.49 ' HD3' ' OG ' ' A' ' 28' ' ' SER . 27.2 ttm180 -109.32 128.79 55.37 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 121.13 0.49 . . . . 2.92 110.9 -176.233 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 59.5 mt -113.45 135.06 54.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.399 -0.819 . . . . 0.23 109.696 178.709 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.538 ' HA ' ' O ' ' A' ' 28' ' ' SER . 45.8 mt-10 -94.91 122.46 37.56 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.227 0.537 . . . . 1.33 110.318 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 60.0 t -98.35 123.75 51.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 115.493 -0.776 . . . . 0.27 110.103 -178.751 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 47.6 tp -108.97 94.8 5.24 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 109.315 -0.624 . . . . 0.36 109.315 178.542 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.416 ' HA ' ' HB1' ' A' ' 74' ' ' ALA . 48.1 mt-10 -77.4 2.56 15.64 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.628 -0.715 . . . . 0.49 111.035 -174.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.782 0 CA-C-O 118.818 -0.99 . . . . 1.39 112.08 177.212 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 50.0 t . . . . . 0 N--CA 1.449 -0.494 0 N-CA-C 109.787 -0.449 . . . . 0.52 109.787 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.494 ' HA ' ' HA ' ' A' ' 49' ' ' GLU . 55.3 tp -65.66 115.76 6.17 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.021 0.439 . . . . 0.91 110.247 177.729 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.591 HG12 ' HB3' ' A' ' 46' ' ' PRO . 48.5 t -95.54 121.67 46.3 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 CA-C-N 115.842 -0.617 . . . . 0.31 110.353 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 80.2 mttt -107.35 -27.22 10.61 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.589 -0.732 . . . . 1.16 109.704 177.203 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.8 ptp180 -161.74 161.71 29.39 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.837 -0.619 . . . . 2.16 110.876 177.303 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.521 ' CE2' ' HG ' ' A' ' 42' ' ' LEU . 29.2 m-85 -110.72 137.04 48.9 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.715 -0.675 . . . . 0.35 109.799 176.913 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 19.2 tp60 -119.12 129.45 55.05 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.409 -0.589 . . . . 1.37 109.409 177.789 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.534 HD13 ' HB ' ' A' ' 90' ' ' ILE . 3.8 mm? -103.02 132.68 49.11 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.259 0.552 . . . . 0.25 110.113 -179.63 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 48.1 t -121.71 122.16 38.92 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.495 -0.775 . . . . 0.95 109.667 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 103.79 -16.11 51.53 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.625 -0.798 . . . . 0.21 112.331 179.022 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 20.7 p-10 -69.18 126.53 30.08 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.051 0.453 . . . . 0.44 110.367 179.02 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.576 ' NE ' ' HA ' ' A' ' 31' ' ' ARG . 1.9 mmp_? -125.97 -34.64 2.55 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.266 -0.425 . . . . 2.48 110.678 179.435 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.431 ' HG2' ' CZ ' ' A' ' 71' ' ' TYR . 57.5 tp60 -75.17 -38.29 60.94 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.258 -0.428 . . . . 1.91 110.598 -179.697 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -123.44 146.91 47.65 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.605 -0.517 . . . . 0.25 109.605 178.515 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -92.41 169.71 10.35 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.27 -0.423 . . . . 0.62 111.233 -176.906 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.527 ' O ' HD13 ' A' ' 39' ' ' LEU . 4.1 m-20 -56.07 -52.87 62.74 Favored 'General case' 0 CA--C 1.517 -0.323 0 O-C-N 123.258 0.349 . . . . 0.59 110.616 -177.579 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 61.9 ttp180 -52.79 -39.61 62.46 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.307 -0.406 . . . . 3.66 111.1 -177.694 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 15.4 tpt180 -63.75 -50.09 70.45 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.925 -0.58 . . . . 2.3 111.094 178.4 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.528 HD23 ' HG ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -73.56 -26.79 61.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.844 0.354 . . . . 0.19 111.261 -176.736 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.527 HD13 ' O ' ' A' ' 35' ' ' ASP . 2.3 mp -60.14 -32.93 71.48 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.154 -0.475 . . . . 1.77 111.781 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.54 -25.58 66.25 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.146 -0.479 . . . . 0.3 111.452 179.142 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.523 HD13 HG12 ' A' ' 62' ' ' ILE . 1.7 mt -70.12 -27.49 64.62 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.888 0.375 . . . . 0.2 110.431 176.826 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.616 HD21 HD11 ' A' ' 62' ' ' ILE . 0.4 OUTLIER -107.55 13.32 26.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.94 -0.573 . . . . 0.22 110.447 -177.184 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 6.5 p80 -51.92 -24.77 6.85 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.798 -0.637 . . . . 0.55 112.554 -173.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -101.02 3.38 41.43 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.369 0.507 . . . . 0.6 112.369 -172.873 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 86.9 mt -95.53 -54.87 0.22 Allowed Pre-proline 0 C--N 1.323 -0.556 0 N-CA-C 113.932 1.086 . . . . 0.83 113.932 -172.89 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.591 ' HB3' HG12 ' A' ' 22' ' ' VAL . 75.3 Cg_endo -73.41 161.38 42.69 Favored 'Trans proline' 0 C--N 1.351 0.697 0 C-N-CA 121.318 1.345 . . . . 0.33 112.678 -168.205 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 100.87 3.98 54.63 Favored Glycine 0 N--CA 1.449 -0.477 0 N-CA-C 110.594 -1.002 . . . . 0.31 110.594 -170.275 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -143.07 170.23 16.11 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.858 -0.671 . . . . 1.46 109.282 177.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.494 ' HA ' ' HA ' ' A' ' 21' ' ' LEU . 35.9 mt-10 -98.46 96.04 7.73 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.384 0.611 . . . . 1.12 109.679 178.235 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.42 ' HA ' ' OE1' ' A' ' 54' ' ' GLN . 2.7 mm? -83.72 140.77 31.91 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.068 -0.969 . . . . 0.38 109.604 -178.216 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -88.87 161.55 16.63 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.484 -0.561 . . . . 1.39 109.484 178.901 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -45.08 -43.4 9.52 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.462 0.912 . . . . 0.92 113.462 -172.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.658 ' HA ' ' NE2' ' A' ' 56' ' ' HIS . 50.0 m -58.61 -37.12 75.17 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.929 0.395 . . . . 0.69 110.971 179.562 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.42 ' OE1' ' HA ' ' A' ' 50' ' ' LEU . 99.5 mt-30 -72.2 -38.67 69.0 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.656 -0.702 . . . . 1.74 110.56 179.043 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.655 ' HB3' HD13 ' A' ' 78' ' ' LEU . 9.4 mp -58.87 -54.78 43.23 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 112.62 0.6 . . . . 1.15 112.62 179.206 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.658 ' NE2' ' HA ' ' A' ' 53' ' ' SER . 32.7 p80 -72.76 -23.48 60.83 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.014 -0.674 . . . . 2.83 111.294 -177.579 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.07 -32.94 73.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.288 0.565 . . . . 0.31 109.976 173.656 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.415 ' HB3' ' O ' ' A' ' 55' ' ' LEU . . . -63.63 -37.79 88.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.392 -0.822 . . . . 0.21 110.638 175.393 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.07 -34.03 77.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.733 -0.667 . . . . 0.14 110.686 179.182 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.58 -35.0 78.12 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.929 -0.578 . . . . 0.17 111.013 178.446 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 88.6 mtt180 -59.06 -42.38 90.18 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.24 0.543 . . . . 0.36 109.976 177.149 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.616 HD11 HD21 ' A' ' 42' ' ' LEU . 80.9 mt -77.6 -37.39 24.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.398 -0.819 . . . . 0.16 110.3 -177.349 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.606 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -57.55 -46.48 91.99 Favored Glycine 0 N--CA 1.442 -0.909 0 CA-C-N 115.447 -0.797 . . . . 0.22 111.583 176.168 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -68.97 -33.51 73.8 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.61 0.243 . . . . 2.17 110.395 177.844 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.581 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 76.8 t80 -54.68 -49.38 70.79 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.016 -0.538 . . . . 0.21 110.508 177.577 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -62.12 -47.16 85.85 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.004 -0.544 . . . . 0.21 111.159 178.23 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLN . . . . . 0.606 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 74.7 mt-30 -57.48 -41.72 81.2 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.359 0.599 . . . . 1.21 110.45 179.49 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -58.37 -38.55 77.48 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.135 -0.939 . . . . 1.68 110.798 178.003 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.581 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 68.9 mmtt -82.33 2.88 30.1 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.937 -0.574 . . . . 0.57 111.058 -177.302 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.31 -14.6 30.57 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 121.017 -0.611 . . . . 0.31 112.683 176.551 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' TYR . . . . . 0.431 ' CZ ' ' HG2' ' A' ' 32' ' ' GLN . 60.7 m-85 -83.33 69.49 9.99 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.182 0.515 . . . . 0.39 110.239 -177.37 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 41.1 t -69.89 -23.95 26.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.776 -0.647 . . . . 0.41 110.841 -177.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 95.0 mt -83.04 -3.2 57.0 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 1.76 110.811 178.25 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -101.08 144.12 30.37 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.914 -0.585 . . . . 0.37 110.867 -178.281 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.401 HH11 ' NE2' ' A' ' 67' ' ' GLN . 20.7 tpt180 -154.33 137.33 15.49 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.015 -0.539 . . . . 1.8 110.033 178.022 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -102.41 135.49 43.94 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.271 -0.422 . . . . 0.18 110.141 177.836 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 48.7 p90 -135.6 151.06 49.9 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.722 -0.473 . . . . 0.38 109.722 179.436 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.655 HD13 ' HB3' ' A' ' 55' ' ' LEU . 6.7 tt -107.54 109.47 62.53 Favored Pre-proline 0 C--N 1.32 -0.704 0 N-CA-C 109.5 -0.556 . . . . 0.39 109.5 -179.487 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo . . . . . 0 N--CA 1.46 -0.469 0 C-N-CA 122.609 2.206 . . . . 1.12 112.06 179.84 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.816 0 N-CA-C 112.469 -0.252 . . . . 0.58 112.469 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 20.4 m -117.81 120.77 38.92 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 120.866 0.365 . . . . 0.47 110.802 -177.245 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 34.3 m -103.1 137.02 32.93 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 109.638 -0.504 . . . . 0.31 109.638 176.119 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 30.4 ttm180 -113.58 117.6 32.07 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.122 0.486 . . . . 2.92 110.778 -177.678 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.534 ' HB ' HD13 ' A' ' 27' ' ' LEU . 70.0 mt -103.83 129.73 55.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.465 -0.789 . . . . 0.23 109.605 177.609 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -94.7 123.61 38.24 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.147 0.499 . . . . 1.33 110.266 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 40.6 t -101.8 108.28 23.38 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 115.552 -0.749 . . . . 0.27 110.256 -178.211 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 62.0 tp -90.11 96.57 10.73 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.236 -0.653 . . . . 0.36 109.236 175.52 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.444 ' OE1' ' HB2' ' A' ' 31' ' ' ARG . 43.6 mt-10 -76.68 -31.13 57.06 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.016 0.436 . . . . 0.49 110.461 -177.219 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.869 0 CA-C-O 118.244 -1.309 . . . . 1.39 111.562 178.246 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 38.3 t . . . . . 0 N--CA 1.446 -0.644 0 N-CA-C 109.61 -0.515 . . . . 0.52 109.61 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.431 ' O ' ' HA2' ' A' ' 86' ' ' GLY . 42.8 tp -71.99 90.66 1.17 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.233 0.539 . . . . 0.91 110.194 176.417 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.544 HG12 ' HB3' ' A' ' 46' ' ' PRO . 56.7 t -72.85 129.33 35.99 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 CA-C-N 115.27 -0.877 . . . . 0.31 110.77 -177.314 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 54.5 mttp -112.48 -25.15 9.32 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.654 -0.703 . . . . 1.16 109.586 177.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 13.1 ptp180 -163.22 157.43 20.36 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.791 -0.64 . . . . 2.16 110.811 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.51 ' CE2' ' HG ' ' A' ' 42' ' ' LEU . 22.4 m-85 -111.27 149.03 31.63 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.664 -0.698 . . . . 0.35 109.915 177.561 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.406 ' O ' ' HA ' ' A' ' 89' ' ' ARG . 59.6 tp60 -130.27 135.38 48.05 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 109.454 -0.573 . . . . 1.37 109.454 176.302 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.47 ' HG ' HD23 ' A' ' 38' ' ' LEU . 3.6 mm? -103.73 143.43 32.8 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.004 0.431 . . . . 0.25 110.058 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 28.5 t -128.83 133.88 48.14 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.95 -0.568 . . . . 0.95 109.996 -179.607 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 84.74 -3.77 86.17 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.714 -0.755 . . . . 0.21 112.575 178.725 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 20.6 p-10 -76.06 130.36 38.23 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.964 0.411 . . . . 0.44 110.954 179.305 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.479 ' NE ' ' HA ' ' A' ' 31' ' ' ARG . 4.7 tpm_? -137.15 -33.42 0.75 Allowed 'General case' 0 C--N 1.321 -0.63 0 CA-C-N 116.291 -0.413 . . . . 2.48 110.639 178.419 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 86.7 mm-40 -68.14 -36.8 80.27 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.207 -0.452 . . . . 1.91 110.396 177.712 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.44 ' CZ ' ' HG3' ' A' ' 69' ' ' LYS . 86.7 m-85 -129.48 137.41 50.82 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.084 -0.507 . . . . 0.25 109.993 176.371 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.605 ' OD1' ' HB3' ' A' ' 36' ' ' ARG . 4.1 p30 -74.61 164.26 26.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.122 -0.49 . . . . 0.62 110.839 -179.414 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.675 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 3.8 m-20 -50.46 -55.24 16.79 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 123.393 0.433 . . . . 0.59 110.804 -177.553 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.605 ' HB3' ' OD1' ' A' ' 34' ' ' ASP . 6.0 ttp180 -46.25 -48.17 17.95 Favored 'General case' 0 C--N 1.33 -0.278 0 O-C-N 123.814 0.696 . . . . 3.66 111.999 178.385 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -59.04 -35.46 73.35 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.964 -0.562 . . . . 2.3 110.96 -178.321 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.593 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -87.22 -26.23 23.62 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.21 -0.45 . . . . 0.19 111.085 -179.913 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.675 ' HG ' ' O ' ' A' ' 35' ' ' ASP . 92.9 mt -62.98 -34.39 77.41 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.763 0.316 . . . . 1.77 111.204 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.29 -23.46 65.71 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.027 -0.533 . . . . 0.3 111.305 178.635 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.604 HD13 HG12 ' A' ' 62' ' ' ILE . 5.2 mt -70.0 -26.98 64.33 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.864 0.364 . . . . 0.2 110.659 177.366 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.627 HD21 HD11 ' A' ' 62' ' ' ILE . 0.4 OUTLIER -109.08 12.9 24.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.237 -0.438 . . . . 0.22 110.39 -178.026 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 27.6 p-80 -51.39 -26.55 8.04 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.768 0.655 . . . . 0.55 112.768 -174.371 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -104.84 11.82 33.3 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.137 0.421 . . . . 0.6 112.137 -173.54 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 81.5 mt -99.56 -54.54 0.17 Allowed Pre-proline 0 C--N 1.324 -0.501 0 N-CA-C 113.723 1.008 . . . . 0.83 113.723 -176.039 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.544 ' HB3' HG12 ' A' ' 22' ' ' VAL . 72.5 Cg_endo -73.37 165.75 31.71 Favored 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 121.324 1.349 . . . . 0.33 112.845 -168.441 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 97.74 -12.42 64.38 Favored Glycine 0 N--CA 1.446 -0.682 0 N-CA-C 110.371 -1.092 . . . . 0.31 110.371 -171.323 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 53.3 mt-30 -117.11 175.06 5.77 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.66 -0.77 . . . . 1.46 109.559 176.839 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -99.5 101.18 12.34 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 121.283 0.563 . . . . 1.12 109.816 174.358 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.51 131.97 35.28 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.189 -0.914 . . . . 0.38 110.097 -176.16 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.643 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 33.4 p30 -80.84 170.52 16.18 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 121.124 -0.23 . . . . 1.39 110.452 178.984 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.508 ' HA ' HD12 ' A' ' 55' ' ' LEU . 4.4 mm? -50.73 -43.38 58.06 Favored 'General case' 0 N--CA 1.465 0.298 0 O-C-N 123.141 0.275 . . . . 0.92 111.235 -177.535 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.49 ' HA ' ' NE2' ' A' ' 56' ' ' HIS . 14.9 m -54.39 -55.71 25.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.021 -0.536 . . . . 0.69 110.619 178.375 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -62.62 -34.24 76.64 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.831 -0.622 . . . . 1.74 111.223 -179.629 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.643 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 89.8 mt -59.65 -57.0 14.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 1.15 111.167 179.566 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.49 ' NE2' ' HA ' ' A' ' 53' ' ' SER . 34.5 p80 -74.0 -23.86 59.5 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.314 -0.554 . . . . 2.83 110.867 -178.407 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.1 -30.95 72.0 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.98 0.419 . . . . 0.31 110.491 174.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.61 -38.94 86.35 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.885 -0.598 . . . . 0.21 110.335 174.692 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.56 -32.93 74.03 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.622 -0.717 . . . . 0.14 110.841 179.179 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.91 -32.16 73.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.965 -0.562 . . . . 0.17 110.897 178.602 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 74.8 mtt180 -62.68 -39.51 94.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.915 -0.584 . . . . 0.36 110.175 176.266 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.627 HD11 HD21 ' A' ' 42' ' ' LEU . 68.7 mt -79.8 -37.29 18.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.453 -0.794 . . . . 0.16 110.99 -175.338 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.571 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -59.66 -47.88 88.75 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.615 -0.803 . . . . 0.22 111.556 177.39 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.422 ' O ' ' HG3' ' A' ' 68' ' ' GLU . 28.5 t70 -68.86 -31.62 70.69 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.731 0.301 . . . . 2.17 110.57 178.556 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.458 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 90.7 t80 -57.54 -51.37 69.75 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.092 -0.504 . . . . 0.21 110.267 176.982 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' TYR . . . . . 0.429 ' HB3' ' HB2' ' A' ' 71' ' ' TYR . 4.3 m-85 -57.65 -42.54 83.65 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.537 -0.756 . . . . 0.21 110.749 177.162 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLN . . . . . 0.571 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 91.0 mt-30 -62.07 -35.32 78.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 1.21 111.347 -178.77 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.422 ' HG3' ' O ' ' A' ' 64' ' ' ASP . 43.6 mt-10 -71.19 -23.31 62.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.873 0.368 . . . . 1.68 110.837 179.309 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.458 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 74.5 mmtt -91.41 1.88 56.8 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.061 -0.518 . . . . 0.57 110.676 -179.583 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.25 -14.17 28.26 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.734 -0.745 . . . . 0.31 112.86 176.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' TYR . . . . . 0.429 ' HB2' ' HB3' ' A' ' 66' ' ' TYR . 55.0 m-85 -87.06 67.66 9.8 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.243 0.544 . . . . 0.39 109.852 -178.762 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 22.0 t -68.93 -23.43 27.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.735 -0.666 . . . . 0.41 110.889 -175.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 97.8 mt -86.09 -8.54 57.82 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.04 -0.527 . . . . 1.76 111.111 179.285 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -82.98 140.45 32.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.17 -0.468 . . . . 0.37 110.574 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 5.0 tpp180 -144.54 131.71 20.59 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.166 -0.47 . . . . 1.8 109.884 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -102.51 136.28 42.62 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.97 -0.381 . . . . 0.18 109.97 177.906 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 52.8 p90 -137.75 151.54 48.27 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.869 -0.419 . . . . 0.38 109.869 179.359 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.433 ' HA ' ' HD2' ' A' ' 79' ' ' PRO . 7.1 tt -105.89 113.04 64.2 Favored Pre-proline 0 C--N 1.32 -0.681 0 N-CA-C 109.908 -0.404 . . . . 0.39 109.908 -178.509 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 0.455 ' HD2' ' O ' ' A' ' 89' ' ' ARG . 35.3 Cg_endo . . . . . 0 C--O 1.234 0.317 0 C-N-CA 122.748 2.299 . . . . 1.12 111.459 176.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' GLY . . . . . 0.431 ' HA2' ' O ' ' A' ' 21' ' ' LEU . . . . . . . . 0 N--CA 1.444 -0.831 0 N-CA-C 111.572 -0.611 . . . . 0.58 111.572 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 24.3 m -96.33 120.87 37.42 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-O 120.84 0.352 . . . . 0.47 110.676 177.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 35.0 m -111.4 134.94 52.16 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 N-CA-C 109.201 -0.666 . . . . 0.31 109.201 175.014 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.455 ' O ' ' HD2' ' A' ' 79' ' ' PRO . 15.6 ttp180 -113.11 131.0 56.0 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 120.177 -0.609 . . . . 2.92 110.666 -177.807 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 72.4 mt -112.63 131.05 65.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 115.354 -0.839 . . . . 0.23 109.696 179.034 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -94.07 126.33 39.23 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.43 0.633 . . . . 1.33 109.986 179.468 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 66.0 t -100.76 101.45 12.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 CA-C-N 115.161 -0.927 . . . . 0.27 110.562 -176.273 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 63.1 tp -83.93 92.39 7.8 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.898 -0.779 . . . . 0.36 108.898 175.019 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 57.8 mt-10 -69.47 -17.33 63.61 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.217 -0.447 . . . . 0.49 111.017 -175.666 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.787 -1.007 . . . . 1.39 112.643 174.656 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 23.8 t . . . . . 0 N--CA 1.451 -0.393 0 N-CA-C 110.24 -0.281 . . . . 0.52 110.24 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 56.8 tp -71.44 106.07 3.8 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.385 0.612 . . . . 0.91 109.609 174.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.518 HG12 ' HB3' ' A' ' 46' ' ' PRO . 56.4 t -91.64 118.72 37.62 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 CA-C-N 115.435 -0.802 . . . . 0.31 109.973 179.789 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -98.08 -26.03 14.74 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 109.111 -0.7 . . . . 1.16 109.111 174.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 13.9 ptp180 -162.75 162.87 26.92 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.369 -0.832 . . . . 2.16 110.712 -178.329 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.476 ' CE2' ' HG ' ' A' ' 42' ' ' LEU . 29.6 m-85 -111.12 154.87 23.68 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.694 -0.685 . . . . 0.35 109.967 177.718 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.489 ' O ' ' HA ' ' A' ' 89' ' ' ARG . 56.5 tp60 -137.3 140.1 41.33 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 109.065 -0.717 . . . . 1.37 109.065 177.497 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.514 ' HG ' HD23 ' A' ' 38' ' ' LEU . 3.8 mm? -108.36 152.16 25.02 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 120.935 0.397 . . . . 0.25 110.403 -179.215 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 23.1 t -132.9 125.83 30.77 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.127 -0.488 . . . . 0.95 110.254 177.905 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 90.86 -2.09 79.2 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.8 -0.714 . . . . 0.21 113.009 175.832 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 14.7 p-10 -74.04 123.05 23.64 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.183 0.516 . . . . 0.44 111.072 179.176 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 29.8 mmm180 -121.43 -33.57 3.62 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.828 -0.624 . . . . 2.48 110.514 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 84.9 mm-40 -70.92 -42.25 70.13 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.007 -0.542 . . . . 1.91 110.551 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 86.2 m-85 -128.68 137.08 51.43 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.033 -0.53 . . . . 0.25 109.749 179.446 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.649 ' OD2' ' HB3' ' A' ' 36' ' ' ARG . 4.6 p-10 -79.72 167.5 20.56 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.234 -0.439 . . . . 0.62 111.028 -177.636 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.461 ' O ' HD13 ' A' ' 39' ' ' LEU . 2.8 m-20 -54.22 -52.8 60.15 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 123.084 0.24 . . . . 0.59 110.959 -176.836 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.649 ' HB3' ' OD2' ' A' ' 34' ' ' ASP . 8.7 ttp180 -45.25 -45.51 11.95 Favored 'General case' 0 C--N 1.327 -0.394 0 O-C-N 123.763 0.664 . . . . 3.66 111.536 177.403 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 22.0 tpt85 -65.21 -42.88 93.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.803 -0.635 . . . . 2.3 111.476 -178.497 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.572 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -79.91 -24.9 40.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.723 0.297 . . . . 0.19 111.377 -177.545 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.461 HD13 ' O ' ' A' ' 35' ' ' ASP . 2.2 mp -62.15 -36.37 81.6 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.339 -0.392 . . . . 1.77 111.328 178.506 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.59 -26.26 66.83 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.062 -0.517 . . . . 0.3 111.051 178.597 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.592 HD13 HG12 ' A' ' 62' ' ' ILE . 5.9 mt -64.88 -30.51 71.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.008 0.432 . . . . 0.2 110.98 176.165 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.61 HD21 HD11 ' A' ' 62' ' ' ILE . 0.4 OUTLIER -105.36 12.86 31.16 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.139 -0.482 . . . . 0.22 110.271 -177.713 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 7.1 p80 -47.3 -29.83 2.73 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.5 0.926 . . . . 0.55 113.5 -173.879 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -104.2 11.25 35.22 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.246 0.461 . . . . 0.6 112.246 -174.23 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 80.0 mt -97.08 -53.03 0.21 Allowed Pre-proline 0 C--N 1.323 -0.573 0 N-CA-C 113.591 0.96 . . . . 0.83 113.591 -176.353 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.518 ' HB3' HG12 ' A' ' 22' ' ' VAL . 77.6 Cg_endo -75.9 175.59 11.12 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 121.428 1.418 . . . . 0.33 113.023 -168.956 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 89.18 -6.78 83.26 Favored Glycine 0 N--CA 1.445 -0.712 0 N-CA-C 110.629 -0.989 . . . . 0.31 110.629 -172.003 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -124.75 175.48 7.21 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.979 -0.611 . . . . 1.46 109.72 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -100.59 96.36 7.31 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.402 0.62 . . . . 1.12 109.83 176.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.445 HD23 ' CG2' ' A' ' 22' ' ' VAL . 2.7 mm? -84.42 134.55 34.46 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.016 -0.993 . . . . 0.38 110.231 -174.5 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.591 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 8.5 p30 -85.03 171.37 12.13 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.727 -0.472 . . . . 1.39 109.727 177.797 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.524 ' HA ' HD12 ' A' ' 55' ' ' LEU . 4.0 mm? -48.8 -45.17 39.87 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.512 0.56 . . . . 0.92 112.512 -175.473 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.567 ' HA ' ' NE2' ' A' ' 56' ' ' HIS . 69.1 m -57.46 -46.0 84.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.622 0.249 . . . . 0.69 110.929 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.405 ' NE2' HD12 ' A' ' 50' ' ' LEU . 55.2 mt-30 -66.42 -32.64 74.14 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.982 0.42 . . . . 1.74 110.522 179.546 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.591 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 79.7 mt -62.67 -55.58 25.57 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.766 -0.652 . . . . 1.15 111.279 -178.883 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.567 ' NE2' ' HA ' ' A' ' 53' ' ' SER . 34.0 p80 -74.76 -23.42 58.53 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.324 -0.55 . . . . 2.83 111.184 -178.094 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.14 -31.97 70.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.184 0.516 . . . . 0.31 110.192 173.747 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.33 -45.57 92.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.624 -0.716 . . . . 0.21 110.477 175.265 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.48 -34.99 78.98 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.662 -0.699 . . . . 0.14 110.82 179.041 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.3 -42.51 99.42 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.872 -0.604 . . . . 0.17 110.93 178.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 77.2 mtt180 -54.19 -40.9 67.98 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 121.183 0.516 . . . . 0.36 110.642 177.153 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.61 HD11 HD21 ' A' ' 42' ' ' LEU . 67.4 mt -78.45 -37.5 21.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.53 -0.759 . . . . 0.16 110.579 -176.938 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.458 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -60.32 -42.11 98.68 Favored Glycine 0 N--CA 1.442 -0.913 0 CA-C-N 115.651 -0.704 . . . . 0.22 111.89 177.818 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -75.98 -26.48 56.82 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.54 0.209 . . . . 2.17 110.551 177.075 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -59.97 -50.33 74.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.936 0.398 . . . . 0.21 110.277 178.016 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' TYR . . . . . 0.444 ' HB3' ' HB2' ' A' ' 71' ' ' TYR . 10.3 m-85 -58.58 -44.97 89.98 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.729 -0.669 . . . . 0.21 110.453 176.193 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLN . . . . . 0.458 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 79.7 mt-30 -59.97 -38.06 81.44 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.966 -0.561 . . . . 1.21 111.218 -179.758 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -69.42 -26.59 64.69 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.152 -0.477 . . . . 1.68 110.632 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -88.97 4.78 46.98 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.004 -0.544 . . . . 0.57 110.932 178.863 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 106.32 -14.96 43.22 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.819 -0.705 . . . . 0.31 112.881 176.483 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' TYR . . . . . 0.444 ' HB2' ' HB3' ' A' ' 66' ' ' TYR . 80.5 m-85 -82.3 71.56 9.36 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.191 0.52 . . . . 0.39 110.186 -178.448 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 40.5 t -67.77 -28.69 42.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.629 -0.714 . . . . 0.41 110.992 -176.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 43.4 tp -78.84 -8.93 59.26 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.038 -0.528 . . . . 1.76 110.908 -179.274 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -93.15 141.07 28.82 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.076 0.465 . . . . 0.37 111.241 -177.127 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 30.3 tpt180 -151.28 131.5 13.6 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.959 -0.564 . . . . 1.8 109.603 177.837 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.22 138.16 35.9 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.378 -0.374 . . . . 0.18 110.203 178.874 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 49.0 p90 -135.78 142.59 44.95 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.415 -0.357 . . . . 0.38 110.053 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.8 tt -95.79 115.42 65.51 Favored Pre-proline 0 C--N 1.318 -0.784 0 N-CA-C 109.211 -0.663 . . . . 0.39 109.211 179.627 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 0.403 ' HD2' ' O ' ' A' ' 89' ' ' ARG . 55.7 Cg_endo . . . . . 0 N--CA 1.462 -0.374 0 C-N-CA 122.39 2.06 . . . . 1.12 111.796 178.315 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.688 0 N-CA-C 112.077 -0.409 . . . . 0.58 112.077 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 25.8 m -127.04 121.67 32.23 Favored 'General case' 0 C--N 1.322 -0.595 0 O-C-N 122.692 -0.299 . . . . 0.47 110.717 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 31.7 m -102.84 131.66 50.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 N-CA-C 109.716 -0.476 . . . . 0.31 109.716 175.865 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.489 ' HA ' ' O ' ' A' ' 26' ' ' GLN . 51.8 ttt180 -110.52 130.87 55.46 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.268 0.556 . . . . 2.92 110.901 -177.316 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.421 ' HB ' HD13 ' A' ' 27' ' ' LEU . 67.2 mt -110.86 134.34 53.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.046 -0.979 . . . . 0.23 109.868 -179.249 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -94.14 123.75 37.72 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.342 0.591 . . . . 1.33 110.13 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 57.9 t -98.63 110.6 26.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 115.367 -0.833 . . . . 0.27 110.501 -176.569 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 56.2 tp -94.35 95.13 8.69 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.356 -0.609 . . . . 0.36 109.356 176.509 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 55.7 mt-10 -78.56 -9.9 59.52 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.895 -0.593 . . . . 0.49 110.816 -176.526 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.934 -0.926 . . . . 1.39 111.723 178.189 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 60.3 t . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.768 0.318 . . . . 0.52 110.555 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.453 ' HA ' ' HA ' ' A' ' 49' ' ' GLU . 51.8 tp -69.46 101.37 1.56 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.047 0.451 . . . . 0.91 110.478 177.427 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.554 HG12 ' HB3' ' A' ' 46' ' ' PRO . 60.8 t -80.68 126.54 39.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.704 -0.68 . . . . 0.31 110.172 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -108.52 -35.49 6.46 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.98 -0.555 . . . . 1.16 110.289 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 12.6 ptp180 -155.11 160.96 41.36 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.231 -0.44 . . . . 2.16 111.016 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.561 ' CE2' ' HG ' ' A' ' 42' ' ' LEU . 40.7 m-85 -114.78 141.02 48.42 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.735 -0.666 . . . . 0.35 110.228 178.569 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -129.08 127.56 41.76 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.355 -0.609 . . . . 1.37 109.355 179.215 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.435 HD13 ' HB ' ' A' ' 90' ' ' ILE . 3.5 mm? -101.93 136.53 41.61 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.113 0.483 . . . . 0.25 109.8 -178.578 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.493 ' O ' ' HA ' ' A' ' 91' ' ' GLU . 74.1 m -132.16 131.25 42.07 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.757 -0.656 . . . . 0.95 110.414 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 99.18 -11.71 61.96 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.764 -0.732 . . . . 0.21 111.803 -177.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 17.3 p-10 -77.88 131.97 37.75 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.975 0.417 . . . . 0.44 110.58 179.369 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 28.5 mmm180 -126.23 -38.37 2.15 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.133 -0.485 . . . . 2.48 110.252 179.118 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 49.3 tp60 -68.5 -44.61 74.32 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.046 -0.524 . . . . 1.91 110.67 -177.624 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.435 ' HD2' ' CZ ' ' A' ' 66' ' ' TYR . 83.1 m-85 -122.98 136.19 54.76 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.016 -0.538 . . . . 0.25 109.69 179.583 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -82.48 175.72 9.98 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.027 -0.533 . . . . 0.62 111.046 -175.855 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.434 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 72.5 m-20 -54.73 -48.8 72.08 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 116.222 -0.444 . . . . 0.59 111.296 -177.489 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -62.34 -25.69 68.03 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.193 -0.458 . . . . 3.66 111.319 -174.221 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.2 tpt180 -79.89 -36.35 36.65 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.874 -0.603 . . . . 2.3 110.718 179.599 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.483 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -87.45 -34.35 18.74 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.053 0.39 . . . . 0.19 112.053 -176.456 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 35' ' ' ASP . 4.1 pp -67.0 -18.15 65.25 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 120.917 -0.313 . . . . 1.77 110.896 -179.065 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.49 -23.44 66.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.061 0.458 . . . . 0.3 110.37 176.345 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.609 HD13 HG12 ' A' ' 62' ' ' ILE . 2.4 mt -70.46 -23.09 62.64 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.871 -0.604 . . . . 0.2 110.45 175.636 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.614 HD21 HD11 ' A' ' 62' ' ' ILE . 0.7 OUTLIER -110.21 13.79 22.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.859 -0.61 . . . . 0.22 110.116 -179.444 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.9 p80 -56.19 -25.34 46.53 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.451 0.537 . . . . 0.55 112.451 -172.429 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -103.57 9.57 37.4 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.659 0.266 . . . . 0.6 111.152 -176.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.447 ' HA ' HD12 ' A' ' 45' ' ' LEU . 10.5 tp -97.52 -55.75 0.19 Allowed Pre-proline 0 C--N 1.32 -0.689 0 N-CA-C 113.792 1.034 . . . . 0.83 113.792 -169.727 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.554 ' HB3' HG12 ' A' ' 22' ' ' VAL . 82.7 Cg_endo -76.03 172.83 15.54 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 121.567 1.512 . . . . 0.33 112.825 -170.414 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.26 -0.67 64.01 Favored Glycine 0 N--CA 1.445 -0.728 0 N-CA-C 110.435 -1.066 . . . . 0.31 110.435 -172.354 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -131.33 174.62 9.88 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.954 -0.623 . . . . 1.46 109.621 178.301 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.453 ' HA ' ' HA ' ' A' ' 21' ' ' LEU . 37.4 mt-10 -95.58 95.56 8.46 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.385 0.612 . . . . 1.12 110.178 175.572 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -85.39 136.12 33.59 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.256 -0.884 . . . . 0.38 109.408 178.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.8 t-20 -80.39 156.47 26.67 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.452 -0.573 . . . . 1.39 109.452 178.641 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -49.76 -43.1 47.89 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 117.945 0.338 . . . . 0.92 111.738 -175.068 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 11.2 m -52.25 -45.03 65.21 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.092 0.472 . . . . 0.69 110.659 175.734 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -68.3 -39.2 82.11 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.629 -0.714 . . . . 1.74 111.152 179.837 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.65 ' HB3' HD13 ' A' ' 78' ' ' LEU . 10.9 mp -56.85 -46.99 81.4 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 120.719 0.295 . . . . 1.15 111.265 173.907 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 75.7 m80 -65.95 -34.82 79.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.883 0.373 . . . . 2.83 110.451 178.882 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.7 -27.84 67.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.178 -0.464 . . . . 0.31 110.962 178.077 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.0 -38.49 91.28 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.193 0.521 . . . . 0.21 110.233 175.628 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.18 -30.85 71.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.596 -0.729 . . . . 0.14 110.546 177.427 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -66.16 -36.72 83.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.965 -0.562 . . . . 0.17 110.895 179.056 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 80.7 mtt180 -55.35 -42.06 73.36 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.299 0.571 . . . . 0.36 110.001 175.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.614 HD11 HD21 ' A' ' 42' ' ' LEU . 66.0 mt -77.91 -35.17 20.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.111 -0.949 . . . . 0.16 111.151 -175.626 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.626 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -58.89 -49.59 76.49 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.376 -0.916 . . . . 0.22 111.624 176.471 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -66.45 -28.32 68.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.541 0.21 . . . . 2.17 110.957 178.524 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.543 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 87.7 t80 -58.99 -50.38 74.29 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.019 0.437 . . . . 0.21 110.183 177.022 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' TYR . . . . . 0.435 ' CZ ' ' HD2' ' A' ' 33' ' ' PHE . 8.6 m-85 -61.66 -44.46 96.93 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.651 -0.704 . . . . 0.21 110.964 177.658 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLN . . . . . 0.626 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 42.0 mt-30 -61.16 -35.49 77.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.11 -0.496 . . . . 1.21 111.033 -178.621 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -64.49 -35.66 81.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.219 0.533 . . . . 1.68 110.589 176.765 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.543 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 69.6 mmtt -79.16 -4.12 48.91 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.982 -0.554 . . . . 0.57 110.829 -177.284 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.67 -6.99 27.94 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.953 -0.642 . . . . 0.31 112.302 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' TYR . . . . . 0.419 ' HB2' ' HB3' ' A' ' 66' ' ' TYR . 43.3 m-85 -92.37 65.78 4.59 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.324 -0.621 . . . . 0.39 109.324 179.515 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 43.8 t -66.0 -28.1 42.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.699 -0.682 . . . . 0.41 110.836 -175.52 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 55.6 tp -73.66 -25.32 60.21 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.832 -0.622 . . . . 1.76 110.349 178.072 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -79.68 131.64 36.01 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.824 -0.626 . . . . 0.37 111.438 -175.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 20.5 mmm180 -140.37 155.13 46.88 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.645 -0.707 . . . . 1.8 109.918 176.6 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -113.51 135.05 54.32 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.954 -0.566 . . . . 0.18 109.754 178.875 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 47.4 p90 -130.33 149.71 51.89 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.511 -0.551 . . . . 0.38 109.511 179.498 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.65 HD13 ' HB3' ' A' ' 55' ' ' LEU . 7.5 tt -106.24 108.43 61.73 Favored Pre-proline 0 C--N 1.316 -0.88 0 N-CA-C 110.018 -0.364 . . . . 0.39 110.018 -178.008 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' A' ' 78' ' ' LEU . 18.0 Cg_endo . . . . . 0 C--O 1.233 0.271 0 C-N-CA 122.891 2.394 . . . . 1.12 112.163 176.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.832 0 N-CA-C 111.436 -0.666 . . . . 0.58 111.436 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 25.0 m -102.31 122.29 43.96 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 120.814 0.34 . . . . 0.47 110.211 178.566 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 33.2 m -108.21 128.07 63.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 109.918 -0.401 . . . . 0.31 109.918 176.468 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 14.3 ttt180 -103.94 114.29 28.44 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 120.494 -0.482 . . . . 2.92 110.43 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.435 ' HB ' HD13 ' A' ' 27' ' ' LEU . 49.1 mt -103.56 131.43 52.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 115.888 -0.596 . . . . 0.23 109.772 178.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.493 ' HA ' ' O ' ' A' ' 28' ' ' SER . 38.6 mt-10 -96.75 125.95 41.57 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.36 0.6 . . . . 1.33 110.591 -179.028 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 57.8 t -98.76 111.43 28.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.435 -0.802 . . . . 0.27 110.215 -178.246 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 30.9 tp -94.63 89.02 5.61 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.076 -0.713 . . . . 0.36 109.076 178.148 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 57.6 mt-10 -67.22 -15.67 63.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.508 -0.769 . . . . 0.49 111.725 -174.098 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.964 0 CA-C-O 118.929 -0.928 . . . . 1.39 111.764 178.904 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 21.8 t . . . . . 0 N--CA 1.447 -0.584 0 N-CA-C 109.846 -0.428 . . . . 0.52 109.846 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -71.72 126.76 30.55 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.028 -0.73 . . . . 0.91 109.028 175.409 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.487 HG12 ' HB3' ' A' ' 46' ' ' PRO . 63.9 t -108.36 116.89 52.69 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 CA-C-N 115.909 -0.587 . . . . 0.31 110.498 -176.138 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -97.85 -26.17 14.78 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.335 -0.848 . . . . 1.16 109.382 178.161 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 4.3 ptp180 -168.05 161.9 12.89 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.839 -0.619 . . . . 2.16 110.685 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.577 ' CE2' ' HG ' ' A' ' 42' ' ' LEU . 26.7 m-85 -110.91 137.14 48.92 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.696 -0.684 . . . . 0.35 109.731 178.033 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.409 ' O ' ' HA ' ' A' ' 89' ' ' ARG . 53.9 tp60 -114.72 129.18 56.65 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 109.544 -0.539 . . . . 1.37 109.544 177.282 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.441 ' HG ' HD23 ' A' ' 38' ' ' LEU . 3.9 mm? -103.7 127.29 51.18 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.007 0.432 . . . . 0.25 110.098 -178.997 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.0 t -115.08 119.47 36.56 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.938 -0.574 . . . . 0.95 110.164 -178.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 99.27 0.63 56.97 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.756 -0.735 . . . . 0.21 112.758 178.362 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 20.0 p-10 -81.23 124.29 29.17 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.361 0.6 . . . . 0.44 111.259 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' ' 31' ' ' ARG . 15.3 mmm180 -128.22 -34.03 2.12 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.782 -0.645 . . . . 2.48 110.575 177.782 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -69.35 -32.68 71.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.108 -0.497 . . . . 1.91 110.543 179.711 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 -136.94 141.68 42.66 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.406 -0.59 . . . . 0.25 109.406 175.868 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -81.06 169.7 17.13 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.433 -0.349 . . . . 0.62 110.721 -178.516 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.507 ' O ' HD13 ' A' ' 39' ' ' LEU . 1.0 OUTLIER -55.4 -54.99 36.79 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-N 116.455 -0.339 . . . . 0.59 111.344 -176.048 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.512 ' HA ' HD22 ' A' ' 39' ' ' LEU . 62.8 ttt180 -58.69 -32.79 69.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.764 0.316 . . . . 3.66 110.853 -175.839 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 20.2 tpt180 -64.59 -42.94 95.26 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.212 -0.449 . . . . 2.3 110.575 176.798 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.505 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -78.79 -26.14 44.36 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.91 0.386 . . . . 0.19 110.916 179.651 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.512 HD22 ' HA ' ' A' ' 36' ' ' ARG . 1.4 mp -60.3 -31.47 70.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.145 -0.48 . . . . 1.77 111.116 177.668 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.73 -24.06 65.41 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.903 -0.59 . . . . 0.3 111.403 176.822 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.512 HD13 HG12 ' A' ' 62' ' ' ILE . 3.8 mt -74.69 -24.49 58.78 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.123 0.487 . . . . 0.2 110.513 176.366 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.671 HD21 HD11 ' A' ' 62' ' ' ILE . 0.4 OUTLIER -107.67 14.27 25.79 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.989 -0.551 . . . . 0.22 110.12 -179.041 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 8.1 p80 -53.9 -19.94 5.29 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 113.161 0.8 . . . . 0.55 113.161 -171.93 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -110.65 11.0 22.85 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.082 0.401 . . . . 0.6 112.082 -175.314 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 84.8 mt -100.31 -54.72 0.16 Allowed Pre-proline 0 CA--C 1.539 0.519 0 N-CA-C 113.823 1.046 . . . . 0.83 113.823 -174.654 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.487 ' HB3' HG12 ' A' ' 22' ' ' VAL . 41.3 Cg_endo -69.92 165.82 29.88 Favored 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 121.345 1.363 . . . . 0.33 112.788 -170.384 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.26 -24.26 29.75 Favored Glycine 0 N--CA 1.447 -0.567 0 N-CA-C 110.711 -0.955 . . . . 0.31 110.711 -171.994 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -109.08 169.79 8.46 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.284 -0.458 . . . . 1.46 110.165 175.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -97.93 110.74 23.25 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.705 -0.68 . . . . 1.12 109.894 177.189 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.411 HD23 ' CG2' ' A' ' 22' ' ' VAL . 2.9 mm? -96.85 140.74 30.96 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.293 -0.867 . . . . 0.38 110.402 -174.13 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.67 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 36.1 p30 -85.44 171.34 11.88 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.938 -0.394 . . . . 1.39 109.938 177.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.475 ' HA ' HD12 ' A' ' 55' ' ' LEU . 3.8 mm? -50.69 -45.01 58.08 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.515 0.197 . . . . 0.92 111.521 -178.506 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.463 ' HA ' ' NE2' ' A' ' 56' ' ' HIS . 22.5 m -55.42 -51.1 67.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.327 -0.397 . . . . 0.69 111.069 179.3 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -67.28 -30.83 70.8 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.111 -0.495 . . . . 1.74 111.185 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.67 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 84.3 mt -60.78 -55.03 38.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.404 -0.362 . . . . 1.15 111.027 178.843 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.463 ' NE2' ' HA ' ' A' ' 53' ' ' SER . 34.8 p80 -75.88 -22.91 55.66 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.493 -0.483 . . . . 2.83 111.183 -178.125 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.32 -33.31 72.21 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.132 0.492 . . . . 0.31 110.403 174.085 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.86 -39.7 90.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.676 -0.693 . . . . 0.21 110.662 176.345 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.48 -34.99 78.3 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.802 -0.635 . . . . 0.14 110.729 179.679 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.06 -39.19 94.0 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.873 -0.603 . . . . 0.17 110.962 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 80.6 mtt180 -55.45 -42.59 74.46 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.266 0.555 . . . . 0.36 110.334 176.607 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ILE . . . . . 0.671 HD11 HD21 ' A' ' 42' ' ' LEU . 72.6 mt -78.34 -37.52 21.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.533 -0.758 . . . . 0.16 110.699 -176.238 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.657 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -59.1 -45.36 95.41 Favored Glycine 0 N--CA 1.442 -0.929 0 C-N-CA 120.67 -0.776 . . . . 0.22 111.645 176.717 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -68.25 -33.41 74.34 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.818 0.342 . . . . 2.17 110.52 178.2 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.458 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 90.4 t80 -57.27 -51.32 69.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.889 -0.596 . . . . 0.21 110.628 178.231 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -59.61 -41.42 90.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.97 -0.559 . . . . 0.21 111.157 178.798 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLN . . . . . 0.657 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 21.2 mt-30 -58.73 -44.8 90.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.034 -0.53 . . . . 1.21 111.087 -178.146 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -70.44 -17.27 62.99 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.84 0.352 . . . . 1.68 111.339 -179.123 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.458 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 75.5 mmtt -91.2 4.89 51.1 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.802 0.334 . . . . 0.57 110.642 179.704 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 102.61 -11.54 56.47 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.769 -0.729 . . . . 0.31 112.489 176.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -89.72 74.24 7.53 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.426 0.631 . . . . 0.39 109.387 -179.214 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 28.7 t -74.34 -25.77 19.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.434 -0.803 . . . . 0.41 111.091 -174.023 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 60.8 tp -78.19 -16.77 57.56 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.134 0.492 . . . . 1.76 110.029 176.968 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.512 ' HA ' ' O ' ' A' ' 93' ' ' LEU . . . -82.7 137.3 34.48 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.957 -0.565 . . . . 0.37 111.504 -178.286 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 21.5 tpt180 -152.12 132.6 13.81 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.7 -0.682 . . . . 1.8 109.602 176.761 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -95.81 135.13 37.94 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 110.288 -0.264 . . . . 0.18 110.288 178.678 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 51.0 p90 -135.36 149.39 49.68 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.86 0.362 . . . . 0.38 110.27 179.253 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.5 tt -104.21 118.4 56.99 Favored Pre-proline 0 C--N 1.318 -0.791 0 N-CA-C 108.997 -0.742 . . . . 0.39 108.997 178.607 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo . . . . . 0 C--O 1.234 0.292 0 C-N-CA 122.654 2.236 . . . . 1.12 112.095 179.087 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.703 0 N-CA-C 111.599 -0.6 . . . . 0.58 111.599 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 87.0 m -128.86 119.76 25.03 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.904 0.383 . . . . 0.47 110.397 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 32.6 m -95.91 132.97 38.74 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 N-CA-C 109.676 -0.49 . . . . 0.31 109.676 178.946 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.409 ' HA ' ' O ' ' A' ' 26' ' ' GLN . 34.4 ttp180 -111.34 117.32 32.8 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.287 0.565 . . . . 2.92 110.707 -177.721 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.415 ' HB ' HD13 ' A' ' 27' ' ' LEU . 71.9 mt -100.98 131.47 48.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 115.223 -0.899 . . . . 0.23 109.669 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -94.21 117.95 30.86 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.371 0.605 . . . . 1.33 110.068 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 55.4 t -92.85 109.57 21.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 115.426 -0.806 . . . . 0.27 110.263 -177.349 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.512 ' O ' ' HA ' ' A' ' 74' ' ' ALA . 57.5 tp -89.9 90.72 8.3 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.47 -0.567 . . . . 0.36 109.47 176.589 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -77.79 -12.32 59.96 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.203 0.525 . . . . 0.49 110.465 -178.33 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.232 0 CA-C-O 118.279 -1.289 . . . . 1.39 111.22 178.277 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.1 ttt . . . . . 0 N--CA 1.478 0.943 0 N-CA-C 109.669 -0.493 . . . . 15.85 109.669 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -60.53 112.98 2.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.091 -0.504 . . . . 12.76 111.604 -176.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 53.6 m80 -120.23 -81.9 0.64 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.763 -0.653 . . . . 13.36 109.765 175.213 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 37.7 p-80 -84.02 127.81 34.13 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.225 -0.443 . . . . 10.71 109.841 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' HIS . . . . . 0.486 ' HB2' ' OE2' ' A' ' 49' ' ' GLU . 77.1 m80 -90.23 -44.36 9.79 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.655 -0.498 . . . . 9.04 109.655 178.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 40.3 t-80 48.48 61.75 2.89 Favored 'General case' 0 N--CA 1.468 0.429 0 O-C-N 123.786 0.679 . . . . 9.79 112.215 169.275 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 30.8 m170 -122.47 -3.11 8.88 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.271 0.558 . . . . 7.41 109.813 174.288 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 54.1 t-80 -178.73 -39.5 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.735 -1.121 . . . . 6.44 108.181 177.514 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.429 HG21 ' HA ' ' A' ' 48' ' ' GLN . 15.6 m -129.27 168.08 23.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 114.527 -1.215 . . . . 1.97 109.266 174.899 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -163.59 -169.71 2.01 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 110.466 -0.198 . . . . 4.2 110.466 178.164 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.513 ' HA ' HG21 ' A' ' 19' ' ' THR . 3.9 p-10 -59.92 133.26 55.93 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.443 0.64 . . . . 4.33 112.325 -174.219 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -133.93 165.31 25.3 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.308 -0.86 . . . . 4.37 109.54 -178.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 22.9 t70 68.62 -75.94 0.06 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.336 0.654 . . . . 5.36 110.343 -175.224 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -107.58 93.87 4.78 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.565 -0.902 . . . . 3.42 108.565 174.169 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 63.9 mtt -78.27 143.18 37.27 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.702 -0.681 . . . . 4.43 110.596 -177.378 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 82.23 12.82 80.16 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.97 -0.633 . . . . 3.41 112.279 -177.858 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -118.26 -173.05 15.87 Favored Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 120.819 -0.705 . . . . 2.09 111.836 178.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_exo -71.87 131.74 18.83 Favored 'Trans proline' 0 N--CA 1.459 -0.517 0 C-N-CA 122.515 2.143 . . . . 1.16 111.372 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.513 HG21 ' HA ' ' A' ' 11' ' ' ASP . 17.3 p -135.59 154.18 51.43 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.223 -0.444 . . . . 0.73 110.902 -179.461 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 39.2 t -123.51 123.68 67.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-N 116.04 -0.527 . . . . 0.52 110.021 178.289 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.411 ' O ' ' HA2' ' A' ' 86' ' ' GLY . 35.9 tp -71.32 102.27 2.56 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.138 -0.689 . . . . 0.91 109.138 174.114 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.602 HG12 ' HB3' ' A' ' 46' ' ' PRO . 75.7 t -76.15 115.54 17.87 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 CA-C-N 115.585 -0.734 . . . . 0.31 110.727 -176.707 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -98.88 -32.6 11.25 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.905 -0.589 . . . . 1.16 109.848 176.595 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 7.1 ptm180 -158.68 163.09 37.18 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.083 -0.508 . . . . 2.16 110.963 178.426 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.58 ' CE2' ' HG ' ' A' ' 42' ' ' LEU . 42.0 m-85 -111.18 139.12 46.82 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.534 -0.757 . . . . 0.35 109.78 176.051 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -120.59 128.99 53.56 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 109.559 -0.534 . . . . 1.37 109.559 176.178 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.61 ' HG ' HD23 ' A' ' 38' ' ' LEU . 3.8 mm? -102.65 129.52 49.27 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.278 0.561 . . . . 0.25 110.013 -179.007 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 40.8 t -121.04 121.67 38.44 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.535 -0.757 . . . . 0.95 110.227 -177.288 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 101.51 -7.46 56.03 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.835 -0.698 . . . . 0.21 112.295 -179.25 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 20.6 p-10 -77.49 123.34 26.44 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.139 0.495 . . . . 0.44 110.935 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.451 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 30.1 mmm180 -124.33 -26.71 3.89 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.043 -0.526 . . . . 2.48 110.226 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -81.34 -36.02 30.21 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.886 -0.597 . . . . 1.91 110.835 -179.464 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.437 ' HD2' ' CZ ' ' A' ' 66' ' ' TYR . 78.3 m-85 -130.92 135.39 47.62 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.139 -0.482 . . . . 0.25 110.336 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.582 ' OD1' ' HB3' ' A' ' 36' ' ' ARG . 1.7 p30 -77.04 169.45 18.32 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.904 -0.589 . . . . 0.62 111.16 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.505 ' O ' HD13 ' A' ' 39' ' ' LEU . 4.2 m-20 -52.81 -52.58 56.35 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 123.284 0.365 . . . . 0.59 110.387 -179.348 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.582 ' HB3' ' OD1' ' A' ' 34' ' ' ASP . 6.7 ttp180 -45.32 -49.57 12.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.467 -0.788 . . . . 3.66 111.975 179.456 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -59.77 -41.96 92.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.175 -0.466 . . . . 2.3 111.372 -179.207 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.61 HD23 ' HG ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -82.51 -25.15 33.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.3 -0.409 . . . . 0.19 111.445 -175.799 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.505 HD13 ' O ' ' A' ' 35' ' ' ASP . 2.5 mp -63.11 -34.6 77.94 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.363 -0.38 . . . . 1.77 111.806 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.91 -21.99 66.42 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.478 -0.328 . . . . 0.3 111.211 178.392 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.612 HD13 HG12 ' A' ' 62' ' ' ILE . 6.4 mt -69.87 -25.41 63.7 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.072 0.463 . . . . 0.2 110.202 175.033 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.58 ' HG ' ' CE2' ' A' ' 25' ' ' PHE . 0.5 OUTLIER -108.04 14.21 25.39 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.799 -0.637 . . . . 0.22 110.171 -179.29 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 13.0 p80 -47.53 -27.02 1.61 Allowed 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 113.489 0.922 . . . . 0.55 113.489 -174.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -104.21 11.29 35.14 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.486 0.55 . . . . 0.6 112.486 -173.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 81.6 mt -102.38 -56.95 0.11 Allowed Pre-proline 0 C--N 1.323 -0.577 0 N-CA-C 114.005 1.113 . . . . 0.83 114.005 -173.376 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.602 ' HB3' HG12 ' A' ' 22' ' ' VAL . 74.1 Cg_endo -72.26 164.07 36.75 Favored 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 121.36 1.373 . . . . 0.33 113.145 -166.229 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 91.96 -0.36 72.7 Favored Glycine 0 N--CA 1.446 -0.684 0 N-CA-C 110.331 -1.108 . . . . 0.31 110.331 -170.231 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.429 ' HA ' HG21 ' A' ' 9' ' ' VAL . 44.0 mt-30 -129.57 171.33 12.71 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.075 -0.562 . . . . 1.46 109.77 -179.189 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.486 ' OE2' ' HB2' ' A' ' 5' ' ' HIS . 49.5 mt-10 -99.15 92.15 5.33 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.481 0.658 . . . . 1.12 110.168 178.446 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -83.18 135.81 34.66 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 114.876 -1.056 . . . . 0.38 109.477 -179.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.584 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 28.2 p-10 -83.78 170.7 13.88 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.586 -0.524 . . . . 1.39 109.586 178.15 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.517 HD13 HD12 ' A' ' 55' ' ' LEU . 3.6 mm? -55.33 -42.19 73.46 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.644 0.259 . . . . 0.92 111.07 -176.411 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 11.5 m -59.48 -45.74 90.81 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.335 -0.393 . . . . 0.69 111.193 -178.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -66.78 -33.95 76.75 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.891 0.377 . . . . 1.74 110.767 176.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.584 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 82.2 mt -63.36 -42.68 98.91 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.021 -0.536 . . . . 1.15 110.854 177.526 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 71.6 m80 -69.76 -35.75 75.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.82 0.343 . . . . 2.83 110.416 177.571 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.4 -33.86 76.83 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.24 -0.436 . . . . 0.31 110.934 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -57.45 -39.13 75.64 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.827 -0.624 . . . . 0.21 111.012 177.054 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.44 -30.71 69.65 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.778 -0.646 . . . . 0.14 111.322 -178.323 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.91 -32.03 73.55 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.213 -0.449 . . . . 0.17 110.838 -179.138 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 77.5 mtt180 -58.84 -42.08 88.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.828 -0.623 . . . . 0.36 110.172 176.471 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.612 HG12 HD13 ' A' ' 41' ' ' LEU . 62.3 mt -77.37 -35.86 22.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.363 -0.835 . . . . 0.16 110.761 -175.642 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.518 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -60.97 -36.17 91.79 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.859 -0.686 . . . . 0.22 112.197 178.456 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -80.61 -31.81 36.53 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.883 0.373 . . . . 2.17 110.47 177.422 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.444 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 90.8 t80 -54.45 -50.75 66.94 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.825 -0.625 . . . . 0.21 110.627 177.544 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' TYR . . . . . 0.46 ' HB3' ' HB2' ' A' ' 71' ' ' TYR . 8.5 m-85 -59.53 -39.64 84.59 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.589 -0.732 . . . . 0.21 111.313 178.704 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLN . . . . . 0.518 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 77.3 mt-30 -60.39 -38.29 83.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.252 -0.431 . . . . 1.21 111.267 -177.713 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -73.08 -19.35 61.18 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.031 0.443 . . . . 1.68 111.071 -179.174 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.444 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 73.6 mmtt -88.38 -4.43 58.66 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.147 -0.479 . . . . 0.57 110.058 178.079 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.31 -8.27 30.76 Favored Glycine 0 N--CA 1.448 -0.53 0 CA-C-N 115.84 -0.618 . . . . 0.31 112.402 178.735 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' TYR . . . . . 0.46 ' HB2' ' HB3' ' A' ' 66' ' ' TYR . 44.3 m-85 -90.53 72.51 6.89 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.235 0.541 . . . . 0.39 109.795 -179.452 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 21.2 t -72.53 -24.63 21.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.735 -0.666 . . . . 0.41 110.85 -175.583 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 96.1 mt -80.72 -9.89 59.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.837 -0.619 . . . . 1.76 110.849 178.544 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.554 ' HA ' ' O ' ' A' ' 93' ' ' LEU . . . -85.94 139.95 30.77 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.065 -0.516 . . . . 0.37 111.437 -176.166 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 13.4 tpt180 -147.32 131.42 17.31 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.765 -0.652 . . . . 1.8 110.044 177.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -102.02 132.88 47.61 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.806 -0.442 . . . . 0.18 109.806 175.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 48.1 p90 -139.55 142.84 37.18 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.688 0.28 . . . . 0.38 110.316 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.613 HD23 ' H ' ' A' ' 80' ' ' ALA . 7.0 tt -92.98 106.95 21.26 Favored Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 109.167 -0.679 . . . . 0.39 109.167 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -77.28 -8.2 17.33 Favored 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 123.029 2.486 . . . . 1.12 113.009 -172.593 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.613 ' H ' HD23 ' A' ' 78' ' ' LEU . . . 66.2 -91.31 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 O-C-N 123.904 0.752 . . . . 2.0 110.719 -177.597 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 52.74 53.37 12.27 Favored 'General case' 0 C--O 1.235 0.297 0 O-C-N 123.424 0.453 . . . . 3.72 110.564 178.198 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 58.9 82.24 0.15 Allowed 'General case' 0 C--O 1.233 0.205 0 CA-C-O 121.518 0.675 . . . . 3.76 110.805 -177.083 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.416 HG21 HG12 ' A' ' 88' ' ' VAL . 55.6 mt -69.34 145.05 13.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.246 -0.888 . . . . 1.23 111.067 -176.537 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLN . . . . . 0.434 ' H ' ' NE2' ' A' ' 84' ' ' GLN . 0.8 OUTLIER -67.11 153.87 42.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.014 -0.539 . . . . 1.56 109.74 178.937 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -80.07 52.44 1.53 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.484 0.659 . . . . 1.54 110.999 -179.088 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLY . . . . . 0.411 ' HA2' ' O ' ' A' ' 21' ' ' LEU . . . 162.24 -45.11 0.36 Allowed Glycine 0 N--CA 1.444 -0.777 0 CA-C-N 115.566 -0.743 . . . . 0.58 111.638 -179.437 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 17.8 m -95.85 121.65 37.8 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.034 0.445 . . . . 0.47 110.424 176.706 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.416 HG12 HG21 ' A' ' 83' ' ' ILE . 35.0 m -104.0 137.33 33.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 109.283 -0.636 . . . . 0.31 109.283 174.334 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.472 ' O ' ' HG ' ' A' ' 78' ' ' LEU . 27.4 ttm180 -114.38 135.29 54.25 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.447 -0.501 . . . . 2.92 111.404 -176.4 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.441 ' HB ' HD13 ' A' ' 27' ' ' LEU . 59.4 mt -120.26 136.68 56.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.564 -0.744 . . . . 0.23 110.239 179.013 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 44.9 mm-40 -92.97 120.49 33.34 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.862 -0.422 . . . . 1.33 109.862 179.022 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 40.0 t -102.07 102.05 13.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 116.113 -0.494 . . . . 0.27 110.72 -179.023 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.554 ' O ' ' HA ' ' A' ' 74' ' ' ALA . 61.3 tp -86.48 88.66 7.68 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.968 -0.56 . . . . 0.36 109.497 175.788 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.451 ' CD ' ' H ' ' A' ' 31' ' ' ARG . 50.1 mt-10 -74.22 -34.21 63.62 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.207 0.527 . . . . 0.49 110.389 -178.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.184 0 CA-C-O 118.322 -1.265 . . . . 1.39 111.118 -178.864 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.3 ttp . . . . . 0 N--CA 1.478 0.969 0 CA-C-O 120.592 0.234 . . . . 15.85 110.869 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 52.3 54.55 10.53 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 113.183 0.809 . . . . 12.76 113.183 172.359 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 7.3 m-70 -94.61 53.66 1.68 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.089 0.471 . . . . 13.36 110.719 176.034 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 7.2 p80 -166.88 131.24 2.0 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.479 -0.782 . . . . 10.71 109.314 176.682 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 74.8 t60 -155.87 78.82 0.99 Allowed 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.648 -0.501 . . . . 9.04 109.648 -179.515 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 15.0 t-80 -88.86 -37.54 15.26 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.981 -0.554 . . . . 9.79 110.224 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 78.4 m-70 -67.54 136.96 55.34 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.996 -0.547 . . . . 7.41 110.337 178.466 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 64.7 t60 -130.75 -26.56 2.2 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.551 -0.75 . . . . 6.44 109.973 -178.009 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.524 HG21 ' HA ' ' A' ' 48' ' ' GLN . 52.1 t -133.64 -61.21 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.004 -0.544 . . . . 1.97 110.187 -178.515 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 35.8 t70 48.21 52.93 12.55 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.854 0.835 . . . . 4.2 110.548 -177.556 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -132.53 46.9 2.57 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.282 -0.872 . . . . 4.33 109.107 -179.385 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -132.77 149.47 52.27 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.328 -0.851 . . . . 4.37 109.825 -177.356 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -61.62 99.85 0.13 Allowed 'General case' 0 C--N 1.329 -0.296 0 O-C-N 123.577 0.548 . . . . 5.36 110.876 -177.608 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.45 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 4.6 tmmm? -95.18 72.83 3.35 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.888 -0.596 . . . . 3.42 109.477 -176.404 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 53.1 ttm -114.17 -42.28 3.38 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.888 -0.596 . . . . 4.43 110.444 178.317 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -78.99 -12.64 83.92 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.883 -0.675 . . . . 3.41 112.602 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.45 ' O ' ' HG2' ' A' ' 14' ' ' LYS . . . 160.17 166.18 18.51 Favored Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 120.87 -0.681 . . . . 2.09 111.905 179.086 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -57.37 150.9 56.2 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 123.433 2.756 . . . . 1.16 112.519 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.545 ' HA ' ' HA ' ' A' ' 51' ' ' ASN . 24.2 p -80.73 139.32 36.17 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.207 0.527 . . . . 0.73 111.335 -178.263 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 59.1 t -115.63 119.56 62.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.626 -0.716 . . . . 0.52 110.034 178.066 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.438 ' HB2' ' HG2' ' A' ' 49' ' ' GLU . 48.7 tp -65.82 115.99 6.52 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.353 -0.385 . . . . 0.91 110.081 175.41 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.545 HG11 ' CE1' ' A' ' 25' ' ' PHE . 51.7 t -100.69 136.52 31.83 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 CA-C-N 115.902 -0.59 . . . . 0.31 109.692 177.368 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -118.64 -24.46 6.72 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 109.797 -0.446 . . . . 1.16 109.797 176.829 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 16.3 ptp180 -162.69 154.3 18.01 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.06 -0.518 . . . . 2.16 110.67 175.192 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.545 ' CE1' HG11 ' A' ' 22' ' ' VAL . 33.2 m-85 -106.32 145.54 31.53 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.909 -0.587 . . . . 0.35 110.498 178.093 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.469 ' O ' ' HA ' ' A' ' 89' ' ' ARG . 50.1 tp60 -125.08 129.39 50.14 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 109.371 -0.603 . . . . 1.37 109.371 176.401 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.478 HD13 ' HB ' ' A' ' 90' ' ' ILE . 4.1 mm? -103.31 136.93 42.16 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.675 -0.491 . . . . 0.25 109.675 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.5 t -124.76 128.98 49.6 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.384 -0.371 . . . . 0.95 110.05 -179.08 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 96.48 -11.07 67.03 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.632 -0.794 . . . . 0.21 112.562 178.445 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 6.2 p-10 -67.67 144.95 55.25 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.906 0.384 . . . . 0.44 110.61 178.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.458 ' HB3' ' OE1' ' A' ' 94' ' ' GLU . 21.8 tpp180 -143.57 -37.72 0.34 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.795 -0.639 . . . . 2.48 110.161 179.355 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -68.62 -43.67 75.87 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.669 -0.696 . . . . 1.91 110.517 179.269 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -125.08 151.94 45.0 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.991 -0.744 . . . . 0.25 108.991 175.427 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -96.78 172.45 7.88 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.199 -0.297 . . . . 0.62 110.199 -178.387 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.529 ' O ' HD13 ' A' ' 39' ' ' LEU . 4.9 m-20 -50.7 -51.35 50.43 Favored 'General case' 0 C--O 1.221 -0.404 0 O-C-N 123.31 0.381 . . . . 0.59 110.785 -178.649 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 72.9 mtp180 -55.38 -33.67 63.66 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.946 -0.57 . . . . 3.66 111.967 -175.038 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 31.5 tpt85 -77.22 -41.91 39.46 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.683 -0.235 . . . . 2.3 110.829 -178.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.501 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -76.17 -27.37 56.92 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.983 0.421 . . . . 0.19 110.8 -178.515 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.529 HD13 ' O ' ' A' ' 35' ' ' ASP . 3.8 mp -60.9 -30.4 70.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.868 -0.605 . . . . 1.77 111.053 176.297 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.63 -23.32 65.97 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.727 -0.67 . . . . 0.3 111.633 178.535 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.549 HD13 HG12 ' A' ' 62' ' ' ILE . 2.3 mt -75.05 -26.65 59.56 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.344 0.592 . . . . 0.2 110.3 176.574 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.546 HD21 HD11 ' A' ' 62' ' ' ILE . 0.4 OUTLIER -105.49 14.26 28.9 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.648 -0.706 . . . . 0.22 109.886 -179.086 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 8.3 p80 -51.5 -22.86 3.43 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.408 0.892 . . . . 0.55 113.408 -171.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -107.83 -0.4 21.62 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.816 0.302 . . . . 0.6 111.816 -174.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 64.1 mt -84.45 -54.05 0.49 Allowed Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 113.462 0.912 . . . . 0.83 113.462 -173.43 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.514 ' HB3' HG12 ' A' ' 22' ' ' VAL . 73.8 Cg_endo -74.22 155.45 46.74 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 121.275 1.316 . . . . 0.33 112.051 -170.275 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 99.23 -17.14 58.36 Favored Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 109.444 -1.462 . . . . 0.31 109.444 -167.261 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.524 ' HA ' HG21 ' A' ' 9' ' ' VAL . 89.4 mt-30 -116.4 173.3 6.68 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.267 -0.966 . . . . 1.46 109.532 176.761 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.438 ' HG2' ' HB2' ' A' ' 21' ' ' LEU . 43.0 mt-10 -107.51 106.93 17.55 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.234 0.54 . . . . 1.12 109.972 178.554 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.428 HD23 ' CG2' ' A' ' 22' ' ' VAL . 2.6 mm? -93.56 126.46 38.73 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.911 -1.04 . . . . 0.38 110.318 -173.646 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.545 ' HA ' ' HA ' ' A' ' 19' ' ' THR . 4.0 p30 -77.25 167.79 21.13 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 121.266 -0.174 . . . . 1.39 110.597 178.57 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.446 ' HA ' HD12 ' A' ' 55' ' ' LEU . 4.2 mm? -46.43 -45.06 17.8 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.453 0.538 . . . . 0.92 112.453 -176.181 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.409 ' HA ' ' NE2' ' A' ' 56' ' ' HIS . 33.2 m -56.59 -46.77 80.64 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.697 0.284 . . . . 0.69 111.032 -178.21 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -77.47 -23.72 50.34 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.422 -0.354 . . . . 1.74 111.348 -178.62 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 78.8 mt -61.41 -53.42 56.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.658 0.266 . . . . 1.15 110.366 176.369 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.409 ' NE2' ' HA ' ' A' ' 53' ' ' SER . 34.6 p80 -77.38 -23.65 50.73 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.392 -0.523 . . . . 2.83 111.125 -179.333 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.21 -32.15 73.62 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.139 0.495 . . . . 0.31 110.044 174.679 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.02 -41.36 92.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.62 -0.718 . . . . 0.21 110.253 175.007 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.16 -36.79 82.56 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.529 -0.76 . . . . 0.14 110.659 178.049 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.56 -34.6 78.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.911 -0.586 . . . . 0.17 111.09 179.361 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -57.31 -41.54 80.06 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.419 0.628 . . . . 0.36 110.034 175.021 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.549 HG12 HD13 ' A' ' 41' ' ' LEU . 76.9 mt -75.9 -36.72 33.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.154 -0.93 . . . . 0.16 110.717 -177.031 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.575 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -58.9 -47.98 87.88 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.688 -0.767 . . . . 0.22 111.689 177.038 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -68.35 -30.92 69.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.711 0.291 . . . . 2.17 110.552 178.426 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.437 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 86.9 t80 -57.79 -49.37 76.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.998 -0.546 . . . . 0.21 110.376 177.751 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 -61.58 -46.66 88.95 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.686 -0.688 . . . . 0.21 111.169 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLN . . . . . 0.575 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 15.7 mt-30 -56.84 -40.42 76.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.16 0.505 . . . . 1.21 110.536 179.452 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -63.72 -30.07 71.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.264 -0.88 . . . . 1.68 110.73 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.437 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 75.8 mmtt -90.04 6.8 40.76 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.902 -0.59 . . . . 0.57 110.927 -178.681 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 104.31 -12.18 51.49 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.953 -0.641 . . . . 0.31 112.914 176.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -88.76 70.16 8.72 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.212 0.529 . . . . 0.39 109.602 -179.301 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 26.1 t -71.1 -24.33 24.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.759 -0.655 . . . . 0.41 110.579 -176.568 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 50.3 tp -80.75 -7.16 59.29 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.668 -0.696 . . . . 1.76 110.389 178.632 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -99.92 134.86 42.21 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.183 0.516 . . . . 0.37 111.466 -176.234 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 16.7 mmm180 -141.86 164.28 30.63 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.553 -0.749 . . . . 1.8 109.509 176.334 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -127.53 137.5 52.64 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.971 -0.381 . . . . 0.18 109.971 179.551 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 48.1 p90 -132.39 143.16 49.64 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.9 0.381 . . . . 0.38 110.298 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.433 ' HA ' ' HD2' ' A' ' 79' ' ' PRO . 8.1 tt -96.18 110.83 54.21 Favored Pre-proline 0 C--N 1.32 -0.705 0 N-CA-C 109.164 -0.68 . . . . 0.39 109.164 178.046 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.433 ' HD2' ' HA ' ' A' ' 78' ' ' LEU . 11.8 Cg_endo -57.83 111.32 0.81 Allowed 'Trans proline' 0 N--CA 1.463 -0.282 0 C-N-CA 122.677 2.251 . . . . 1.12 111.701 177.569 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -87.69 -1.5 58.0 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.877 -0.601 . . . . 2.0 111.547 -175.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -81.64 100.39 9.41 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.796 -0.446 . . . . 3.72 109.796 178.058 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 62.31 71.24 0.54 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.344 -0.844 . . . . 3.76 110.499 -177.383 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 21.2 mt -71.81 141.91 16.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.325 -0.852 . . . . 1.23 110.336 177.214 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 92.4 mt-30 -89.02 159.58 17.52 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.332 -0.395 . . . . 1.56 109.973 177.193 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -107.24 149.65 27.51 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.697 -0.482 . . . . 1.54 109.697 179.441 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 78.18 -66.02 3.23 Favored Glycine 0 N--CA 1.445 -0.709 0 N-CA-C 111.271 -0.732 . . . . 0.58 111.271 -175.595 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 25.8 m -100.65 120.57 40.26 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.288 -0.634 . . . . 0.47 109.288 173.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 29.6 m -116.36 131.43 68.94 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.938 0 N-CA-C 109.847 -0.427 . . . . 0.31 109.847 179.66 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.469 ' HA ' ' O ' ' A' ' 26' ' ' GLN . 25.0 ttp180 -106.26 128.71 54.16 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.351 0.596 . . . . 2.92 111.221 -174.875 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.478 ' HB ' HD13 ' A' ' 27' ' ' LEU . 63.1 mt -113.89 134.83 55.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.042 -0.981 . . . . 0.23 109.187 177.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -96.49 128.26 43.26 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.216 0.531 . . . . 1.33 110.693 -179.322 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.424 ' CG2' HD12 ' A' ' 27' ' ' LEU . 47.7 t -102.63 124.55 56.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.445 -0.798 . . . . 0.27 110.259 -178.464 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 56.7 tp -107.85 99.93 9.35 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.525 -0.546 . . . . 0.36 109.525 177.021 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.458 ' OE1' ' HB3' ' A' ' 31' ' ' ARG . 69.4 mt-10 -87.61 33.64 0.7 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.889 -0.596 . . . . 0.49 111.045 -175.535 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.901 0 CA-C-O 118.65 -1.084 . . . . 1.39 112.13 179.882 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 88.3 mmm . . . . . 0 N--CA 1.479 1.021 0 CA-C-O 120.794 0.33 . . . . 15.85 110.622 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -80.44 102.18 9.5 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.184 -0.462 . . . . 12.76 110.366 178.549 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 12.8 p-80 -104.61 41.78 1.28 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.961 -0.563 . . . . 13.36 110.974 -177.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 36.9 t-80 -65.14 124.43 22.11 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.275 -0.421 . . . . 10.71 110.295 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 78.0 t60 -59.26 127.68 33.35 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.862 -0.608 . . . . 9.04 110.735 -179.711 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 40.0 m80 -97.41 152.07 19.32 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.544 -0.753 . . . . 9.79 109.321 178.799 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 17.7 t-80 -67.3 -26.52 66.56 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.17 -0.678 . . . . 7.41 109.17 174.665 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' HIS . . . . . 0.415 ' HB3' ' HB3' ' A' ' 11' ' ' ASP . 32.6 m170 -83.02 86.47 6.99 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.717 -0.846 . . . . 6.44 108.717 171.272 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.481 ' HB ' ' HA ' ' A' ' 48' ' ' GLN . 46.5 t -67.92 113.41 3.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.496 -0.32 . . . . 1.97 111.187 -175.88 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 17.2 t70 55.17 70.07 0.67 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.257 -0.883 . . . . 4.2 110.739 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.415 ' HB3' ' HB3' ' A' ' 8' ' ' HIS . 7.4 p-10 -98.17 151.73 20.11 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.584 -0.734 . . . . 4.33 111.023 -177.074 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.601 ' H ' HG21 ' A' ' 19' ' ' THR . 10.2 m-20 -113.91 153.67 28.84 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.556 -0.747 . . . . 4.37 109.311 176.063 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -55.94 -71.6 0.09 Allowed 'General case' 0 C--N 1.327 -0.396 0 O-C-N 123.265 0.353 . . . . 5.36 110.96 -177.497 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.471 ' HD2' ' O ' ' A' ' 14' ' ' LYS . 1.4 tmmt? -166.22 72.87 0.16 Allowed 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.083 -0.71 . . . . 3.42 109.083 177.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 47.4 ttp -98.53 91.33 5.11 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.819 -0.628 . . . . 4.43 109.954 -179.054 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLY . . . . . 0.416 ' HA3' ' OG ' ' A' ' 53' ' ' SER . . . 86.35 -9.47 70.22 Favored Glycine 0 N--CA 1.448 -0.562 0 CA-C-N 115.619 -0.719 . . . . 3.41 111.445 -175.448 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 147.78 158.2 7.8 Favored Glycine 0 N--CA 1.443 -0.844 0 N-CA-C 111.372 -0.691 . . . . 2.09 111.372 -179.44 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -59.31 138.43 84.5 Favored 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.998 2.465 . . . . 1.16 112.142 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.601 HG21 ' H ' ' A' ' 12' ' ' ASP . 32.5 p -71.84 140.93 49.58 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.944 -0.571 . . . . 0.73 111.918 -174.487 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 32.8 t -109.86 127.61 66.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 115.591 -0.731 . . . . 0.52 110.189 178.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.499 ' O ' ' HA2' ' A' ' 86' ' ' GLY . 24.7 tp -72.91 92.0 1.59 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.081 -0.711 . . . . 0.91 109.081 174.261 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.56 ' HA ' ' O ' ' A' ' 86' ' ' GLY . 98.8 t -70.66 123.8 25.46 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.048 0 CA-C-N 115.295 -0.866 . . . . 0.31 111.149 -174.745 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.424 ' HG2' ' HA3' ' A' ' 86' ' ' GLY . 10.7 mmtp -80.84 -40.45 24.86 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.544 -0.753 . . . . 1.16 109.449 176.1 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.424 ' HG3' HG23 ' A' ' 87' ' ' THR . 4.6 ptp180 -174.59 169.57 3.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 114.493 -1.23 . . . . 2.16 109.392 -179.111 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.525 ' CE1' HG11 ' A' ' 22' ' ' VAL . 33.6 m-85 -106.04 125.1 50.58 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.002 -0.544 . . . . 0.35 110.525 178.527 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.408 ' O ' ' HA ' ' A' ' 89' ' ' ARG . 11.9 tp60 -104.63 127.51 52.4 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.325 -0.852 . . . . 1.37 108.721 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.453 HD13 ' HB ' ' A' ' 90' ' ' ILE . 3.7 mm? -102.97 134.91 45.62 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.148 0.499 . . . . 0.25 110.321 -177.591 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.462 ' HB2' ' HD3' ' A' ' 89' ' ' ARG . 28.4 t -127.76 135.04 49.59 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.763 -0.653 . . . . 0.95 109.797 -178.504 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 91.11 -11.36 72.4 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.672 -0.775 . . . . 0.21 112.646 179.259 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 15.5 p-10 -75.17 137.64 41.46 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.75 0.31 . . . . 0.44 110.688 179.018 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 30.1 tpt180 -128.2 -44.58 1.42 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.406 -0.361 . . . . 2.48 110.942 177.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 21.8 tp60 -64.85 -40.85 95.81 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.972 0.415 . . . . 1.91 110.612 -177.598 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 -125.63 133.37 52.24 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.936 -0.764 . . . . 0.25 108.936 177.677 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -88.76 178.08 6.56 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.613 -0.435 . . . . 0.62 110.629 -178.508 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -47.61 -48.83 28.2 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 123.743 0.652 . . . . 0.59 111.909 -176.733 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 79.0 mtm180 -55.17 -38.22 68.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.835 -0.621 . . . . 3.66 111.799 -173.275 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 37.1 tpt85 -77.57 -38.65 47.99 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.346 -0.388 . . . . 2.3 110.883 -176.809 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.59 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -81.67 -32.57 31.74 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 111.982 0.364 . . . . 0.19 111.982 -174.319 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.5 pp -68.19 -18.83 64.69 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.913 -0.315 . . . . 1.77 110.92 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.46 -24.04 63.74 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.248 -0.433 . . . . 0.3 110.653 177.16 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.675 HD13 HG12 ' A' ' 62' ' ' ILE . 1.9 mt -67.44 -22.84 65.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.331 0.586 . . . . 0.2 110.143 175.275 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.505 HD21 HD11 ' A' ' 62' ' ' ILE . 0.7 OUTLIER -111.93 13.26 20.83 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.712 -0.676 . . . . 0.22 110.403 -179.041 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 5.4 p80 -51.11 -21.87 2.16 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 113.488 0.921 . . . . 0.55 113.488 -172.552 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -94.88 -8.89 35.9 Favored 'General case' 0 C--N 1.328 -0.359 0 O-C-N 122.261 -0.274 . . . . 0.6 111.643 -175.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.401 ' O ' HD21 ' A' ' 50' ' ' LEU . 87.7 mt -87.21 -58.18 0.29 Allowed Pre-proline 0 C--N 1.325 -0.495 0 N-CA-C 113.601 0.963 . . . . 0.83 113.601 -171.188 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.525 ' HB3' HG12 ' A' ' 22' ' ' VAL . 61.0 Cg_endo -68.81 156.46 65.36 Favored 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 121.406 1.404 . . . . 0.33 112.439 -168.613 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 96.67 -14.89 63.59 Favored Glycine 0 N--CA 1.446 -0.69 0 N-CA-C 109.895 -1.282 . . . . 0.31 109.895 -168.453 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.481 ' HA ' ' HB ' ' A' ' 9' ' ' VAL . 78.5 mt-30 -120.23 172.95 7.42 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 114.802 -0.699 . . . . 1.46 109.699 176.203 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.558 ' HB3' ' HB ' ' A' ' 19' ' ' THR . 4.4 mt-10 -97.21 108.92 21.75 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.902 -0.59 . . . . 1.12 110.307 177.279 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.418 HD22 ' N ' ' A' ' 50' ' ' LEU . 2.6 mm? -99.12 131.78 44.91 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.902 -0.59 . . . . 0.38 109.763 -179.472 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.551 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 8.1 p30 -75.31 163.38 27.53 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.157 -0.474 . . . . 1.39 110.819 179.486 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.44 HD13 HD12 ' A' ' 55' ' ' LEU . 4.4 mm? -52.03 -43.03 63.54 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 123.258 0.349 . . . . 0.92 111.77 -176.755 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.416 ' OG ' ' HA3' ' A' ' 16' ' ' GLY . 5.1 m -56.87 -49.18 76.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.882 0.372 . . . . 0.69 110.303 178.825 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -68.0 -29.19 68.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.011 -0.54 . . . . 1.74 111.467 178.673 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.551 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 77.4 mt -65.42 -43.05 91.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.998 0.428 . . . . 1.15 110.236 176.323 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 71.0 m80 -72.35 -33.97 67.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.512 -0.313 . . . . 2.83 110.465 178.396 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.25 -30.98 72.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.076 0.465 . . . . 0.31 110.617 177.339 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.53 -42.15 98.39 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.775 -0.648 . . . . 0.21 110.74 176.225 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.61 -34.41 78.16 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.916 -0.584 . . . . 0.14 110.821 178.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.32 -36.52 82.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.915 -0.584 . . . . 0.17 111.128 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.472 ' HD2' ' CD1' ' A' ' 42' ' ' LEU . 94.0 mtt180 -57.89 -41.41 82.48 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.107 -0.497 . . . . 0.36 110.428 177.543 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.675 HG12 HD13 ' A' ' 41' ' ' LEU . 68.3 mt -78.42 -34.9 18.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.526 -0.761 . . . . 0.16 110.533 -176.722 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.438 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -59.85 -47.39 91.23 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.765 -0.731 . . . . 0.22 111.692 176.279 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -71.28 -24.25 62.12 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.505 0.193 . . . . 2.17 110.917 177.222 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.439 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 93.1 t80 -60.36 -49.41 77.7 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.116 0.484 . . . . 0.21 110.019 176.673 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 8.1 m-85 -62.2 -42.27 99.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.593 -0.73 . . . . 0.21 110.721 176.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLN . . . . . 0.438 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 49.8 mt-30 -61.06 -36.0 78.45 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.109 -0.496 . . . . 1.21 111.093 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -62.22 -35.47 78.98 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.1 0.476 . . . . 1.68 110.347 176.55 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.439 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 73.1 mmtt -83.23 4.75 25.53 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.845 -0.616 . . . . 0.57 110.98 -176.794 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 98.97 -2.99 58.39 Favored Glycine 0 N--CA 1.449 -0.494 0 CA-C-N 116.01 -0.541 . . . . 0.31 112.706 177.041 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 45.9 m-85 -88.58 75.18 8.35 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.336 0.588 . . . . 0.39 109.721 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 21.9 t -74.07 -23.87 18.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.561 -0.745 . . . . 0.41 110.313 -177.45 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 86.0 mt -81.31 -3.03 51.31 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.848 -0.615 . . . . 1.76 110.806 178.767 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -102.23 147.16 26.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.918 -0.583 . . . . 0.37 110.996 -178.044 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 26.1 tpt180 -160.19 136.15 8.52 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.944 -0.571 . . . . 1.8 109.73 177.534 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -99.11 140.54 33.11 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.646 -0.252 . . . . 0.18 110.438 179.026 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 46.3 p90 -137.3 155.07 49.89 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.909 0.385 . . . . 0.38 110.407 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 9.9 tt -110.84 107.07 57.93 Favored Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 109.778 -0.453 . . . . 0.39 109.778 -178.674 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -76.91 83.39 2.12 Favored 'Trans proline' 0 C--O 1.233 0.268 0 C-N-CA 123.004 2.469 . . . . 1.12 112.298 -178.679 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -76.75 78.19 3.37 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.173 -0.467 . . . . 2.0 111.303 -176.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -145.78 -54.86 0.28 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.09 -0.505 . . . . 3.72 111.109 178.418 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 45.8 mm-40 -119.01 35.7 4.72 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.859 0.362 . . . . 3.76 110.921 -178.702 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 56.4 mt -92.67 127.88 44.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.26 -0.427 . . . . 1.23 110.437 178.31 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLN . . . . . 0.476 ' CD ' ' H ' ' A' ' 84' ' ' GLN . 5.0 pm0 -64.46 164.83 10.83 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.603 -0.726 . . . . 1.56 110.705 177.703 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -81.24 149.42 29.03 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.066 -0.515 . . . . 1.54 110.053 178.435 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLY . . . . . 0.56 ' O ' ' HA ' ' A' ' 22' ' ' VAL . . . 89.58 -90.3 1.62 Allowed Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 121.03 -0.605 . . . . 0.58 111.78 -176.731 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.424 HG23 ' HG3' ' A' ' 24' ' ' ARG . 85.5 m -72.87 120.96 19.23 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 117.191 0.496 . . . . 0.47 110.315 177.193 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 34.2 m -102.33 138.16 27.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 109.858 -0.423 . . . . 0.31 109.858 179.194 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.462 ' HD3' ' HB2' ' A' ' 28' ' ' SER . 23.0 ttm180 -107.19 129.01 54.91 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.15 0.5 . . . . 2.92 111.107 -177.476 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.453 ' HB ' HD13 ' A' ' 27' ' ' LEU . 56.6 mt -113.65 130.74 67.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.543 -0.753 . . . . 0.23 109.413 176.596 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -95.22 125.4 39.84 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.373 0.606 . . . . 1.33 110.36 -179.523 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 71.7 t -98.71 103.47 14.74 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 115.287 -0.869 . . . . 0.27 110.434 -177.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 52.3 tp -85.93 93.62 8.99 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.396 -0.594 . . . . 0.36 109.396 176.41 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -72.17 -18.98 61.82 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.121 -0.491 . . . . 0.49 110.423 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.157 0 CA-C-O 117.976 -1.458 . . . . 1.39 111.037 179.398 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.6 ttm . . . . . 0 N--CA 1.478 0.975 0 CA-C-O 120.895 0.378 . . . . 15.85 110.71 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -88.09 86.16 7.06 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.901 0.381 . . . . 12.76 111.066 -176.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 46.6 m80 -84.3 87.64 7.21 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.216 -0.447 . . . . 13.36 110.698 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 49.3 m-70 -76.18 -37.02 58.41 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.991 0.424 . . . . 10.71 110.16 178.425 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' HIS . . . . . 0.408 ' CD2' ' H ' ' A' ' 5' ' ' HIS . 6.3 p80 -86.27 126.71 34.5 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.911 -0.586 . . . . 9.04 110.135 177.57 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' HIS . . . . . 0.448 ' O ' HD22 ' A' ' 21' ' ' LEU . 88.1 m-70 -115.05 -179.75 3.72 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.64 -0.504 . . . . 9.79 109.64 -179.476 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 46.1 m80 57.96 66.14 1.17 Allowed 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.192 0.52 . . . . 7.41 110.028 -175.552 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 68.9 m-70 -70.78 141.21 51.42 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.362 -0.835 . . . . 6.44 112.497 -170.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 53.8 t -113.4 -39.64 3.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.761 0 CA-C-N 114.417 -1.265 . . . . 1.97 108.327 173.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.5 t70 171.61 121.61 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 114.926 -1.034 . . . . 4.2 109.856 175.689 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -116.65 25.2 10.74 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 122.017 0.913 . . . . 4.33 109.616 -179.414 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -82.76 -36.8 25.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.537 -0.756 . . . . 4.37 110.207 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -76.75 67.83 2.89 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.149 -0.478 . . . . 5.36 109.868 173.075 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.439 ' HG3' ' HA ' ' A' ' 18' ' ' PRO . 15.0 ttmm -100.24 -74.69 0.6 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.916 -0.584 . . . . 3.42 111.288 -175.074 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 64.8 mtm 52.54 76.62 0.18 Allowed 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.49 -0.777 . . . . 4.43 111.38 -177.363 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 106.33 -100.35 1.62 Allowed Glycine 0 N--CA 1.444 -0.768 0 C-N-CA 120.721 -0.752 . . . . 3.41 112.195 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -85.36 136.91 14.84 Favored Glycine 0 N--CA 1.444 -0.798 0 C-N-CA 120.705 -0.76 . . . . 2.09 112.455 -178.104 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.439 ' HA ' ' HG3' ' A' ' 14' ' ' LYS . 11.3 Cg_endo -55.52 147.48 58.17 Favored 'Trans proline' 0 C--O 1.236 0.376 0 C-N-CA 123.355 2.703 . . . . 1.16 112.014 177.611 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.555 ' HA ' ' HA ' ' A' ' 51' ' ' ASN . 40.6 p -64.28 140.41 58.87 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.919 -0.582 . . . . 0.73 111.418 -176.952 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 75.1 t -99.05 121.07 49.21 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-N 115.581 -0.736 . . . . 0.52 109.67 176.213 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.596 ' O ' ' HA2' ' A' ' 86' ' ' GLY . 50.8 tp -71.3 91.85 1.0 Allowed 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.574 -0.528 . . . . 0.91 109.574 176.175 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.596 HG12 ' HB3' ' A' ' 46' ' ' PRO . 61.7 t -68.71 113.54 4.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.932 0 CA-C-N 115.339 -0.846 . . . . 0.31 110.582 -178.132 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -92.84 -32.36 14.65 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.545 -0.752 . . . . 1.16 109.168 175.81 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 12.5 ptp180 -163.87 158.5 19.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.562 -0.745 . . . . 2.16 110.342 -179.362 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.56 ' CE1' HG11 ' A' ' 22' ' ' VAL . 31.9 m-85 -105.25 142.0 35.79 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.985 -0.552 . . . . 0.35 109.822 176.018 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 45.0 tp60 -123.16 128.27 49.83 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.198 -0.667 . . . . 1.37 109.198 178.469 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.52 HD13 ' HB ' ' A' ' 90' ' ' ILE . 3.9 mm? -103.36 133.39 48.5 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.124 0.488 . . . . 0.25 110.436 -177.814 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.485 ' O ' ' HA ' ' A' ' 91' ' ' GLU . 23.1 t -127.51 126.2 41.81 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.899 -0.592 . . . . 0.95 109.929 -178.332 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 100.97 -15.17 58.31 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.545 -0.836 . . . . 0.21 112.372 179.086 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 15.1 p-10 -72.38 136.21 46.06 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.754 0.312 . . . . 0.44 110.663 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.8 tpp180 -130.12 -39.28 1.37 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.248 -0.433 . . . . 2.48 110.708 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 24.0 tp60 -68.41 -40.24 81.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.012 0.434 . . . . 1.91 110.634 -179.022 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -126.59 134.66 50.75 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.027 -0.533 . . . . 0.25 109.64 179.737 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -79.31 176.19 9.91 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.943 -0.571 . . . . 0.62 111.593 -176.316 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.507 ' O ' HD13 ' A' ' 39' ' ' LEU . 6.4 m-20 -55.99 -57.01 13.9 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 116.147 -0.479 . . . . 0.59 110.991 -178.502 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.434 ' HA ' HD22 ' A' ' 39' ' ' LEU . 74.2 mtp180 -58.03 -34.77 70.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.233 -0.439 . . . . 3.66 111.502 -175.147 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 15.0 tpt180 -62.26 -46.14 90.14 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.096 -0.502 . . . . 2.3 110.684 176.699 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.546 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -78.08 -27.54 48.59 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.138 -0.483 . . . . 0.19 111.311 -178.139 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.507 HD13 ' O ' ' A' ' 35' ' ' ASP . 1.8 mp -57.18 -35.15 69.24 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.085 -0.507 . . . . 1.77 111.318 177.846 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.5 -25.51 66.13 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.042 -0.526 . . . . 0.3 111.697 178.884 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.575 HD13 HG12 ' A' ' 62' ' ' ILE . 4.0 mt -69.62 -28.06 65.61 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.155 0.503 . . . . 0.2 110.45 177.014 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.559 HD21 HD11 ' A' ' 62' ' ' ILE . 0.4 OUTLIER -106.53 13.27 28.55 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.898 -0.592 . . . . 0.22 110.164 -178.299 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 38.7 p-80 -48.86 -26.11 2.26 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.821 1.045 . . . . 0.55 113.821 -172.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -105.08 5.97 32.89 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 111.98 0.363 . . . . 0.6 111.98 -174.101 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 84.3 mt -94.67 -52.19 0.24 Allowed Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 113.84 1.052 . . . . 0.83 113.84 -173.657 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.596 ' HB3' HG12 ' A' ' 22' ' ' VAL . 71.8 Cg_endo -74.61 157.41 44.41 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 121.233 1.289 . . . . 0.33 112.254 -169.665 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 98.44 -5.9 60.86 Favored Glycine 0 N--CA 1.446 -0.648 0 N-CA-C 110.023 -1.231 . . . . 0.31 110.023 -169.267 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -121.15 170.52 9.48 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.733 -0.734 . . . . 1.46 109.085 176.253 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -100.07 107.56 19.5 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.477 -0.564 . . . . 1.12 109.477 176.395 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -101.01 122.91 44.36 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.595 -0.729 . . . . 0.38 110.376 -175.068 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.61 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 31.2 p-10 -72.26 166.3 22.71 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.553 -0.294 . . . . 1.39 110.805 177.587 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.485 ' HA ' HD12 ' A' ' 55' ' ' LEU . 4.6 mm? -48.34 -46.06 36.08 Favored 'General case' 0 C--N 1.329 -0.3 0 O-C-N 123.461 0.476 . . . . 0.92 111.585 -177.26 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.443 ' HA ' ' NE2' ' A' ' 56' ' ' HIS . 13.1 m -50.61 -53.53 30.01 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.878 -0.601 . . . . 0.69 111.113 178.605 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -72.7 -23.83 60.92 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.005 -0.543 . . . . 1.74 111.679 -178.202 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.61 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 85.5 mt -65.1 -53.0 52.18 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.579 -0.282 . . . . 1.15 110.9 179.426 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.443 ' NE2' ' HA ' ' A' ' 53' ' ' SER . 31.5 p80 -74.34 -23.46 59.04 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.396 -0.522 . . . . 2.83 111.203 -179.448 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.12 -33.85 75.23 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.989 0.423 . . . . 0.31 110.516 175.217 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.87 -34.87 76.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.782 -0.644 . . . . 0.21 110.854 176.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.98 -30.37 69.63 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.942 -0.572 . . . . 0.14 110.887 -179.401 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.85 -28.9 69.87 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.98 -0.555 . . . . 0.17 110.829 179.155 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 78.0 mtt180 -63.06 -39.84 95.91 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.161 0.505 . . . . 0.36 110.129 176.251 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.575 HG12 HD13 ' A' ' 41' ' ' LEU . 78.6 mt -79.05 -36.32 18.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.467 -0.788 . . . . 0.16 110.726 -177.294 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.633 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -59.94 -46.9 93.32 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.389 -0.91 . . . . 0.22 111.038 174.579 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.426 ' O ' ' HG3' ' A' ' 68' ' ' GLU . 21.6 t70 -63.51 -37.52 87.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.624 -0.288 . . . . 2.17 110.653 176.788 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.421 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 82.8 t80 -53.22 -53.5 49.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.918 -0.583 . . . . 0.21 110.834 177.003 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -59.63 -40.52 87.89 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.709 -0.678 . . . . 0.21 111.184 178.61 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLN . . . . . 0.633 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 78.4 mt-30 -61.69 -37.89 85.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.483 -0.326 . . . . 1.21 111.226 -178.451 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 64' ' ' ASP . 44.0 mt-10 -70.27 -19.67 63.1 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.058 0.456 . . . . 1.68 110.658 178.497 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.421 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 75.3 mmtt -90.74 6.47 43.98 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.022 -0.536 . . . . 0.57 110.326 177.931 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 97.54 -8.95 64.38 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 121.06 -0.59 . . . . 0.31 112.555 177.862 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -88.46 73.29 8.75 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.381 0.61 . . . . 0.39 109.8 -178.471 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 23.8 t -71.31 -28.57 32.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.45 -0.795 . . . . 0.41 110.927 -176.039 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 10.8 mp -82.4 -3.47 55.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.282 -0.417 . . . . 1.76 110.92 179.231 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -91.39 136.24 33.25 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.073 -0.512 . . . . 0.37 110.494 179.663 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 17.1 tpt180 -149.03 131.73 15.94 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.945 -0.57 . . . . 1.8 110.071 -179.467 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.75 138.36 36.02 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.029 -0.532 . . . . 0.18 109.93 176.273 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 52.9 p90 -137.45 155.49 49.26 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.555 -0.535 . . . . 0.38 109.555 179.526 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.433 HD13 ' HB3' ' A' ' 55' ' ' LEU . 3.8 tt -111.59 108.91 56.1 Favored Pre-proline 0 C--N 1.318 -0.782 0 N-CA-C 109.64 -0.504 . . . . 0.39 109.64 -179.389 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.49 ' HG3' ' OE2' ' A' ' 91' ' ' GLU . 36.8 Cg_endo -64.66 105.12 0.6 Allowed 'Trans proline' 0 C--O 1.234 0.319 0 C-N-CA 122.768 2.312 . . . . 1.12 112.165 -179.459 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -80.85 64.13 5.5 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.341 0.591 . . . . 2.0 110.81 -178.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -116.9 78.45 1.21 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.634 -0.712 . . . . 3.72 109.921 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 60.27 62.34 1.61 Allowed 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.964 -0.562 . . . . 3.76 110.716 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 56.4 mt -62.49 137.82 23.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.367 -0.833 . . . . 1.23 111.087 -178.311 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLN . . . . . 0.435 ' HB2' ' O ' ' A' ' 87' ' ' THR . 38.9 mt-30 -59.63 146.21 41.83 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.378 -0.828 . . . . 1.56 110.107 177.946 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -79.69 34.18 0.27 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.098 0.475 . . . . 1.54 111.525 -176.063 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLY . . . . . 0.596 ' HA2' ' O ' ' A' ' 21' ' ' LEU . . . -170.75 -51.06 0.04 OUTLIER Glycine 0 N--CA 1.445 -0.754 0 C-N-CA 121.032 -0.604 . . . . 0.58 111.94 -178.448 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.435 ' O ' ' HB2' ' A' ' 84' ' ' GLN . 12.5 m -98.32 121.16 39.91 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.772 0.32 . . . . 0.47 110.736 179.318 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.405 ' HB ' HD11 ' A' ' 78' ' ' LEU . 34.8 m -103.51 134.98 43.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 N-CA-C 109.658 -0.497 . . . . 0.31 109.658 176.407 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.484 ' O ' ' HD2' ' A' ' 79' ' ' PRO . 37.4 ttp180 -111.54 115.3 28.95 Favored 'General case' 0 C--N 1.32 -0.713 0 C-N-CA 120.554 -0.458 . . . . 2.92 110.968 -177.289 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.52 ' HB ' HD13 ' A' ' 27' ' ' LEU . 60.9 mt -101.88 126.21 55.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.789 -0.641 . . . . 0.23 109.779 177.813 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.49 ' OE2' ' HG3' ' A' ' 79' ' ' PRO . 53.8 mt-10 -94.76 125.23 39.28 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.17 0.509 . . . . 1.33 110.271 -179.652 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.402 ' CG2' HD12 ' A' ' 27' ' ' LEU . 40.2 t -101.63 100.97 11.43 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-N 115.513 -0.767 . . . . 0.27 110.588 -175.65 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 57.7 tp -86.18 90.05 8.02 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.359 -0.608 . . . . 0.36 109.359 176.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -68.47 -27.42 66.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.685 -0.688 . . . . 0.49 110.689 -176.633 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.153 0 CA-C-O 118.47 -1.183 . . . . 1.39 111.584 178.695 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 92.4 mmm . . . . . 0 N--CA 1.479 1.009 0 CA-C-O 120.985 0.422 . . . . 15.85 110.191 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -135.04 10.64 3.58 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.289 0.566 . . . . 12.76 110.292 178.551 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 13.7 m170 -82.1 150.69 27.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.718 -0.674 . . . . 13.36 109.908 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 37.8 m80 58.95 40.86 21.97 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.315 0.578 . . . . 10.71 109.886 -172.707 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 13.9 t-80 -165.77 -33.94 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.284 -0.871 . . . . 9.04 110.375 179.667 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -64.13 -36.5 84.24 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.313 -0.403 . . . . 9.79 110.342 178.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 11.9 p80 -137.37 117.26 13.22 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.11 0.481 . . . . 7.41 110.506 173.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 29.2 p80 -88.78 -6.66 57.25 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.318 0.58 . . . . 6.44 109.479 176.221 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.636 HG13 ' HG3' ' A' ' 49' ' ' GLU . 11.6 p -85.86 146.77 6.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.214 -0.903 . . . . 1.97 110.107 177.121 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -132.76 -173.02 3.06 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.443 -0.577 . . . . 4.2 109.443 176.472 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -66.61 87.76 0.13 Allowed 'General case' 0 C--O 1.234 0.278 0 CA-C-O 120.81 0.338 . . . . 4.33 110.971 178.519 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -78.29 -47.44 17.84 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.268 -0.424 . . . . 4.37 110.197 178.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -135.51 108.83 7.8 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.128 -0.487 . . . . 5.36 110.534 179.3 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -134.61 83.71 2.05 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.216 -0.661 . . . . 3.42 109.216 179.81 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 87.5 mtp -123.38 -47.23 2.0 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.17 -0.468 . . . . 4.43 110.989 179.348 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -82.49 -14.71 75.53 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.807 -0.711 . . . . 3.41 112.179 -178.608 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 172.5 163.09 25.76 Favored Glycine 0 N--CA 1.443 -0.835 0 N-CA-C 111.478 -0.649 . . . . 2.09 111.478 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -58.31 155.12 36.85 Favored 'Trans proline' 0 C--O 1.232 0.217 0 C-N-CA 123.186 2.591 . . . . 1.16 112.213 178.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.405 ' HA ' ' HA ' ' A' ' 51' ' ' ASN . 77.9 p -93.03 139.28 30.7 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-O 121.045 0.45 . . . . 0.73 110.41 -179.837 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 41.3 t -117.9 121.87 68.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 116.104 -0.498 . . . . 0.52 109.671 177.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.408 ' HB2' ' HG2' ' A' ' 49' ' ' GLU . 45.4 tp -68.51 97.52 0.78 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.189 0.518 . . . . 0.91 110.02 177.249 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.583 HG12 ' HB3' ' A' ' 46' ' ' PRO . 57.7 t -75.68 120.33 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.996 0 CA-C-N 115.43 -0.804 . . . . 0.31 109.798 178.503 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 66.7 mttt -104.13 -22.39 13.42 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.789 -0.641 . . . . 1.16 109.362 179.068 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -169.34 160.09 9.19 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.56 -0.745 . . . . 2.16 110.623 178.497 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.512 ' CE1' HG11 ' A' ' 22' ' ' VAL . 21.4 m-85 -111.31 148.06 33.75 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.742 -0.663 . . . . 0.35 109.231 176.034 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 60.4 tp60 -129.74 134.59 47.7 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 109.541 -0.54 . . . . 1.37 109.541 174.77 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.474 ' HG ' HD23 ' A' ' 38' ' ' LEU . 3.4 mm? -103.62 135.09 45.85 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 121.052 0.453 . . . . 0.25 109.995 -178.527 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.538 ' O ' ' HA ' ' A' ' 91' ' ' GLU . 45.2 m -129.35 120.49 25.67 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.902 -0.59 . . . . 0.95 110.255 177.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 111.86 -11.04 27.47 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.927 -0.654 . . . . 0.21 112.038 -179.21 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 17.7 p-10 -84.67 139.65 31.88 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.137 0.494 . . . . 0.44 110.802 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.9 tpp180 -136.67 -32.82 0.81 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.389 -0.823 . . . . 2.48 109.898 177.801 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -66.48 -40.14 89.16 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.985 -0.552 . . . . 1.91 111.307 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.425 ' CZ ' ' HG3' ' A' ' 69' ' ' LYS . 82.4 m-85 -126.34 137.39 53.46 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 110.104 -0.332 . . . . 0.25 110.104 179.197 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -72.91 168.1 19.64 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.972 -0.558 . . . . 0.62 110.923 -178.694 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.65 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 58.1 m-20 -53.61 -55.87 22.09 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 123.402 0.439 . . . . 0.59 111.326 -175.167 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.424 ' HA ' HD12 ' A' ' 39' ' ' LEU . 61.0 ttp180 -57.73 -37.48 73.64 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.354 -0.384 . . . . 3.66 111.581 -175.818 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 17.1 tpt180 -59.35 -36.0 74.91 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.107 0.479 . . . . 2.3 110.452 177.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.605 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -87.14 -24.51 24.49 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.952 -0.567 . . . . 0.19 110.929 179.57 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.65 ' HG ' ' O ' ' A' ' 35' ' ' ASP . 83.4 mt -66.07 -34.59 78.41 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.6 -0.273 . . . . 1.77 111.187 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.8 -23.46 63.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.172 -0.467 . . . . 0.3 111.311 178.709 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.614 HD13 HG12 ' A' ' 62' ' ' ILE . 5.7 mt -68.22 -29.6 68.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.026 0.441 . . . . 0.2 110.581 176.026 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.596 HD21 HD11 ' A' ' 62' ' ' ILE . 0.4 OUTLIER -107.34 13.14 27.38 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.076 -0.511 . . . . 0.22 110.347 -177.629 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 5.3 p80 -50.43 -26.32 4.91 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 113.047 0.758 . . . . 0.55 113.047 -173.114 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -97.94 0.99 47.51 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.216 0.45 . . . . 0.6 112.216 -173.599 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.476 ' O ' HD21 ' A' ' 50' ' ' LEU . 79.6 mt -93.51 -56.28 0.23 Allowed Pre-proline 0 C--N 1.324 -0.538 0 N-CA-C 113.731 1.012 . . . . 0.83 113.731 -173.778 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.583 ' HB3' HG12 ' A' ' 22' ' ' VAL . 87.5 Cg_endo -74.54 154.8 45.11 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 121.35 1.367 . . . . 0.33 112.587 -167.291 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 103.38 -8.68 52.74 Favored Glycine 0 N--CA 1.447 -0.583 0 N-CA-C 109.95 -1.26 . . . . 0.31 109.95 -169.307 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.582 ' HA ' HG11 ' A' ' 9' ' ' VAL . 97.6 mt-30 -122.87 167.5 13.46 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 114.637 -0.782 . . . . 1.46 109.458 176.174 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.636 ' HG3' HG13 ' A' ' 9' ' ' VAL . 39.4 mt-10 -98.86 89.75 4.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.532 0.682 . . . . 1.12 109.502 176.673 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.476 HD21 ' O ' ' A' ' 45' ' ' LEU . 1.9 mm? -79.52 135.69 36.7 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.739 -1.119 . . . . 0.38 109.946 -177.666 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.405 ' HA ' ' HA ' ' A' ' 19' ' ' THR . 2.7 p30 -81.51 161.48 23.59 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.215 -0.661 . . . . 1.39 109.215 175.2 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -46.67 -40.49 13.26 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 113.137 0.791 . . . . 0.92 113.137 -173.061 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.7 m -58.1 -38.06 75.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.931 0.396 . . . . 0.69 111.044 -178.556 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -72.49 -38.34 68.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.072 -0.513 . . . . 1.74 110.827 178.568 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.463 ' HB3' HD13 ' A' ' 78' ' ' LEU . 9.8 mp -60.56 -44.64 95.93 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.261 -0.427 . . . . 1.15 111.421 176.779 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 73.4 m80 -68.35 -31.79 71.42 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.893 -0.323 . . . . 2.83 110.73 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.13 -28.89 69.74 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.23 0.538 . . . . 0.31 110.453 177.885 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.81 -39.58 94.72 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.519 -0.764 . . . . 0.21 111.06 177.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.22 -34.72 78.66 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.858 -0.61 . . . . 0.14 111.231 -178.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.88 -35.87 82.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 0.17 110.947 -179.453 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 -58.82 -38.77 79.38 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.879 -0.6 . . . . 0.36 110.446 178.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.614 HG12 HD13 ' A' ' 41' ' ' LEU . 66.2 mt -79.52 -37.77 18.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.285 -0.871 . . . . 0.16 110.871 -175.094 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -61.5 -44.65 97.72 Favored Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 120.389 -0.91 . . . . 0.22 111.65 177.352 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -73.96 -24.23 59.61 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.619 0.247 . . . . 2.17 110.874 178.112 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.468 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 91.3 t80 -59.78 -48.8 80.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.121 0.486 . . . . 0.21 109.862 174.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' TYR . . . . . 0.447 ' HB3' ' HB2' ' A' ' 71' ' ' TYR . 10.0 m-85 -59.82 -46.03 90.53 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.463 -0.79 . . . . 0.21 111.173 177.766 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 17.6 mt-30 -59.83 -38.61 82.54 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.464 -0.334 . . . . 1.21 111.083 -179.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -61.91 -35.58 78.8 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.554 -0.535 . . . . 1.68 109.554 178.57 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.468 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 69.6 mmtt -82.58 2.6 32.39 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.837 -0.619 . . . . 0.57 111.113 -179.314 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 106.51 -7.78 39.91 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 121.047 -0.597 . . . . 0.31 112.936 175.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' TYR . . . . . 0.447 ' HB2' ' HB3' ' A' ' 66' ' ' TYR . 70.5 m-85 -89.26 73.68 8.01 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.153 0.502 . . . . 0.39 109.805 -179.702 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 43.8 t -69.04 -29.02 41.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.779 -0.646 . . . . 0.41 111.204 -175.382 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 67.3 mt -91.38 22.68 3.78 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.026 0.441 . . . . 1.76 111.042 177.736 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.416 ' HB1' ' HA ' ' A' ' 94' ' ' GLU . . . -121.22 120.29 34.77 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.068 -0.515 . . . . 0.37 110.547 178.778 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 19.5 mmm180 -128.95 170.82 12.97 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.073 -0.512 . . . . 1.8 109.739 177.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -133.18 132.75 41.93 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 109.707 -0.479 . . . . 0.18 109.707 178.056 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 51.0 p90 -129.3 143.39 50.83 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.847 0.356 . . . . 0.38 110.171 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.492 HD23 ' H ' ' A' ' 80' ' ' ALA . 6.6 tt -93.7 107.43 27.17 Favored Pre-proline 0 C--N 1.319 -0.732 0 N-CA-C 108.948 -0.76 . . . . 0.39 108.948 178.841 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.427 ' HD2' ' HA ' ' A' ' 78' ' ' LEU . 12.4 Cg_endo -55.8 -34.7 91.97 Favored 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 123.534 2.823 . . . . 1.12 112.881 -175.766 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.492 ' H ' HD23 ' A' ' 78' ' ' LEU . . . 63.75 -96.23 0.05 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.259 -0.882 . . . . 2.0 111.215 178.364 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 67.58 -64.84 0.26 Allowed 'General case' 0 N--CA 1.467 0.376 0 O-C-N 123.889 0.743 . . . . 3.72 110.724 -177.849 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.428 ' O ' ' HB ' ' A' ' 83' ' ' ILE . 34.0 tt0 -139.95 -49.19 0.47 Allowed 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.536 -0.542 . . . . 3.76 109.536 177.865 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.428 ' HB ' ' O ' ' A' ' 82' ' ' GLU . 39.4 mt 75.07 142.16 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 CA-C-N 115.714 -0.675 . . . . 1.23 111.485 179.397 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -87.64 157.28 19.14 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.393 -0.821 . . . . 1.56 110.593 -176.045 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -76.82 85.54 3.41 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.141 0.496 . . . . 1.54 110.417 177.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 128.61 -58.71 0.7 Allowed Glycine 0 N--CA 1.443 -0.838 0 C-N-CA 120.661 -0.781 . . . . 0.58 112.352 177.664 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 19.6 m -91.91 120.66 32.79 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 120.925 0.393 . . . . 0.47 110.627 179.251 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 31.0 m -108.53 132.52 56.19 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 N-CA-C 109.258 -0.645 . . . . 0.31 109.258 175.195 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.49 ' HD3' ' OG ' ' A' ' 28' ' ' SER . 27.2 ttm180 -109.32 128.79 55.37 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 121.13 0.49 . . . . 2.92 110.9 -176.233 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 59.5 mt -113.45 135.06 54.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.399 -0.819 . . . . 0.23 109.696 178.709 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.538 ' HA ' ' O ' ' A' ' 28' ' ' SER . 45.8 mt-10 -94.91 122.46 37.56 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.227 0.537 . . . . 1.33 110.318 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 60.0 t -98.35 123.75 51.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 115.493 -0.776 . . . . 0.27 110.103 -178.751 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 47.6 tp -108.97 94.8 5.24 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 109.315 -0.624 . . . . 0.36 109.315 178.542 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.416 ' HA ' ' HB1' ' A' ' 74' ' ' ALA . 48.1 mt-10 -77.4 2.56 15.64 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.628 -0.715 . . . . 0.49 111.035 -174.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.782 0 CA-C-O 118.818 -0.99 . . . . 1.39 112.08 177.212 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 83.5 mtp . . . . . 0 N--CA 1.478 0.947 0 N-CA-C 110.262 -0.273 . . . . 15.85 110.262 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -68.03 109.3 3.42 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.27 -0.423 . . . . 12.76 110.584 -178.249 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 57.8 m80 -88.66 31.98 0.81 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.146 -0.479 . . . . 13.36 111.194 -176.121 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 7.3 p80 -148.97 115.99 6.04 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.207 0.527 . . . . 10.71 110.024 177.252 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 62.2 m80 -86.33 -14.75 42.66 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.248 0.547 . . . . 9.04 109.767 177.115 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 21.3 m-70 -86.22 123.89 32.0 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.525 -0.761 . . . . 9.79 109.669 175.758 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 79.4 m80 -100.75 -1.67 34.41 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.245 -0.434 . . . . 7.41 110.491 -179.501 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 31.2 m170 -105.9 40.8 1.5 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.07 -0.514 . . . . 6.44 110.11 177.089 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.438 HG22 ' O ' ' A' ' 47' ' ' GLY . 60.2 t -65.83 121.62 15.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.113 0.483 . . . . 1.97 110.145 178.523 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.565 ' H ' ' HG2' ' A' ' 48' ' ' GLN . 53.3 m-20 -109.24 148.03 31.63 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.622 -0.717 . . . . 4.2 110.823 -175.457 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -80.57 -15.88 55.56 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 108.688 -0.856 . . . . 4.33 108.688 172.151 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 17.6 t70 66.57 -79.55 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 114.455 -1.248 . . . . 4.37 111.237 176.594 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -169.69 90.75 0.2 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.95 0.405 . . . . 5.36 110.095 178.26 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 4.7 tmmm? -75.07 82.79 2.28 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.943 -0.572 . . . . 3.42 110.218 -179.031 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 87.9 mmm -136.63 136.05 38.83 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.733 -0.667 . . . . 4.43 109.609 175.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 85.19 -2.64 88.1 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.716 -0.754 . . . . 3.41 111.91 -176.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 160.67 145.51 4.31 Favored Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 121.23 -0.51 . . . . 2.09 112.246 178.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -54.01 157.03 11.46 Favored 'Trans proline' 0 C--O 1.235 0.343 0 C-N-CA 123.83 3.02 . . . . 1.16 113.21 175.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.502 ' HA ' ' HA ' ' A' ' 51' ' ' ASN . 25.1 p -98.47 140.15 33.15 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.707 -0.679 . . . . 0.73 111.529 -177.842 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 50.0 t -117.27 121.48 67.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.806 -0.633 . . . . 0.52 109.787 177.339 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.494 ' HA ' ' HA ' ' A' ' 49' ' ' GLU . 55.3 tp -65.66 115.76 6.17 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.021 0.439 . . . . 0.91 110.247 177.729 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.591 HG12 ' HB3' ' A' ' 46' ' ' PRO . 48.5 t -95.54 121.67 46.3 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 CA-C-N 115.842 -0.617 . . . . 0.31 110.353 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 80.2 mttt -107.35 -27.22 10.61 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.589 -0.732 . . . . 1.16 109.704 177.203 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.8 ptp180 -161.74 161.71 29.39 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.837 -0.619 . . . . 2.16 110.876 177.303 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.521 ' CE2' ' HG ' ' A' ' 42' ' ' LEU . 29.2 m-85 -110.72 137.04 48.9 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.715 -0.675 . . . . 0.35 109.799 176.913 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 19.2 tp60 -119.12 129.45 55.05 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.409 -0.589 . . . . 1.37 109.409 177.789 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.534 HD13 ' HB ' ' A' ' 90' ' ' ILE . 3.8 mm? -103.02 132.68 49.11 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.259 0.552 . . . . 0.25 110.113 -179.63 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 48.1 t -121.71 122.16 38.92 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.495 -0.775 . . . . 0.95 109.667 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 103.79 -16.11 51.53 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.625 -0.798 . . . . 0.21 112.331 179.022 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 20.7 p-10 -69.18 126.53 30.08 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.051 0.453 . . . . 0.44 110.367 179.02 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.576 ' NE ' ' HA ' ' A' ' 31' ' ' ARG . 1.9 mmp_? -125.97 -34.64 2.55 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.266 -0.425 . . . . 2.48 110.678 179.435 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.431 ' HG2' ' CZ ' ' A' ' 71' ' ' TYR . 57.5 tp60 -75.17 -38.29 60.94 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.258 -0.428 . . . . 1.91 110.598 -179.697 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -123.44 146.91 47.65 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.605 -0.517 . . . . 0.25 109.605 178.515 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -92.41 169.71 10.35 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.27 -0.423 . . . . 0.62 111.233 -176.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.527 ' O ' HD13 ' A' ' 39' ' ' LEU . 4.1 m-20 -56.07 -52.87 62.74 Favored 'General case' 0 CA--C 1.517 -0.323 0 O-C-N 123.258 0.349 . . . . 0.59 110.616 -177.579 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 61.9 ttp180 -52.79 -39.61 62.46 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.307 -0.406 . . . . 3.66 111.1 -177.694 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 15.4 tpt180 -63.75 -50.09 70.45 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.925 -0.58 . . . . 2.3 111.094 178.4 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.528 HD23 ' HG ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -73.56 -26.79 61.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.844 0.354 . . . . 0.19 111.261 -176.736 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.527 HD13 ' O ' ' A' ' 35' ' ' ASP . 2.3 mp -60.14 -32.93 71.48 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.154 -0.475 . . . . 1.77 111.781 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.54 -25.58 66.25 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.146 -0.479 . . . . 0.3 111.452 179.142 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.523 HD13 HG12 ' A' ' 62' ' ' ILE . 1.7 mt -70.12 -27.49 64.62 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.888 0.375 . . . . 0.2 110.431 176.826 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.616 HD21 HD11 ' A' ' 62' ' ' ILE . 0.4 OUTLIER -107.55 13.32 26.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.94 -0.573 . . . . 0.22 110.447 -177.184 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 6.5 p80 -51.92 -24.77 6.85 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.798 -0.637 . . . . 0.55 112.554 -173.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -101.02 3.38 41.43 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.369 0.507 . . . . 0.6 112.369 -172.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 86.9 mt -95.53 -54.87 0.22 Allowed Pre-proline 0 C--N 1.323 -0.556 0 N-CA-C 113.932 1.086 . . . . 0.83 113.932 -172.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.591 ' HB3' HG12 ' A' ' 22' ' ' VAL . 75.3 Cg_endo -73.41 161.38 42.69 Favored 'Trans proline' 0 C--N 1.351 0.697 0 C-N-CA 121.318 1.345 . . . . 0.33 112.678 -168.205 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.438 ' O ' HG22 ' A' ' 9' ' ' VAL . . . 100.87 3.98 54.63 Favored Glycine 0 N--CA 1.449 -0.477 0 N-CA-C 110.594 -1.002 . . . . 0.31 110.594 -170.275 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.565 ' HG2' ' H ' ' A' ' 10' ' ' ASP . 78.2 mt-30 -143.07 170.23 16.11 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.858 -0.671 . . . . 1.46 109.282 177.898 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.494 ' HA ' ' HA ' ' A' ' 21' ' ' LEU . 35.9 mt-10 -98.46 96.04 7.73 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.384 0.611 . . . . 1.12 109.679 178.235 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.42 ' HA ' ' OE1' ' A' ' 54' ' ' GLN . 2.7 mm? -83.72 140.77 31.91 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.068 -0.969 . . . . 0.38 109.604 -178.216 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.502 ' HA ' ' HA ' ' A' ' 19' ' ' THR . 9.6 p30 -88.87 161.55 16.63 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.484 -0.561 . . . . 1.39 109.484 178.901 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -45.08 -43.4 9.52 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.462 0.912 . . . . 0.92 113.462 -172.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.658 ' HA ' ' NE2' ' A' ' 56' ' ' HIS . 50.0 m -58.61 -37.12 75.17 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.929 0.395 . . . . 0.69 110.971 179.562 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.42 ' OE1' ' HA ' ' A' ' 50' ' ' LEU . 99.5 mt-30 -72.2 -38.67 69.0 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.656 -0.702 . . . . 1.74 110.56 179.043 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.655 ' HB3' HD13 ' A' ' 78' ' ' LEU . 9.4 mp -58.87 -54.78 43.23 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 112.62 0.6 . . . . 1.15 112.62 179.206 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.658 ' NE2' ' HA ' ' A' ' 53' ' ' SER . 32.7 p80 -72.76 -23.48 60.83 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.014 -0.674 . . . . 2.83 111.294 -177.579 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.07 -32.94 73.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.288 0.565 . . . . 0.31 109.976 173.656 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.415 ' HB3' ' O ' ' A' ' 55' ' ' LEU . . . -63.63 -37.79 88.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.392 -0.822 . . . . 0.21 110.638 175.393 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.07 -34.03 77.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.733 -0.667 . . . . 0.14 110.686 179.182 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.58 -35.0 78.12 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.929 -0.578 . . . . 0.17 111.013 178.446 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 88.6 mtt180 -59.06 -42.38 90.18 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.24 0.543 . . . . 0.36 109.976 177.149 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.616 HD11 HD21 ' A' ' 42' ' ' LEU . 80.9 mt -77.6 -37.39 24.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.398 -0.819 . . . . 0.16 110.3 -177.349 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.606 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -57.55 -46.48 91.99 Favored Glycine 0 N--CA 1.442 -0.909 0 CA-C-N 115.447 -0.797 . . . . 0.22 111.583 176.168 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -68.97 -33.51 73.8 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.61 0.243 . . . . 2.17 110.395 177.844 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.581 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 76.8 t80 -54.68 -49.38 70.79 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.016 -0.538 . . . . 0.21 110.508 177.577 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -62.12 -47.16 85.85 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.004 -0.544 . . . . 0.21 111.159 178.23 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLN . . . . . 0.606 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 74.7 mt-30 -57.48 -41.72 81.2 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.359 0.599 . . . . 1.21 110.45 179.49 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -58.37 -38.55 77.48 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.135 -0.939 . . . . 1.68 110.798 178.003 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.581 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 68.9 mmtt -82.33 2.88 30.1 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.937 -0.574 . . . . 0.57 111.058 -177.302 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.31 -14.6 30.57 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 121.017 -0.611 . . . . 0.31 112.683 176.551 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' TYR . . . . . 0.431 ' CZ ' ' HG2' ' A' ' 32' ' ' GLN . 60.7 m-85 -83.33 69.49 9.99 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.182 0.515 . . . . 0.39 110.239 -177.37 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 41.1 t -69.89 -23.95 26.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.776 -0.647 . . . . 0.41 110.841 -177.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 95.0 mt -83.04 -3.2 57.0 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 1.76 110.811 178.25 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -101.08 144.12 30.37 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.914 -0.585 . . . . 0.37 110.867 -178.281 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.401 HH11 ' NE2' ' A' ' 67' ' ' GLN . 20.7 tpt180 -154.33 137.33 15.49 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.015 -0.539 . . . . 1.8 110.033 178.022 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -102.41 135.49 43.94 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.271 -0.422 . . . . 0.18 110.141 177.836 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 48.7 p90 -135.6 151.06 49.9 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.722 -0.473 . . . . 0.38 109.722 179.436 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.655 HD13 ' HB3' ' A' ' 55' ' ' LEU . 6.7 tt -107.54 109.47 62.53 Favored Pre-proline 0 C--N 1.32 -0.704 0 N-CA-C 109.5 -0.556 . . . . 0.39 109.5 -179.487 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.69 116.78 4.85 Favored 'Trans proline' 0 N--CA 1.46 -0.469 0 C-N-CA 122.609 2.206 . . . . 1.12 112.06 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.76 54.85 2.82 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.269 0.557 . . . . 2.0 110.217 178.527 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -93.65 -49.98 5.61 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.563 -0.744 . . . . 3.72 111.0 -175.072 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -132.25 -70.06 0.57 Allowed 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.449 -0.574 . . . . 3.76 109.449 -177.044 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 38.6 mt 58.2 80.09 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.367 0 CA-C-N 115.593 -0.73 . . . . 1.23 111.127 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -57.28 130.03 44.41 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.414 -0.812 . . . . 1.56 110.159 174.754 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -52.56 122.53 9.11 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.303 0.573 . . . . 1.54 110.786 -177.431 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 109.91 -41.89 2.11 Favored Glycine 0 N--CA 1.444 -0.816 0 C-N-CA 120.843 -0.694 . . . . 0.58 112.469 -178.038 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 20.4 m -117.81 120.77 38.92 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 120.866 0.365 . . . . 0.47 110.802 -177.245 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 34.3 m -103.1 137.02 32.93 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 109.638 -0.504 . . . . 0.31 109.638 176.119 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 30.4 ttm180 -113.58 117.6 32.07 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.122 0.486 . . . . 2.92 110.778 -177.678 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.534 ' HB ' HD13 ' A' ' 27' ' ' LEU . 70.0 mt -103.83 129.73 55.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.465 -0.789 . . . . 0.23 109.605 177.609 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -94.7 123.61 38.24 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.147 0.499 . . . . 1.33 110.266 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 40.6 t -101.8 108.28 23.38 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 115.552 -0.749 . . . . 0.27 110.256 -178.211 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 62.0 tp -90.11 96.57 10.73 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.236 -0.653 . . . . 0.36 109.236 175.52 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.444 ' OE1' ' HB2' ' A' ' 31' ' ' ARG . 43.6 mt-10 -76.68 -31.13 57.06 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.016 0.436 . . . . 0.49 110.461 -177.219 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.869 0 CA-C-O 118.244 -1.309 . . . . 1.39 111.562 178.246 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.8 ptp . . . . . 0 N--CA 1.483 1.222 0 CA-C-O 120.457 0.17 . . . . 15.85 111.194 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.23 -35.1 73.63 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.017 0.437 . . . . 12.76 110.293 179.453 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 9.8 t-80 -82.23 86.45 6.65 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.791 -0.64 . . . . 13.36 109.357 177.29 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 50.6 m80 -70.33 120.66 16.33 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.38 -0.827 . . . . 10.71 111.499 -173.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 28.8 p-80 -94.09 98.17 10.81 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.588 0.708 . . . . 9.04 110.508 177.538 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 43.1 t-80 -86.21 -28.68 23.72 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.61 -0.723 . . . . 9.79 110.243 -179.249 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -143.2 81.24 1.71 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.347 0.594 . . . . 7.41 111.07 -178.521 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 28.7 t-80 -73.67 89.78 1.78 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.863 -0.608 . . . . 6.44 109.874 176.456 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 60.4 t -75.68 87.57 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-O 121.396 0.617 . . . . 1.97 110.399 179.313 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -68.86 125.34 26.29 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.187 -0.915 . . . . 4.2 109.529 177.532 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -54.09 120.37 6.34 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.491 0.662 . . . . 4.33 111.507 -175.454 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -107.25 -2.33 20.89 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.36 -0.836 . . . . 4.37 110.938 -178.239 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -137.79 137.7 38.48 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.219 -0.446 . . . . 5.36 110.631 -177.821 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.425 ' HD2' ' O ' ' A' ' 14' ' ' LYS . 1.1 tmmm? -148.5 48.36 1.03 Allowed 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 107.914 -1.143 . . . . 3.42 107.914 170.038 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 87.0 mtp -105.79 -26.03 11.93 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.359 -0.837 . . . . 4.43 109.844 178.253 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLY . . . . . 0.453 ' O ' ' HB2' ' A' ' 52' ' ' LEU . . . -108.81 47.35 1.05 Allowed Glycine 0 N--CA 1.444 -0.831 0 CA-C-N 115.544 -0.753 . . . . 3.41 111.383 176.69 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 89.09 161.93 37.99 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 121.041 -0.599 . . . . 2.09 112.241 -179.115 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -63.46 132.43 35.72 Favored 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 122.57 2.18 . . . . 1.16 111.709 176.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.548 ' HB ' ' HB3' ' A' ' 49' ' ' GLU . 29.6 p -73.01 145.5 46.62 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.401 0.619 . . . . 0.73 112.229 -175.239 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.506 HG13 ' HA ' ' A' ' 85' ' ' ASP . 38.3 t -113.89 123.22 69.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 115.114 -0.948 . . . . 0.52 109.61 175.839 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.431 ' O ' ' HA2' ' A' ' 86' ' ' GLY . 42.8 tp -71.99 90.66 1.17 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.233 0.539 . . . . 0.91 110.194 176.417 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.544 HG12 ' HB3' ' A' ' 46' ' ' PRO . 56.7 t -72.85 129.33 35.99 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 CA-C-N 115.27 -0.877 . . . . 0.31 110.77 -177.314 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 54.5 mttp -112.48 -25.15 9.32 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.654 -0.703 . . . . 1.16 109.586 177.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 13.1 ptp180 -163.22 157.43 20.36 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.791 -0.64 . . . . 2.16 110.811 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.51 ' CE2' ' HG ' ' A' ' 42' ' ' LEU . 22.4 m-85 -111.27 149.03 31.63 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.664 -0.698 . . . . 0.35 109.915 177.561 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.406 ' O ' ' HA ' ' A' ' 89' ' ' ARG . 59.6 tp60 -130.27 135.38 48.05 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 109.454 -0.573 . . . . 1.37 109.454 176.302 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.47 ' HG ' HD23 ' A' ' 38' ' ' LEU . 3.6 mm? -103.73 143.43 32.8 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.004 0.431 . . . . 0.25 110.058 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 28.5 t -128.83 133.88 48.14 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.95 -0.568 . . . . 0.95 109.996 -179.607 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 84.74 -3.77 86.17 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.714 -0.755 . . . . 0.21 112.575 178.725 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 20.6 p-10 -76.06 130.36 38.23 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.964 0.411 . . . . 0.44 110.954 179.305 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.479 ' NE ' ' HA ' ' A' ' 31' ' ' ARG . 4.7 tpm_? -137.15 -33.42 0.75 Allowed 'General case' 0 C--N 1.321 -0.63 0 CA-C-N 116.291 -0.413 . . . . 2.48 110.639 178.419 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 86.7 mm-40 -68.14 -36.8 80.27 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.207 -0.452 . . . . 1.91 110.396 177.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.44 ' CZ ' ' HG3' ' A' ' 69' ' ' LYS . 86.7 m-85 -129.48 137.41 50.82 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.084 -0.507 . . . . 0.25 109.993 176.371 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.605 ' OD1' ' HB3' ' A' ' 36' ' ' ARG . 4.1 p30 -74.61 164.26 26.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.122 -0.49 . . . . 0.62 110.839 -179.414 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.675 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 3.8 m-20 -50.46 -55.24 16.79 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 123.393 0.433 . . . . 0.59 110.804 -177.553 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.605 ' HB3' ' OD1' ' A' ' 34' ' ' ASP . 6.0 ttp180 -46.25 -48.17 17.95 Favored 'General case' 0 C--N 1.33 -0.278 0 O-C-N 123.814 0.696 . . . . 3.66 111.999 178.385 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -59.04 -35.46 73.35 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.964 -0.562 . . . . 2.3 110.96 -178.321 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.593 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -87.22 -26.23 23.62 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.21 -0.45 . . . . 0.19 111.085 -179.913 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.675 ' HG ' ' O ' ' A' ' 35' ' ' ASP . 92.9 mt -62.98 -34.39 77.41 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.763 0.316 . . . . 1.77 111.204 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.29 -23.46 65.71 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.027 -0.533 . . . . 0.3 111.305 178.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.604 HD13 HG12 ' A' ' 62' ' ' ILE . 5.2 mt -70.0 -26.98 64.33 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.864 0.364 . . . . 0.2 110.659 177.366 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.627 HD21 HD11 ' A' ' 62' ' ' ILE . 0.4 OUTLIER -109.08 12.9 24.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.237 -0.438 . . . . 0.22 110.39 -178.026 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 27.6 p-80 -51.39 -26.55 8.04 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.768 0.655 . . . . 0.55 112.768 -174.371 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -104.84 11.82 33.3 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.137 0.421 . . . . 0.6 112.137 -173.54 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 81.5 mt -99.56 -54.54 0.17 Allowed Pre-proline 0 C--N 1.324 -0.501 0 N-CA-C 113.723 1.008 . . . . 0.83 113.723 -176.039 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.544 ' HB3' HG12 ' A' ' 22' ' ' VAL . 72.5 Cg_endo -73.37 165.75 31.71 Favored 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 121.324 1.349 . . . . 0.33 112.845 -168.441 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 97.74 -12.42 64.38 Favored Glycine 0 N--CA 1.446 -0.682 0 N-CA-C 110.371 -1.092 . . . . 0.31 110.371 -171.323 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 53.3 mt-30 -117.11 175.06 5.77 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.66 -0.77 . . . . 1.46 109.559 176.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.548 ' HB3' ' HB ' ' A' ' 19' ' ' THR . 17.9 mt-10 -99.5 101.18 12.34 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 121.283 0.563 . . . . 1.12 109.816 174.358 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.51 131.97 35.28 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.189 -0.914 . . . . 0.38 110.097 -176.16 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.643 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 33.4 p30 -80.84 170.52 16.18 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 121.124 -0.23 . . . . 1.39 110.452 178.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.508 ' HA ' HD12 ' A' ' 55' ' ' LEU . 4.4 mm? -50.73 -43.38 58.06 Favored 'General case' 0 N--CA 1.465 0.298 0 O-C-N 123.141 0.275 . . . . 0.92 111.235 -177.535 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.49 ' HA ' ' NE2' ' A' ' 56' ' ' HIS . 14.9 m -54.39 -55.71 25.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.021 -0.536 . . . . 0.69 110.619 178.375 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -62.62 -34.24 76.64 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.831 -0.622 . . . . 1.74 111.223 -179.629 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.643 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 89.8 mt -59.65 -57.0 14.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 1.15 111.167 179.566 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.49 ' NE2' ' HA ' ' A' ' 53' ' ' SER . 34.5 p80 -74.0 -23.86 59.5 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.314 -0.554 . . . . 2.83 110.867 -178.407 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.1 -30.95 72.0 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.98 0.419 . . . . 0.31 110.491 174.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.61 -38.94 86.35 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.885 -0.598 . . . . 0.21 110.335 174.692 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.56 -32.93 74.03 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.622 -0.717 . . . . 0.14 110.841 179.179 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.91 -32.16 73.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.965 -0.562 . . . . 0.17 110.897 178.602 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 74.8 mtt180 -62.68 -39.51 94.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.915 -0.584 . . . . 0.36 110.175 176.266 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.627 HD11 HD21 ' A' ' 42' ' ' LEU . 68.7 mt -79.8 -37.29 18.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.453 -0.794 . . . . 0.16 110.99 -175.338 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.571 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -59.66 -47.88 88.75 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.615 -0.803 . . . . 0.22 111.556 177.39 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.422 ' O ' ' HG3' ' A' ' 68' ' ' GLU . 28.5 t70 -68.86 -31.62 70.69 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.731 0.301 . . . . 2.17 110.57 178.556 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.458 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 90.7 t80 -57.54 -51.37 69.75 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.092 -0.504 . . . . 0.21 110.267 176.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' TYR . . . . . 0.429 ' HB3' ' HB2' ' A' ' 71' ' ' TYR . 4.3 m-85 -57.65 -42.54 83.65 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.537 -0.756 . . . . 0.21 110.749 177.162 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLN . . . . . 0.571 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 91.0 mt-30 -62.07 -35.32 78.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 1.21 111.347 -178.77 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.422 ' HG3' ' O ' ' A' ' 64' ' ' ASP . 43.6 mt-10 -71.19 -23.31 62.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.873 0.368 . . . . 1.68 110.837 179.309 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.458 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 74.5 mmtt -91.41 1.88 56.8 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.061 -0.518 . . . . 0.57 110.676 -179.583 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.25 -14.17 28.26 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.734 -0.745 . . . . 0.31 112.86 176.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' TYR . . . . . 0.429 ' HB2' ' HB3' ' A' ' 66' ' ' TYR . 55.0 m-85 -87.06 67.66 9.8 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.243 0.544 . . . . 0.39 109.852 -178.762 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 22.0 t -68.93 -23.43 27.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.735 -0.666 . . . . 0.41 110.889 -175.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 97.8 mt -86.09 -8.54 57.82 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.04 -0.527 . . . . 1.76 111.111 179.285 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -82.98 140.45 32.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.17 -0.468 . . . . 0.37 110.574 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 5.0 tpp180 -144.54 131.71 20.59 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.166 -0.47 . . . . 1.8 109.884 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -102.51 136.28 42.62 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.97 -0.381 . . . . 0.18 109.97 177.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 52.8 p90 -137.75 151.54 48.27 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.869 -0.419 . . . . 0.38 109.869 179.359 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.433 ' HA ' ' HD2' ' A' ' 79' ' ' PRO . 7.1 tt -105.89 113.04 64.2 Favored Pre-proline 0 C--N 1.32 -0.681 0 N-CA-C 109.908 -0.404 . . . . 0.39 109.908 -178.509 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.455 ' HD2' ' O ' ' A' ' 89' ' ' ARG . 35.3 Cg_endo -64.94 100.54 0.36 Allowed 'Trans proline' 0 C--O 1.234 0.317 0 C-N-CA 122.748 2.299 . . . . 1.12 111.459 176.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -95.27 33.68 1.53 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.944 -0.571 . . . . 2.0 111.654 -173.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 54.8 tp60 -76.79 -52.78 8.91 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.502 -0.555 . . . . 3.72 109.502 177.269 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -137.5 120.11 16.11 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.853 -0.612 . . . . 3.76 109.73 175.467 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 45.5 mt -125.85 111.77 28.14 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-N 116.316 -0.402 . . . . 1.23 110.714 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLN . . . . . 0.522 ' CD ' ' H ' ' A' ' 84' ' ' GLN . 1.9 pm0 -64.51 145.5 56.02 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.598 -0.728 . . . . 1.56 109.938 174.034 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.506 ' HA ' HG13 ' A' ' 20' ' ' VAL . 9.8 p-10 -75.53 74.85 2.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.777 0.799 . . . . 1.54 111.553 -175.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLY . . . . . 0.431 ' HA2' ' O ' ' A' ' 21' ' ' LEU . . . 162.92 -57.42 0.29 Allowed Glycine 0 N--CA 1.444 -0.831 0 CA-C-N 115.699 -0.682 . . . . 0.58 111.572 176.823 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 24.3 m -96.33 120.87 37.42 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-O 120.84 0.352 . . . . 0.47 110.676 177.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 35.0 m -111.4 134.94 52.16 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 N-CA-C 109.201 -0.666 . . . . 0.31 109.201 175.014 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.455 ' O ' ' HD2' ' A' ' 79' ' ' PRO . 15.6 ttp180 -113.11 131.0 56.0 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 120.177 -0.609 . . . . 2.92 110.666 -177.807 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 72.4 mt -112.63 131.05 65.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 115.354 -0.839 . . . . 0.23 109.696 179.034 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -94.07 126.33 39.23 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.43 0.633 . . . . 1.33 109.986 179.468 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 66.0 t -100.76 101.45 12.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 CA-C-N 115.161 -0.927 . . . . 0.27 110.562 -176.273 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 63.1 tp -83.93 92.39 7.8 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.898 -0.779 . . . . 0.36 108.898 175.019 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 57.8 mt-10 -69.47 -17.33 63.61 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.217 -0.447 . . . . 0.49 111.017 -175.666 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.787 -1.007 . . . . 1.39 112.643 174.656 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.2 mtm . . . . . 0 N--CA 1.482 1.138 0 CA-C-O 120.688 0.28 . . . . 15.85 110.893 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -138.41 107.28 5.96 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.761 0.315 . . . . 12.76 110.306 -178.312 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 69.6 m80 -99.46 -14.58 19.04 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.271 -0.422 . . . . 13.36 110.923 -178.106 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 65.2 m80 -102.43 68.17 1.05 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.301 -0.408 . . . . 10.71 111.27 -175.394 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 39.5 m80 -88.17 -61.61 1.68 Allowed 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.705 -0.85 . . . . 9.04 108.705 172.353 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 15.2 m-70 -131.38 2.5 4.2 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.902 -0.59 . . . . 9.79 110.519 174.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 25.1 m170 -81.52 128.62 34.1 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.763 -0.458 . . . . 7.41 109.763 176.351 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' HIS . . . . . 0.421 ' O ' ' HB ' ' A' ' 9' ' ' VAL . 81.6 t60 63.91 93.12 0.06 Allowed 'General case' 0 C--N 1.332 -0.155 0 O-C-N 123.885 0.741 . . . . 6.44 109.814 -172.078 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.421 ' HB ' ' O ' ' A' ' 8' ' ' HIS . 87.1 t 72.77 116.46 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 115.774 -0.648 . . . . 1.97 111.576 -179.405 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -121.67 155.0 36.09 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.624 -0.717 . . . . 4.2 109.559 176.542 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -105.89 16.83 24.59 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.441 -0.345 . . . . 4.33 111.095 -177.524 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 62.58 21.98 13.02 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 115.836 -0.62 . . . . 4.37 111.653 -179.03 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 58.62 56.95 3.97 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 116.256 -0.429 . . . . 5.36 111.099 -179.447 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.4 ' HE3' ' HB3' ' A' ' 14' ' ' LYS . 0.8 OUTLIER 56.39 74.6 0.39 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.467 0.651 . . . . 3.42 110.324 -178.708 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 52.9 ttm -118.94 128.3 54.28 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.76 -0.654 . . . . 4.43 109.882 178.085 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 77.95 36.95 30.67 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.548 -0.834 . . . . 3.41 111.369 -177.432 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 91.48 175.39 43.24 Favored Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 120.76 -0.733 . . . . 2.09 111.917 -176.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_endo -58.66 146.97 89.79 Favored 'Trans proline' 0 CA--C 1.53 0.287 0 C-N-CA 122.826 2.351 . . . . 1.16 112.165 176.282 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 14.7 p -111.83 142.16 44.56 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.303 -0.408 . . . . 0.73 111.402 -177.112 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 23.8 t -118.85 122.81 70.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.043 -0.526 . . . . 0.52 110.24 178.411 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 56.8 tp -71.44 106.07 3.8 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.385 0.612 . . . . 0.91 109.609 174.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.518 HG12 ' HB3' ' A' ' 46' ' ' PRO . 56.4 t -91.64 118.72 37.62 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 CA-C-N 115.435 -0.802 . . . . 0.31 109.973 179.789 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -98.08 -26.03 14.74 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 109.111 -0.7 . . . . 1.16 109.111 174.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 13.9 ptp180 -162.75 162.87 26.92 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.369 -0.832 . . . . 2.16 110.712 -178.329 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.476 ' CE2' ' HG ' ' A' ' 42' ' ' LEU . 29.6 m-85 -111.12 154.87 23.68 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.694 -0.685 . . . . 0.35 109.967 177.718 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.489 ' O ' ' HA ' ' A' ' 89' ' ' ARG . 56.5 tp60 -137.3 140.1 41.33 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 109.065 -0.717 . . . . 1.37 109.065 177.497 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.514 ' HG ' HD23 ' A' ' 38' ' ' LEU . 3.8 mm? -108.36 152.16 25.02 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 120.935 0.397 . . . . 0.25 110.403 -179.215 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 23.1 t -132.9 125.83 30.77 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.127 -0.488 . . . . 0.95 110.254 177.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 90.86 -2.09 79.2 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.8 -0.714 . . . . 0.21 113.009 175.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 14.7 p-10 -74.04 123.05 23.64 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.183 0.516 . . . . 0.44 111.072 179.176 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 29.8 mmm180 -121.43 -33.57 3.62 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.828 -0.624 . . . . 2.48 110.514 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 84.9 mm-40 -70.92 -42.25 70.13 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.007 -0.542 . . . . 1.91 110.551 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 86.2 m-85 -128.68 137.08 51.43 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.033 -0.53 . . . . 0.25 109.749 179.446 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.649 ' OD2' ' HB3' ' A' ' 36' ' ' ARG . 4.6 p-10 -79.72 167.5 20.56 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.234 -0.439 . . . . 0.62 111.028 -177.636 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.461 ' O ' HD13 ' A' ' 39' ' ' LEU . 2.8 m-20 -54.22 -52.8 60.15 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 123.084 0.24 . . . . 0.59 110.959 -176.836 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.649 ' HB3' ' OD2' ' A' ' 34' ' ' ASP . 8.7 ttp180 -45.25 -45.51 11.95 Favored 'General case' 0 C--N 1.327 -0.394 0 O-C-N 123.763 0.664 . . . . 3.66 111.536 177.403 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 22.0 tpt85 -65.21 -42.88 93.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.803 -0.635 . . . . 2.3 111.476 -178.497 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.572 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -79.91 -24.9 40.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.723 0.297 . . . . 0.19 111.377 -177.545 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.461 HD13 ' O ' ' A' ' 35' ' ' ASP . 2.2 mp -62.15 -36.37 81.6 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.339 -0.392 . . . . 1.77 111.328 178.506 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.59 -26.26 66.83 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.062 -0.517 . . . . 0.3 111.051 178.597 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.592 HD13 HG12 ' A' ' 62' ' ' ILE . 5.9 mt -64.88 -30.51 71.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.008 0.432 . . . . 0.2 110.98 176.165 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.61 HD21 HD11 ' A' ' 62' ' ' ILE . 0.4 OUTLIER -105.36 12.86 31.16 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.139 -0.482 . . . . 0.22 110.271 -177.713 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 7.1 p80 -47.3 -29.83 2.73 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.5 0.926 . . . . 0.55 113.5 -173.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -104.2 11.25 35.22 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.246 0.461 . . . . 0.6 112.246 -174.23 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 80.0 mt -97.08 -53.03 0.21 Allowed Pre-proline 0 C--N 1.323 -0.573 0 N-CA-C 113.591 0.96 . . . . 0.83 113.591 -176.353 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.518 ' HB3' HG12 ' A' ' 22' ' ' VAL . 77.6 Cg_endo -75.9 175.59 11.12 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 121.428 1.418 . . . . 0.33 113.023 -168.956 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.406 ' O ' HG21 ' A' ' 9' ' ' VAL . . . 89.18 -6.78 83.26 Favored Glycine 0 N--CA 1.445 -0.712 0 N-CA-C 110.629 -0.989 . . . . 0.31 110.629 -172.003 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -124.75 175.48 7.21 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.979 -0.611 . . . . 1.46 109.72 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -100.59 96.36 7.31 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.402 0.62 . . . . 1.12 109.83 176.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.445 HD23 ' CG2' ' A' ' 22' ' ' VAL . 2.7 mm? -84.42 134.55 34.46 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.016 -0.993 . . . . 0.38 110.231 -174.5 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.591 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 8.5 p30 -85.03 171.37 12.13 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.727 -0.472 . . . . 1.39 109.727 177.797 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.524 ' HA ' HD12 ' A' ' 55' ' ' LEU . 4.0 mm? -48.8 -45.17 39.87 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.512 0.56 . . . . 0.92 112.512 -175.473 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.567 ' HA ' ' NE2' ' A' ' 56' ' ' HIS . 69.1 m -57.46 -46.0 84.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.622 0.249 . . . . 0.69 110.929 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.405 ' NE2' HD12 ' A' ' 50' ' ' LEU . 55.2 mt-30 -66.42 -32.64 74.14 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.982 0.42 . . . . 1.74 110.522 179.546 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.591 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 79.7 mt -62.67 -55.58 25.57 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.766 -0.652 . . . . 1.15 111.279 -178.883 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.567 ' NE2' ' HA ' ' A' ' 53' ' ' SER . 34.0 p80 -74.76 -23.42 58.53 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.324 -0.55 . . . . 2.83 111.184 -178.094 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.14 -31.97 70.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.184 0.516 . . . . 0.31 110.192 173.747 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.33 -45.57 92.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.624 -0.716 . . . . 0.21 110.477 175.265 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.48 -34.99 78.98 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.662 -0.699 . . . . 0.14 110.82 179.041 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.3 -42.51 99.42 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.872 -0.604 . . . . 0.17 110.93 178.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 77.2 mtt180 -54.19 -40.9 67.98 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 121.183 0.516 . . . . 0.36 110.642 177.153 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.61 HD11 HD21 ' A' ' 42' ' ' LEU . 67.4 mt -78.45 -37.5 21.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.53 -0.759 . . . . 0.16 110.579 -176.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.458 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -60.32 -42.11 98.68 Favored Glycine 0 N--CA 1.442 -0.913 0 CA-C-N 115.651 -0.704 . . . . 0.22 111.89 177.818 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -75.98 -26.48 56.82 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.54 0.209 . . . . 2.17 110.551 177.075 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -59.97 -50.33 74.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.936 0.398 . . . . 0.21 110.277 178.016 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' TYR . . . . . 0.444 ' HB3' ' HB2' ' A' ' 71' ' ' TYR . 10.3 m-85 -58.58 -44.97 89.98 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.729 -0.669 . . . . 0.21 110.453 176.193 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLN . . . . . 0.458 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 79.7 mt-30 -59.97 -38.06 81.44 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.966 -0.561 . . . . 1.21 111.218 -179.758 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -69.42 -26.59 64.69 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.152 -0.477 . . . . 1.68 110.632 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -88.97 4.78 46.98 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.004 -0.544 . . . . 0.57 110.932 178.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 106.32 -14.96 43.22 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.819 -0.705 . . . . 0.31 112.881 176.483 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' TYR . . . . . 0.444 ' HB2' ' HB3' ' A' ' 66' ' ' TYR . 80.5 m-85 -82.3 71.56 9.36 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.191 0.52 . . . . 0.39 110.186 -178.448 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 40.5 t -67.77 -28.69 42.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.629 -0.714 . . . . 0.41 110.992 -176.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 43.4 tp -78.84 -8.93 59.26 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.038 -0.528 . . . . 1.76 110.908 -179.274 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -93.15 141.07 28.82 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.076 0.465 . . . . 0.37 111.241 -177.127 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 30.3 tpt180 -151.28 131.5 13.6 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.959 -0.564 . . . . 1.8 109.603 177.837 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.22 138.16 35.9 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.378 -0.374 . . . . 0.18 110.203 178.874 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 49.0 p90 -135.78 142.59 44.95 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.415 -0.357 . . . . 0.38 110.053 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.8 tt -95.79 115.42 65.51 Favored Pre-proline 0 C--N 1.318 -0.784 0 N-CA-C 109.211 -0.663 . . . . 0.39 109.211 179.627 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.403 ' HD2' ' O ' ' A' ' 89' ' ' ARG . 55.7 Cg_endo -70.57 93.23 0.59 Allowed 'Trans proline' 0 N--CA 1.462 -0.374 0 C-N-CA 122.39 2.06 . . . . 1.12 111.796 178.315 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -89.46 63.65 6.44 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.254 -0.43 . . . . 2.0 110.884 -178.138 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -97.77 -33.46 11.26 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.933 -0.576 . . . . 3.72 110.007 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -149.31 -62.12 0.22 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.359 -0.837 . . . . 3.76 109.704 -177.475 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 50.3 mt 66.39 106.37 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.297 0 CA-C-N 115.56 -0.745 . . . . 1.23 112.387 178.581 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLN . . . . . 0.482 ' CD ' ' H ' ' A' ' 84' ' ' GLN . 4.1 pm0 -61.0 140.8 57.74 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.745 -0.661 . . . . 1.56 109.678 171.086 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -77.57 140.63 39.73 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.993 -0.373 . . . . 1.54 109.993 -178.222 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 102.16 -45.32 1.38 Allowed Glycine 0 N--CA 1.446 -0.688 0 C-N-CA 120.836 -0.697 . . . . 0.58 112.077 -178.086 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 25.8 m -127.04 121.67 32.23 Favored 'General case' 0 C--N 1.322 -0.595 0 O-C-N 122.692 -0.299 . . . . 0.47 110.717 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 31.7 m -102.84 131.66 50.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 N-CA-C 109.716 -0.476 . . . . 0.31 109.716 175.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.489 ' HA ' ' O ' ' A' ' 26' ' ' GLN . 51.8 ttt180 -110.52 130.87 55.46 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.268 0.556 . . . . 2.92 110.901 -177.316 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.421 ' HB ' HD13 ' A' ' 27' ' ' LEU . 67.2 mt -110.86 134.34 53.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.046 -0.979 . . . . 0.23 109.868 -179.249 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -94.14 123.75 37.72 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.342 0.591 . . . . 1.33 110.13 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 57.9 t -98.63 110.6 26.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 115.367 -0.833 . . . . 0.27 110.501 -176.569 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 56.2 tp -94.35 95.13 8.69 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.356 -0.609 . . . . 0.36 109.356 176.509 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 55.7 mt-10 -78.56 -9.9 59.52 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.895 -0.593 . . . . 0.49 110.816 -176.526 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.934 -0.926 . . . . 1.39 111.723 178.189 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.8 ptt? . . . . . 0 N--CA 1.48 1.058 0 CA-C-O 120.56 0.219 . . . . 15.85 111.157 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -93.02 -20.57 20.43 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.085 0.469 . . . . 12.76 110.899 -179.108 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -80.83 80.37 7.31 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.839 -0.619 . . . . 13.36 109.561 178.85 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 49.7 m80 69.74 169.18 0.3 Allowed 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.226 -0.897 . . . . 10.71 111.064 -176.609 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 62.9 m80 -135.81 58.59 1.74 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.748 -0.66 . . . . 9.04 109.458 179.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 25.5 p80 -103.86 31.76 4.3 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.361 -0.836 . . . . 9.79 111.581 -172.616 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 28.8 m170 -75.25 63.04 1.31 Allowed 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 121.257 0.551 . . . . 7.41 110.521 176.023 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 41.2 m80 -141.76 84.78 1.91 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.993 -0.743 . . . . 6.44 108.993 -178.534 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.434 ' HB ' ' HG2' ' A' ' 48' ' ' GLN . 45.2 t -72.07 100.74 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 116.056 -0.52 . . . . 1.97 111.317 -174.53 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -95.64 12.91 28.05 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.681 -0.69 . . . . 4.2 109.907 176.028 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -87.59 2.09 51.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.798 -0.637 . . . . 4.33 111.126 -178.298 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -88.33 108.89 19.57 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.999 0.428 . . . . 4.37 109.986 177.174 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -76.98 170.33 16.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.737 -0.665 . . . . 5.36 112.107 -172.258 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.53 ' HB3' HG23 ' A' ' 19' ' ' THR . 1.6 pptp? -145.44 156.07 43.52 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.35 -0.841 . . . . 3.42 110.33 178.442 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 26.1 ttt -139.1 -52.7 0.56 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.472 -0.331 . . . . 4.43 110.535 179.164 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -66.22 -42.56 94.18 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.753 -0.737 . . . . 3.41 112.096 178.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -158.97 150.37 20.92 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.839 -0.696 . . . . 2.09 111.73 178.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -55.05 139.15 79.94 Favored 'Trans proline' 0 C--O 1.235 0.344 0 C-N-CA 123.336 2.691 . . . . 1.16 113.234 179.631 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.53 HG23 ' HB3' ' A' ' 14' ' ' LYS . 3.3 p -87.79 153.91 20.97 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.711 -0.677 . . . . 0.73 110.599 179.295 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 60.3 t -114.56 125.53 71.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.768 0.318 . . . . 0.52 110.555 178.555 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.453 ' HA ' ' HA ' ' A' ' 49' ' ' GLU . 51.8 tp -69.46 101.37 1.56 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.047 0.451 . . . . 0.91 110.478 177.427 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.554 HG12 ' HB3' ' A' ' 46' ' ' PRO . 60.8 t -80.68 126.54 39.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.704 -0.68 . . . . 0.31 110.172 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -108.52 -35.49 6.46 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.98 -0.555 . . . . 1.16 110.289 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 12.6 ptp180 -155.11 160.96 41.36 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.231 -0.44 . . . . 2.16 111.016 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.561 ' CE2' ' HG ' ' A' ' 42' ' ' LEU . 40.7 m-85 -114.78 141.02 48.42 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.735 -0.666 . . . . 0.35 110.228 178.569 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -129.08 127.56 41.76 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.355 -0.609 . . . . 1.37 109.355 179.215 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.435 HD13 ' HB ' ' A' ' 90' ' ' ILE . 3.5 mm? -101.93 136.53 41.61 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.113 0.483 . . . . 0.25 109.8 -178.578 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.493 ' O ' ' HA ' ' A' ' 91' ' ' GLU . 74.1 m -132.16 131.25 42.07 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.757 -0.656 . . . . 0.95 110.414 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 99.18 -11.71 61.96 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.764 -0.732 . . . . 0.21 111.803 -177.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 17.3 p-10 -77.88 131.97 37.75 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.975 0.417 . . . . 0.44 110.58 179.369 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 28.5 mmm180 -126.23 -38.37 2.15 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.133 -0.485 . . . . 2.48 110.252 179.118 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 49.3 tp60 -68.5 -44.61 74.32 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.046 -0.524 . . . . 1.91 110.67 -177.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.435 ' HD2' ' CZ ' ' A' ' 66' ' ' TYR . 83.1 m-85 -122.98 136.19 54.76 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.016 -0.538 . . . . 0.25 109.69 179.583 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -82.48 175.72 9.98 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.027 -0.533 . . . . 0.62 111.046 -175.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.434 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 72.5 m-20 -54.73 -48.8 72.08 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 116.222 -0.444 . . . . 0.59 111.296 -177.489 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -62.34 -25.69 68.03 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.193 -0.458 . . . . 3.66 111.319 -174.221 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.2 tpt180 -79.89 -36.35 36.65 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.874 -0.603 . . . . 2.3 110.718 179.599 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.483 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -87.45 -34.35 18.74 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.053 0.39 . . . . 0.19 112.053 -176.456 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 35' ' ' ASP . 4.1 pp -67.0 -18.15 65.25 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 120.917 -0.313 . . . . 1.77 110.896 -179.065 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.49 -23.44 66.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.061 0.458 . . . . 0.3 110.37 176.345 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.609 HD13 HG12 ' A' ' 62' ' ' ILE . 2.4 mt -70.46 -23.09 62.64 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.871 -0.604 . . . . 0.2 110.45 175.636 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.614 HD21 HD11 ' A' ' 62' ' ' ILE . 0.7 OUTLIER -110.21 13.79 22.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.859 -0.61 . . . . 0.22 110.116 -179.444 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.9 p80 -56.19 -25.34 46.53 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.451 0.537 . . . . 0.55 112.451 -172.429 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -103.57 9.57 37.4 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.659 0.266 . . . . 0.6 111.152 -176.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.447 ' HA ' HD12 ' A' ' 45' ' ' LEU . 10.5 tp -97.52 -55.75 0.19 Allowed Pre-proline 0 C--N 1.32 -0.689 0 N-CA-C 113.792 1.034 . . . . 0.83 113.792 -169.727 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.554 ' HB3' HG12 ' A' ' 22' ' ' VAL . 82.7 Cg_endo -76.03 172.83 15.54 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 121.567 1.512 . . . . 0.33 112.825 -170.414 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.26 -0.67 64.01 Favored Glycine 0 N--CA 1.445 -0.728 0 N-CA-C 110.435 -1.066 . . . . 0.31 110.435 -172.354 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.434 ' HG2' ' HB ' ' A' ' 9' ' ' VAL . 53.6 mt-30 -131.33 174.62 9.88 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.954 -0.623 . . . . 1.46 109.621 178.301 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.453 ' HA ' ' HA ' ' A' ' 21' ' ' LEU . 37.4 mt-10 -95.58 95.56 8.46 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.385 0.612 . . . . 1.12 110.178 175.572 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -85.39 136.12 33.59 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.256 -0.884 . . . . 0.38 109.408 178.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.8 t-20 -80.39 156.47 26.67 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.452 -0.573 . . . . 1.39 109.452 178.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -49.76 -43.1 47.89 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 117.945 0.338 . . . . 0.92 111.738 -175.068 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 11.2 m -52.25 -45.03 65.21 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.092 0.472 . . . . 0.69 110.659 175.734 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -68.3 -39.2 82.11 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.629 -0.714 . . . . 1.74 111.152 179.837 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.65 ' HB3' HD13 ' A' ' 78' ' ' LEU . 10.9 mp -56.85 -46.99 81.4 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 120.719 0.295 . . . . 1.15 111.265 173.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 75.7 m80 -65.95 -34.82 79.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.883 0.373 . . . . 2.83 110.451 178.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.7 -27.84 67.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.178 -0.464 . . . . 0.31 110.962 178.077 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.0 -38.49 91.28 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.193 0.521 . . . . 0.21 110.233 175.628 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.18 -30.85 71.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.596 -0.729 . . . . 0.14 110.546 177.427 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -66.16 -36.72 83.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.965 -0.562 . . . . 0.17 110.895 179.056 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 80.7 mtt180 -55.35 -42.06 73.36 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.299 0.571 . . . . 0.36 110.001 175.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.614 HD11 HD21 ' A' ' 42' ' ' LEU . 66.0 mt -77.91 -35.17 20.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.111 -0.949 . . . . 0.16 111.151 -175.626 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.626 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -58.89 -49.59 76.49 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.376 -0.916 . . . . 0.22 111.624 176.471 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -66.45 -28.32 68.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.541 0.21 . . . . 2.17 110.957 178.524 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.543 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 87.7 t80 -58.99 -50.38 74.29 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.019 0.437 . . . . 0.21 110.183 177.022 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' TYR . . . . . 0.435 ' CZ ' ' HD2' ' A' ' 33' ' ' PHE . 8.6 m-85 -61.66 -44.46 96.93 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.651 -0.704 . . . . 0.21 110.964 177.658 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLN . . . . . 0.626 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 42.0 mt-30 -61.16 -35.49 77.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.11 -0.496 . . . . 1.21 111.033 -178.621 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -64.49 -35.66 81.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.219 0.533 . . . . 1.68 110.589 176.765 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.543 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 69.6 mmtt -79.16 -4.12 48.91 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.982 -0.554 . . . . 0.57 110.829 -177.284 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.67 -6.99 27.94 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.953 -0.642 . . . . 0.31 112.302 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' TYR . . . . . 0.419 ' HB2' ' HB3' ' A' ' 66' ' ' TYR . 43.3 m-85 -92.37 65.78 4.59 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.324 -0.621 . . . . 0.39 109.324 179.515 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 43.8 t -66.0 -28.1 42.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.699 -0.682 . . . . 0.41 110.836 -175.52 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 55.6 tp -73.66 -25.32 60.21 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.832 -0.622 . . . . 1.76 110.349 178.072 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -79.68 131.64 36.01 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.824 -0.626 . . . . 0.37 111.438 -175.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 20.5 mmm180 -140.37 155.13 46.88 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.645 -0.707 . . . . 1.8 109.918 176.6 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -113.51 135.05 54.32 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.954 -0.566 . . . . 0.18 109.754 178.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 47.4 p90 -130.33 149.71 51.89 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.511 -0.551 . . . . 0.38 109.511 179.498 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.65 HD13 ' HB3' ' A' ' 55' ' ' LEU . 7.5 tt -106.24 108.43 61.73 Favored Pre-proline 0 C--N 1.316 -0.88 0 N-CA-C 110.018 -0.364 . . . . 0.39 110.018 -178.008 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' A' ' 78' ' ' LEU . 18.0 Cg_endo -59.8 105.81 0.29 Allowed 'Trans proline' 0 C--O 1.233 0.271 0 C-N-CA 122.891 2.394 . . . . 1.12 112.163 176.903 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.89 160.54 29.81 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.89 -0.596 . . . . 2.0 110.83 -179.163 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 64.06 13.05 7.44 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 123.502 0.501 . . . . 3.72 111.51 -178.822 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -133.56 33.36 3.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 122.176 0.989 . . . . 3.76 108.561 178.157 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 53.5 mt -108.58 149.52 11.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 114.595 -1.184 . . . . 1.23 110.615 -174.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 14.6 mp0 -102.67 161.4 13.76 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.156 -0.683 . . . . 1.56 109.156 177.843 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -75.95 63.32 1.72 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.949 0.88 . . . . 1.54 111.361 -173.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 147.48 -35.76 1.21 Allowed Glycine 0 N--CA 1.444 -0.832 0 CA-C-N 115.206 -0.906 . . . . 0.58 111.436 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 25.0 m -102.31 122.29 43.96 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 120.814 0.34 . . . . 0.47 110.211 178.566 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 33.2 m -108.21 128.07 63.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 109.918 -0.401 . . . . 0.31 109.918 176.468 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 14.3 ttt180 -103.94 114.29 28.44 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 120.494 -0.482 . . . . 2.92 110.43 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.435 ' HB ' HD13 ' A' ' 27' ' ' LEU . 49.1 mt -103.56 131.43 52.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 115.888 -0.596 . . . . 0.23 109.772 178.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.493 ' HA ' ' O ' ' A' ' 28' ' ' SER . 38.6 mt-10 -96.75 125.95 41.57 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.36 0.6 . . . . 1.33 110.591 -179.028 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 57.8 t -98.76 111.43 28.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.435 -0.802 . . . . 0.27 110.215 -178.246 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 30.9 tp -94.63 89.02 5.61 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.076 -0.713 . . . . 0.36 109.076 178.148 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 57.6 mt-10 -67.22 -15.67 63.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.508 -0.769 . . . . 0.49 111.725 -174.098 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.964 0 CA-C-O 118.929 -0.928 . . . . 1.39 111.764 178.904 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 mmt . . . . . 0 N--CA 1.482 1.168 0 CA-C-O 120.631 0.253 . . . . 15.85 110.809 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -79.43 -66.58 0.85 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.429 -0.35 . . . . 12.76 111.078 -178.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 60.2 m170 -65.22 -61.65 2.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.959 0.409 . . . . 13.36 110.202 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 31.3 m170 -83.22 90.72 7.14 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.283 -0.636 . . . . 10.71 109.283 173.629 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 61.2 t60 -106.23 -44.26 4.59 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.671 -0.695 . . . . 9.04 109.936 -179.487 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 64.0 m80 -74.19 108.59 7.09 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.814 -0.63 . . . . 9.79 110.281 177.179 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 53.4 m80 -65.58 117.27 7.81 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.775 -0.648 . . . . 7.41 109.981 179.845 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 33.3 p-80 -126.84 47.44 2.32 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.569 0.7 . . . . 6.44 110.189 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.425 HG11 ' HG2' ' A' ' 48' ' ' GLN . 58.1 t -112.92 132.11 62.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.366 -0.834 . . . . 1.97 109.573 177.378 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -111.4 129.26 56.07 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.073 0.464 . . . . 4.2 111.074 -176.908 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -90.53 -26.35 19.79 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.496 -0.928 . . . . 4.33 108.496 172.291 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 19.1 t70 48.89 79.14 0.08 Allowed 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 114.606 -1.179 . . . . 4.37 112.194 171.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 38.5 t70 64.56 102.67 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.675 -0.693 . . . . 5.36 110.801 -178.51 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.543 ' HD2' ' O ' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -53.9 115.3 1.94 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.753 -0.658 . . . . 3.42 111.608 -179.394 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 27.8 ttt -119.75 126.87 52.11 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.849 -0.614 . . . . 4.43 109.43 177.093 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 94.3 31.34 8.04 Favored Glycine 0 N--CA 1.447 -0.63 0 N-CA-C 110.659 -0.976 . . . . 3.41 110.659 -174.886 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 99.39 163.57 29.47 Favored Glycine 0 N--CA 1.444 -0.823 0 N-CA-C 111.226 -0.75 . . . . 2.09 111.226 -176.006 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -58.64 132.35 47.65 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.571 2.181 . . . . 1.16 111.713 177.773 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 11.4 p -81.94 140.02 34.28 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.344 0.592 . . . . 0.73 111.218 -176.481 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 21.8 t -118.19 125.0 73.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-N 115.587 -0.733 . . . . 0.52 109.846 179.206 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -71.72 126.76 30.55 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.028 -0.73 . . . . 0.91 109.028 175.409 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.487 HG12 ' HB3' ' A' ' 46' ' ' PRO . 63.9 t -108.36 116.89 52.69 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 CA-C-N 115.909 -0.587 . . . . 0.31 110.498 -176.138 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -97.85 -26.17 14.78 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.335 -0.848 . . . . 1.16 109.382 178.161 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 4.3 ptp180 -168.05 161.9 12.89 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.839 -0.619 . . . . 2.16 110.685 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.577 ' CE2' ' HG ' ' A' ' 42' ' ' LEU . 26.7 m-85 -110.91 137.14 48.92 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.696 -0.684 . . . . 0.35 109.731 178.033 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.409 ' O ' ' HA ' ' A' ' 89' ' ' ARG . 53.9 tp60 -114.72 129.18 56.65 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 109.544 -0.539 . . . . 1.37 109.544 177.282 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.441 ' HG ' HD23 ' A' ' 38' ' ' LEU . 3.9 mm? -103.7 127.29 51.18 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.007 0.432 . . . . 0.25 110.098 -178.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.0 t -115.08 119.47 36.56 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.938 -0.574 . . . . 0.95 110.164 -178.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 99.27 0.63 56.97 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.756 -0.735 . . . . 0.21 112.758 178.362 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 20.0 p-10 -81.23 124.29 29.17 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.361 0.6 . . . . 0.44 111.259 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' ' 31' ' ' ARG . 15.3 mmm180 -128.22 -34.03 2.12 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.782 -0.645 . . . . 2.48 110.575 177.782 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -69.35 -32.68 71.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.108 -0.497 . . . . 1.91 110.543 179.711 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 -136.94 141.68 42.66 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.406 -0.59 . . . . 0.25 109.406 175.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -81.06 169.7 17.13 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.433 -0.349 . . . . 0.62 110.721 -178.516 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.507 ' O ' HD13 ' A' ' 39' ' ' LEU . 1.0 OUTLIER -55.4 -54.99 36.79 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-N 116.455 -0.339 . . . . 0.59 111.344 -176.048 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.512 ' HA ' HD22 ' A' ' 39' ' ' LEU . 62.8 ttt180 -58.69 -32.79 69.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.764 0.316 . . . . 3.66 110.853 -175.839 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 20.2 tpt180 -64.59 -42.94 95.26 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.212 -0.449 . . . . 2.3 110.575 176.798 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.505 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -78.79 -26.14 44.36 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.91 0.386 . . . . 0.19 110.916 179.651 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.512 HD22 ' HA ' ' A' ' 36' ' ' ARG . 1.4 mp -60.3 -31.47 70.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.145 -0.48 . . . . 1.77 111.116 177.668 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.73 -24.06 65.41 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.903 -0.59 . . . . 0.3 111.403 176.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.512 HD13 HG12 ' A' ' 62' ' ' ILE . 3.8 mt -74.69 -24.49 58.78 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.123 0.487 . . . . 0.2 110.513 176.366 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.671 HD21 HD11 ' A' ' 62' ' ' ILE . 0.4 OUTLIER -107.67 14.27 25.79 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.989 -0.551 . . . . 0.22 110.12 -179.041 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 8.1 p80 -53.9 -19.94 5.29 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 113.161 0.8 . . . . 0.55 113.161 -171.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -110.65 11.0 22.85 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.082 0.401 . . . . 0.6 112.082 -175.314 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 84.8 mt -100.31 -54.72 0.16 Allowed Pre-proline 0 CA--C 1.539 0.519 0 N-CA-C 113.823 1.046 . . . . 0.83 113.823 -174.654 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.487 ' HB3' HG12 ' A' ' 22' ' ' VAL . 41.3 Cg_endo -69.92 165.82 29.88 Favored 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 121.345 1.363 . . . . 0.33 112.788 -170.384 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.26 -24.26 29.75 Favored Glycine 0 N--CA 1.447 -0.567 0 N-CA-C 110.711 -0.955 . . . . 0.31 110.711 -171.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.425 ' HG2' HG11 ' A' ' 9' ' ' VAL . 79.8 mt-30 -109.08 169.79 8.46 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.284 -0.458 . . . . 1.46 110.165 175.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -97.93 110.74 23.25 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.705 -0.68 . . . . 1.12 109.894 177.189 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.411 HD23 ' CG2' ' A' ' 22' ' ' VAL . 2.9 mm? -96.85 140.74 30.96 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.293 -0.867 . . . . 0.38 110.402 -174.13 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.67 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 36.1 p30 -85.44 171.34 11.88 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.938 -0.394 . . . . 1.39 109.938 177.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.475 ' HA ' HD12 ' A' ' 55' ' ' LEU . 3.8 mm? -50.69 -45.01 58.08 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.515 0.197 . . . . 0.92 111.521 -178.506 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.463 ' HA ' ' NE2' ' A' ' 56' ' ' HIS . 22.5 m -55.42 -51.1 67.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.327 -0.397 . . . . 0.69 111.069 179.3 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -67.28 -30.83 70.8 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.111 -0.495 . . . . 1.74 111.185 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.67 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 84.3 mt -60.78 -55.03 38.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.404 -0.362 . . . . 1.15 111.027 178.843 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.463 ' NE2' ' HA ' ' A' ' 53' ' ' SER . 34.8 p80 -75.88 -22.91 55.66 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.493 -0.483 . . . . 2.83 111.183 -178.125 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.32 -33.31 72.21 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.132 0.492 . . . . 0.31 110.403 174.085 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.86 -39.7 90.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.676 -0.693 . . . . 0.21 110.662 176.345 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.48 -34.99 78.3 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.802 -0.635 . . . . 0.14 110.729 179.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.06 -39.19 94.0 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.873 -0.603 . . . . 0.17 110.962 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 80.6 mtt180 -55.45 -42.59 74.46 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.266 0.555 . . . . 0.36 110.334 176.607 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ILE . . . . . 0.671 HD11 HD21 ' A' ' 42' ' ' LEU . 72.6 mt -78.34 -37.52 21.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.533 -0.758 . . . . 0.16 110.699 -176.238 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.657 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -59.1 -45.36 95.41 Favored Glycine 0 N--CA 1.442 -0.929 0 C-N-CA 120.67 -0.776 . . . . 0.22 111.645 176.717 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -68.25 -33.41 74.34 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.818 0.342 . . . . 2.17 110.52 178.2 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.458 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 90.4 t80 -57.27 -51.32 69.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.889 -0.596 . . . . 0.21 110.628 178.231 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -59.61 -41.42 90.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.97 -0.559 . . . . 0.21 111.157 178.798 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLN . . . . . 0.657 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 21.2 mt-30 -58.73 -44.8 90.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.034 -0.53 . . . . 1.21 111.087 -178.146 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -70.44 -17.27 62.99 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.84 0.352 . . . . 1.68 111.339 -179.123 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.458 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 75.5 mmtt -91.2 4.89 51.1 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.802 0.334 . . . . 0.57 110.642 179.704 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 102.61 -11.54 56.47 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.769 -0.729 . . . . 0.31 112.489 176.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -89.72 74.24 7.53 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.426 0.631 . . . . 0.39 109.387 -179.214 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 28.7 t -74.34 -25.77 19.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.434 -0.803 . . . . 0.41 111.091 -174.023 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 60.8 tp -78.19 -16.77 57.56 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.134 0.492 . . . . 1.76 110.029 176.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.512 ' HA ' ' O ' ' A' ' 93' ' ' LEU . . . -82.7 137.3 34.48 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.957 -0.565 . . . . 0.37 111.504 -178.286 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 21.5 tpt180 -152.12 132.6 13.81 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.7 -0.682 . . . . 1.8 109.602 176.761 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -95.81 135.13 37.94 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 110.288 -0.264 . . . . 0.18 110.288 178.678 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 51.0 p90 -135.36 149.39 49.68 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.86 0.362 . . . . 0.38 110.27 179.253 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.5 tt -104.21 118.4 56.99 Favored Pre-proline 0 C--N 1.318 -0.791 0 N-CA-C 108.997 -0.742 . . . . 0.39 108.997 178.607 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -69.14 80.89 0.68 Allowed 'Trans proline' 0 C--O 1.234 0.292 0 C-N-CA 122.654 2.236 . . . . 1.12 112.095 179.087 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.58 119.63 13.33 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.005 -0.543 . . . . 2.0 110.853 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.505 ' HA ' ' OE1' ' A' ' 81' ' ' GLN . 6.3 tp60 -171.13 -51.79 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.035 -0.529 . . . . 3.72 110.252 -179.508 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -132.17 -64.04 0.79 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.606 -0.725 . . . . 3.76 109.592 178.497 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 65.3 mt 67.17 136.4 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-N 115.574 -0.739 . . . . 1.23 111.724 -178.38 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -72.19 114.57 10.45 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.085 -0.709 . . . . 1.56 109.085 176.772 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -62.29 107.25 0.87 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.756 0.788 . . . . 1.54 110.044 -178.219 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 124.03 -40.72 1.88 Allowed Glycine 0 N--CA 1.445 -0.703 0 CA-C-N 115.423 -0.808 . . . . 0.58 111.599 -175.287 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 87.0 m -128.86 119.76 25.03 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.904 0.383 . . . . 0.47 110.397 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 32.6 m -95.91 132.97 38.74 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 N-CA-C 109.676 -0.49 . . . . 0.31 109.676 178.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.409 ' HA ' ' O ' ' A' ' 26' ' ' GLN . 34.4 ttp180 -111.34 117.32 32.8 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.287 0.565 . . . . 2.92 110.707 -177.721 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.415 ' HB ' HD13 ' A' ' 27' ' ' LEU . 71.9 mt -100.98 131.47 48.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 115.223 -0.899 . . . . 0.23 109.669 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -94.21 117.95 30.86 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.371 0.605 . . . . 1.33 110.068 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 55.4 t -92.85 109.57 21.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 115.426 -0.806 . . . . 0.27 110.263 -177.349 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.512 ' O ' ' HA ' ' A' ' 74' ' ' ALA . 57.5 tp -89.9 90.72 8.3 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.47 -0.567 . . . . 0.36 109.47 176.589 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -77.79 -12.32 59.96 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.203 0.525 . . . . 0.49 110.465 -178.33 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.232 0 CA-C-O 118.279 -1.289 . . . . 1.39 111.22 178.277 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 39.2 t . . . . . 0 N--CA 1.448 -0.527 0 N-CA-C 110.021 -0.363 . . . . 0.52000000000000002 110.021 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.411 ' O ' ' HA2' ' A' ' 86' ' ' GLY . 35.9 tp -71.32 102.27 2.56 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.138 -0.689 . . . . 0.91000000000000003 109.138 174.114 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.602 HG12 ' HB3' ' A' ' 46' ' ' PRO . 75.7 t -76.15 115.54 17.87 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 CA-C-N 115.585 -0.734 . . . . 0.31 110.727 -176.707 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -98.88 -32.6 11.25 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.905 -0.589 . . . . 1.1599999999999999 109.848 176.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 7.1 ptm180 -158.68 163.09 37.18 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.083 -0.508 . . . . 2.1600000000000001 110.963 178.426 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.58 ' CE2' ' HG ' ' A' ' 42' ' ' LEU . 42.0 m-85 -111.18 139.12 46.82 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.534 -0.757 . . . . 0.34999999999999998 109.78 176.051 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.643 HE21 ' HA ' ' A' ' 26' ' ' GLN . 0.0 OUTLIER -120.59 128.99 53.56 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 109.559 -0.534 . . . . 1.3700000000000001 109.559 176.178 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.61 ' HG ' HD23 ' A' ' 38' ' ' LEU . 3.8 mm? -102.65 129.52 49.27 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.278 0.561 . . . . 0.25 110.013 -179.007 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 40.8 t -121.04 121.67 38.44 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.535 -0.757 . . . . 0.94999999999999996 110.227 -177.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 101.51 -7.46 56.03 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.835 -0.698 . . . . 0.20999999999999999 112.295 -179.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 20.6 p-10 -77.49 123.34 26.44 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.139 0.495 . . . . 0.44 110.935 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.451 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 30.1 mmm180 -124.33 -26.71 3.89 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.043 -0.526 . . . . 2.48 110.226 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -81.34 -36.02 30.21 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.886 -0.597 . . . . 1.9099999999999999 110.835 -179.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.437 ' HD2' ' CZ ' ' A' ' 66' ' ' TYR . 78.3 m-85 -130.92 135.39 47.62 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.139 -0.482 . . . . 0.25 110.336 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.582 ' OD1' ' HB3' ' A' ' 36' ' ' ARG . 1.7 p30 -77.04 169.45 18.32 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.904 -0.589 . . . . 0.62 111.16 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.505 ' O ' HD13 ' A' ' 39' ' ' LEU . 4.2 m-20 -52.81 -52.58 56.35 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 123.284 0.365 . . . . 0.58999999999999997 110.387 -179.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.582 ' HB3' ' OD1' ' A' ' 34' ' ' ASP . 6.7 ttp180 -45.32 -49.57 12.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.467 -0.788 . . . . 3.6600000000000001 111.975 179.456 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -59.77 -41.96 92.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.175 -0.466 . . . . 2.2999999999999998 111.372 -179.207 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.61 HD23 ' HG ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -82.51 -25.15 33.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.3 -0.409 . . . . 0.19 111.445 -175.799 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.505 HD13 ' O ' ' A' ' 35' ' ' ASP . 2.5 mp -63.11 -34.6 77.94 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.363 -0.38 . . . . 1.77 111.806 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.91 -21.99 66.42 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.478 -0.328 . . . . 0.29999999999999999 111.211 178.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.612 HD13 HG12 ' A' ' 62' ' ' ILE . 6.4 mt -69.87 -25.41 63.7 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.072 0.463 . . . . 0.20000000000000001 110.202 175.033 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.58 ' HG ' ' CE2' ' A' ' 25' ' ' PHE . 0.5 OUTLIER -108.04 14.21 25.39 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.799 -0.637 . . . . 0.22 110.171 -179.29 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 13.0 p80 -47.53 -27.02 1.61 Allowed 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 113.489 0.922 . . . . 0.55000000000000004 113.489 -174.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -104.21 11.29 35.14 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.486 0.55 . . . . 0.59999999999999998 112.486 -173.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 81.6 mt -102.38 -56.95 0.11 Allowed Pre-proline 0 C--N 1.323 -0.577 0 N-CA-C 114.005 1.113 . . . . 0.82999999999999996 114.005 -173.376 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.602 ' HB3' HG12 ' A' ' 22' ' ' VAL . 74.1 Cg_endo -72.26 164.07 36.75 Favored 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 121.36 1.373 . . . . 0.33000000000000002 113.145 -166.229 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 91.96 -0.36 72.7 Favored Glycine 0 N--CA 1.446 -0.684 0 N-CA-C 110.331 -1.108 . . . . 0.31 110.331 -170.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -129.57 171.33 12.71 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.075 -0.562 . . . . 1.46 109.77 -179.189 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -99.15 92.15 5.33 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.481 0.658 . . . . 1.1200000000000001 110.168 178.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -83.18 135.81 34.66 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 114.876 -1.056 . . . . 0.38 109.477 -179.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.584 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 28.2 p-10 -83.78 170.7 13.88 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.586 -0.524 . . . . 1.3899999999999999 109.586 178.15 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.517 HD13 HD12 ' A' ' 55' ' ' LEU . 3.6 mm? -55.33 -42.19 73.46 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.644 0.259 . . . . 0.92000000000000004 111.07 -176.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 11.5 m -59.48 -45.74 90.81 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.335 -0.393 . . . . 0.68999999999999995 111.193 -178.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -66.78 -33.95 76.75 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.891 0.377 . . . . 1.74 110.767 176.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.584 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 82.2 mt -63.36 -42.68 98.91 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.021 -0.536 . . . . 1.1499999999999999 110.854 177.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.51 ' HD2' ' O ' ' A' ' 52' ' ' LEU . 55.3 m-70 -69.76 -35.75 75.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.82 0.343 . . . . 2.8300000000000001 110.416 177.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.4 -33.86 76.83 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.24 -0.436 . . . . 0.31 110.934 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -57.45 -39.13 75.64 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.827 -0.624 . . . . 0.20999999999999999 111.012 177.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.44 -30.71 69.65 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.778 -0.646 . . . . 0.14000000000000001 111.322 -178.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.91 -32.03 73.55 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.213 -0.449 . . . . 0.17000000000000001 110.838 -179.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 77.5 mtt180 -58.84 -42.08 88.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.828 -0.623 . . . . 0.35999999999999999 110.172 176.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.612 HG12 HD13 ' A' ' 41' ' ' LEU . 62.3 mt -77.37 -35.86 22.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.363 -0.835 . . . . 0.16 110.761 -175.642 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.518 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -60.97 -36.17 91.79 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.859 -0.686 . . . . 0.22 112.197 178.456 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -80.61 -31.81 36.53 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.883 0.373 . . . . 2.1699999999999999 110.47 177.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.444 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 90.8 t80 -54.45 -50.75 66.94 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.825 -0.625 . . . . 0.20999999999999999 110.627 177.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . 0.46 ' HB3' ' HB2' ' A' ' 71' ' ' TYR . 8.5 m-85 -59.53 -39.64 84.59 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.589 -0.732 . . . . 0.20999999999999999 111.313 178.704 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . 0.518 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 77.3 mt-30 -60.39 -38.29 83.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.252 -0.431 . . . . 1.21 111.267 -177.713 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -73.08 -19.35 61.18 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.031 0.443 . . . . 1.6799999999999999 111.071 -179.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.444 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 73.6 mmtt -88.38 -4.43 58.66 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.147 -0.479 . . . . 0.56999999999999995 110.058 178.079 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.31 -8.27 30.76 Favored Glycine 0 N--CA 1.448 -0.53 0 CA-C-N 115.84 -0.618 . . . . 0.31 112.402 178.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . 0.46 ' HB2' ' HB3' ' A' ' 66' ' ' TYR . 44.3 m-85 -90.53 72.51 6.89 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.235 0.541 . . . . 0.39000000000000001 109.795 -179.452 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 21.2 t -72.53 -24.63 21.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.735 -0.666 . . . . 0.40999999999999998 110.85 -175.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 96.1 mt -80.72 -9.89 59.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.837 -0.619 . . . . 1.76 110.849 178.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.554 ' HA ' ' O ' ' A' ' 93' ' ' LEU . . . -85.94 139.95 30.77 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.065 -0.516 . . . . 0.37 111.437 -176.166 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 13.4 tpt180 -147.32 131.42 17.31 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.765 -0.652 . . . . 1.8 110.044 177.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -102.02 132.88 47.61 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.806 -0.442 . . . . 0.17999999999999999 109.806 175.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 48.1 p90 -139.55 142.84 37.18 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.688 0.28 . . . . 0.38 110.316 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.511 HD13 ' HB3' ' A' ' 55' ' ' LEU . 7.0 tt -92.98 106.95 21.26 Favored Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 109.167 -0.679 . . . . 0.39000000000000001 109.167 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo . . . . . 0 C--N 1.342 0.215 0 C-N-CA 123.029 2.486 . . . . 1.1200000000000001 113.009 -172.593 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . 0.411 ' HA2' ' O ' ' A' ' 21' ' ' LEU . . . . . . . . 0 N--CA 1.444 -0.777 0 N-CA-C 111.638 -0.585 . . . . 0.57999999999999996 111.638 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 17.8 m -95.85 121.65 37.8 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.034 0.445 . . . . 0.46999999999999997 110.424 176.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 35.0 m -104.0 137.33 33.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 109.283 -0.636 . . . . 0.31 109.283 174.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.472 ' O ' ' HG ' ' A' ' 78' ' ' LEU . 27.4 ttm180 -114.38 135.29 54.25 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.447 -0.501 . . . . 2.9199999999999999 111.404 -176.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.441 ' HB ' HD13 ' A' ' 27' ' ' LEU . 59.4 mt -120.26 136.68 56.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.564 -0.744 . . . . 0.23000000000000001 110.239 179.013 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 44.9 mm-40 -92.97 120.49 33.34 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.862 -0.422 . . . . 1.3300000000000001 109.862 179.022 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 40.0 t -102.07 102.05 13.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 116.113 -0.494 . . . . 0.27000000000000002 110.72 -179.023 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.554 ' O ' ' HA ' ' A' ' 74' ' ' ALA . 61.3 tp -86.48 88.66 7.68 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.968 -0.56 . . . . 0.35999999999999999 109.497 175.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.451 ' CD ' ' H ' ' A' ' 31' ' ' ARG . 50.1 mt-10 -74.22 -34.21 63.62 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.207 0.527 . . . . 0.48999999999999999 110.389 -178.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.184 0 CA-C-O 118.322 -1.265 . . . . 1.3899999999999999 111.118 -178.864 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 59.1 t . . . . . 0 N--CA 1.448 -0.534 0 N-CA-C 110.034 -0.358 . . . . 0.52000000000000002 110.034 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.438 ' HB2' ' HG2' ' A' ' 49' ' ' GLU . 48.7 tp -65.82 115.99 6.52 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.353 -0.385 . . . . 0.91000000000000003 110.081 175.41 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.545 HG11 ' CE1' ' A' ' 25' ' ' PHE . 51.7 t -100.69 136.52 31.83 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 CA-C-N 115.902 -0.59 . . . . 0.31 109.692 177.368 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -118.64 -24.46 6.72 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 109.797 -0.446 . . . . 1.1599999999999999 109.797 176.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 16.3 ptp180 -162.69 154.3 18.01 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.06 -0.518 . . . . 2.1600000000000001 110.67 175.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.545 ' CE1' HG11 ' A' ' 22' ' ' VAL . 33.2 m-85 -106.32 145.54 31.53 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.909 -0.587 . . . . 0.34999999999999998 110.498 178.093 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.469 ' O ' ' HA ' ' A' ' 89' ' ' ARG . 50.1 tp60 -125.08 129.39 50.14 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 109.371 -0.603 . . . . 1.3700000000000001 109.371 176.401 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.478 HD13 ' HB ' ' A' ' 90' ' ' ILE . 4.1 mm? -103.31 136.93 42.16 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.675 -0.491 . . . . 0.25 109.675 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.5 t -124.76 128.98 49.6 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.384 -0.371 . . . . 0.94999999999999996 110.05 -179.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 96.48 -11.07 67.03 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.632 -0.794 . . . . 0.20999999999999999 112.562 178.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 6.2 p-10 -67.67 144.95 55.25 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.906 0.384 . . . . 0.44 110.61 178.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.458 ' HB3' ' OE1' ' A' ' 94' ' ' GLU . 21.8 tpp180 -143.57 -37.72 0.34 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.795 -0.639 . . . . 2.48 110.161 179.355 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -68.62 -43.67 75.87 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.669 -0.696 . . . . 1.9099999999999999 110.517 179.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -125.08 151.94 45.0 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.991 -0.744 . . . . 0.25 108.991 175.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -96.78 172.45 7.88 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.199 -0.297 . . . . 0.62 110.199 -178.387 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.529 ' O ' HD13 ' A' ' 39' ' ' LEU . 4.9 m-20 -50.7 -51.35 50.43 Favored 'General case' 0 C--O 1.221 -0.404 0 O-C-N 123.31 0.381 . . . . 0.58999999999999997 110.785 -178.649 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 72.9 mtp180 -55.38 -33.67 63.66 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.946 -0.57 . . . . 3.6600000000000001 111.967 -175.038 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 31.5 tpt85 -77.22 -41.91 39.46 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.683 -0.235 . . . . 2.2999999999999998 110.829 -178.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.501 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -76.17 -27.37 56.92 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.983 0.421 . . . . 0.19 110.8 -178.515 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.529 HD13 ' O ' ' A' ' 35' ' ' ASP . 3.8 mp -60.9 -30.4 70.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.868 -0.605 . . . . 1.77 111.053 176.297 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.63 -23.32 65.97 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.727 -0.67 . . . . 0.29999999999999999 111.633 178.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.549 HD13 HG12 ' A' ' 62' ' ' ILE . 2.3 mt -75.05 -26.65 59.56 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.344 0.592 . . . . 0.20000000000000001 110.3 176.574 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.546 HD21 HD11 ' A' ' 62' ' ' ILE . 0.4 OUTLIER -105.49 14.26 28.9 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.648 -0.706 . . . . 0.22 109.886 -179.086 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 8.3 p80 -51.5 -22.86 3.43 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.408 0.892 . . . . 0.55000000000000004 113.408 -171.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -107.83 -0.4 21.62 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.816 0.302 . . . . 0.59999999999999998 111.816 -174.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 64.1 mt -84.45 -54.05 0.49 Allowed Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 113.462 0.912 . . . . 0.82999999999999996 113.462 -173.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.514 ' HB3' HG12 ' A' ' 22' ' ' VAL . 73.8 Cg_endo -74.22 155.45 46.74 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 121.275 1.316 . . . . 0.33000000000000002 112.051 -170.275 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 99.23 -17.14 58.36 Favored Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 109.444 -1.462 . . . . 0.31 109.444 -167.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 16.4 mt-30 -116.4 173.3 6.68 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.267 -0.966 . . . . 1.46 109.532 176.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.438 ' HG2' ' HB2' ' A' ' 21' ' ' LEU . 43.0 mt-10 -107.51 106.93 17.55 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.234 0.54 . . . . 1.1200000000000001 109.972 178.554 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.474 HD12 ' NE2' ' A' ' 54' ' ' GLN . 2.6 mm? -93.56 126.46 38.73 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.911 -1.04 . . . . 0.38 110.318 -173.646 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.542 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 4.0 p30 -77.25 167.79 21.13 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 121.266 -0.174 . . . . 1.3899999999999999 110.597 178.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.446 ' HA ' HD12 ' A' ' 55' ' ' LEU . 4.2 mm? -46.43 -45.06 17.8 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.453 0.538 . . . . 0.92000000000000004 112.453 -176.181 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.409 ' HA ' ' NE2' ' A' ' 56' ' ' HIS . 33.2 m -56.59 -46.77 80.64 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.697 0.284 . . . . 0.68999999999999995 111.032 -178.21 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.474 ' NE2' HD12 ' A' ' 50' ' ' LEU . 9.8 mt-30 -77.47 -23.72 50.34 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.422 -0.354 . . . . 1.74 111.348 -178.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 78.8 mt -61.41 -53.42 56.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.658 0.266 . . . . 1.1499999999999999 110.366 176.369 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.409 ' NE2' ' HA ' ' A' ' 53' ' ' SER . 34.6 p80 -77.38 -23.65 50.73 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.392 -0.523 . . . . 2.8300000000000001 111.125 -179.333 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.21 -32.15 73.62 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.139 0.495 . . . . 0.31 110.044 174.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.02 -41.36 92.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.62 -0.718 . . . . 0.20999999999999999 110.253 175.007 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.16 -36.79 82.56 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.529 -0.76 . . . . 0.14000000000000001 110.659 178.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.56 -34.6 78.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.911 -0.586 . . . . 0.17000000000000001 111.09 179.361 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -57.31 -41.54 80.06 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.419 0.628 . . . . 0.35999999999999999 110.034 175.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.549 HG12 HD13 ' A' ' 41' ' ' LEU . 76.9 mt -75.9 -36.72 33.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.154 -0.93 . . . . 0.16 110.717 -177.031 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.575 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -58.9 -47.98 87.88 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.688 -0.767 . . . . 0.22 111.689 177.038 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -68.35 -30.92 69.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.711 0.291 . . . . 2.1699999999999999 110.552 178.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.437 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 86.9 t80 -57.79 -49.37 76.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.998 -0.546 . . . . 0.20999999999999999 110.376 177.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 -61.58 -46.66 88.95 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.686 -0.688 . . . . 0.20999999999999999 111.169 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . 0.575 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 15.7 mt-30 -56.84 -40.42 76.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.16 0.505 . . . . 1.21 110.536 179.452 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -63.72 -30.07 71.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.264 -0.88 . . . . 1.6799999999999999 110.73 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.437 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 75.8 mmtt -90.04 6.8 40.76 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.902 -0.59 . . . . 0.56999999999999995 110.927 -178.681 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 104.31 -12.18 51.49 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.953 -0.641 . . . . 0.31 112.914 176.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -88.76 70.16 8.72 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.212 0.529 . . . . 0.39000000000000001 109.602 -179.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 26.1 t -71.1 -24.33 24.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.759 -0.655 . . . . 0.40999999999999998 110.579 -176.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 50.3 tp -80.75 -7.16 59.29 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.668 -0.696 . . . . 1.76 110.389 178.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -99.92 134.86 42.21 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.183 0.516 . . . . 0.37 111.466 -176.234 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 16.7 mmm180 -141.86 164.28 30.63 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.553 -0.749 . . . . 1.8 109.509 176.334 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -127.53 137.5 52.64 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.971 -0.381 . . . . 0.17999999999999999 109.971 179.551 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 48.1 p90 -132.39 143.16 49.64 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.9 0.381 . . . . 0.38 110.298 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.433 ' HA ' ' HD2' ' A' ' 79' ' ' PRO . 8.1 tt -96.18 110.83 54.21 Favored Pre-proline 0 C--N 1.32 -0.705 0 N-CA-C 109.164 -0.68 . . . . 0.39000000000000001 109.164 178.046 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 0.433 ' HD2' ' HA ' ' A' ' 78' ' ' LEU . 11.8 Cg_endo . . . . . 0 N--CA 1.463 -0.282 0 C-N-CA 122.677 2.251 . . . . 1.1200000000000001 111.701 177.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.709 0 N-CA-C 111.271 -0.732 . . . . 0.57999999999999996 111.271 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 25.8 m -100.65 120.57 40.26 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.288 -0.634 . . . . 0.46999999999999997 109.288 173.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 29.6 m -116.36 131.43 68.94 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.938 0 N-CA-C 109.847 -0.427 . . . . 0.31 109.847 179.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.469 ' HA ' ' O ' ' A' ' 26' ' ' GLN . 25.0 ttp180 -106.26 128.71 54.16 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.351 0.596 . . . . 2.9199999999999999 111.221 -174.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.478 ' HB ' HD13 ' A' ' 27' ' ' LEU . 63.1 mt -113.89 134.83 55.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.042 -0.981 . . . . 0.23000000000000001 109.187 177.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -96.49 128.26 43.26 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.216 0.531 . . . . 1.3300000000000001 110.693 -179.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.424 ' CG2' HD12 ' A' ' 27' ' ' LEU . 47.7 t -102.63 124.55 56.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.445 -0.798 . . . . 0.27000000000000002 110.259 -178.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 56.7 tp -107.85 99.93 9.35 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.525 -0.546 . . . . 0.35999999999999999 109.525 177.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.458 ' OE1' ' HB3' ' A' ' 31' ' ' ARG . 69.4 mt-10 -87.61 33.64 0.7 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.889 -0.596 . . . . 0.48999999999999999 111.045 -175.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.901 0 CA-C-O 118.65 -1.084 . . . . 1.3899999999999999 112.13 179.882 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 32.8 t . . . . . 0 N--CA 1.45 -0.437 0 N-CA-C 110.189 -0.301 . . . . 0.52000000000000002 110.189 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.499 ' O ' ' HA2' ' A' ' 86' ' ' GLY . 24.7 tp -72.91 92.0 1.59 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.081 -0.711 . . . . 0.91000000000000003 109.081 174.261 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.56 ' HA ' ' O ' ' A' ' 86' ' ' GLY . 98.8 t -70.66 123.8 25.46 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.048 0 CA-C-N 115.295 -0.866 . . . . 0.31 111.149 -174.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.424 ' HG2' ' HA3' ' A' ' 86' ' ' GLY . 10.7 mmtp -80.84 -40.45 24.86 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.544 -0.753 . . . . 1.1599999999999999 109.449 176.1 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.424 ' HG3' HG23 ' A' ' 87' ' ' THR . 4.6 ptp180 -174.59 169.57 3.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 114.493 -1.23 . . . . 2.1600000000000001 109.392 -179.111 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.525 ' CE1' HG11 ' A' ' 22' ' ' VAL . 33.6 m-85 -106.04 125.1 50.58 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.002 -0.544 . . . . 0.34999999999999998 110.525 178.527 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.408 ' O ' ' HA ' ' A' ' 89' ' ' ARG . 11.9 tp60 -104.63 127.51 52.4 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.325 -0.852 . . . . 1.3700000000000001 108.721 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.453 HD13 ' HB ' ' A' ' 90' ' ' ILE . 3.7 mm? -102.97 134.91 45.62 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.148 0.499 . . . . 0.25 110.321 -177.591 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.462 ' HB2' ' HD3' ' A' ' 89' ' ' ARG . 28.4 t -127.76 135.04 49.59 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.763 -0.653 . . . . 0.94999999999999996 109.797 -178.504 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 91.11 -11.36 72.4 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.672 -0.775 . . . . 0.20999999999999999 112.646 179.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 15.5 p-10 -75.17 137.64 41.46 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.75 0.31 . . . . 0.44 110.688 179.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 30.1 tpt180 -128.2 -44.58 1.42 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.406 -0.361 . . . . 2.48 110.942 177.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 21.8 tp60 -64.85 -40.85 95.81 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.972 0.415 . . . . 1.9099999999999999 110.612 -177.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 -125.63 133.37 52.24 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.936 -0.764 . . . . 0.25 108.936 177.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -88.76 178.08 6.56 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.613 -0.435 . . . . 0.62 110.629 -178.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -47.61 -48.83 28.2 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 123.743 0.652 . . . . 0.58999999999999997 111.909 -176.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 79.0 mtm180 -55.17 -38.22 68.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.835 -0.621 . . . . 3.6600000000000001 111.799 -173.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 37.1 tpt85 -77.57 -38.65 47.99 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.346 -0.388 . . . . 2.2999999999999998 110.883 -176.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.59 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -81.67 -32.57 31.74 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 111.982 0.364 . . . . 0.19 111.982 -174.319 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.5 pp -68.19 -18.83 64.69 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.913 -0.315 . . . . 1.77 110.92 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.46 -24.04 63.74 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.248 -0.433 . . . . 0.29999999999999999 110.653 177.16 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.675 HD13 HG12 ' A' ' 62' ' ' ILE . 1.9 mt -67.44 -22.84 65.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.331 0.586 . . . . 0.20000000000000001 110.143 175.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.505 HD21 HD11 ' A' ' 62' ' ' ILE . 0.7 OUTLIER -111.93 13.26 20.83 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.712 -0.676 . . . . 0.22 110.403 -179.041 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 5.4 p80 -51.11 -21.87 2.16 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 113.488 0.921 . . . . 0.55000000000000004 113.488 -172.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -94.88 -8.89 35.9 Favored 'General case' 0 C--N 1.328 -0.359 0 O-C-N 122.261 -0.274 . . . . 0.59999999999999998 111.643 -175.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.401 ' O ' HD21 ' A' ' 50' ' ' LEU . 87.7 mt -87.21 -58.18 0.29 Allowed Pre-proline 0 C--N 1.325 -0.495 0 N-CA-C 113.601 0.963 . . . . 0.82999999999999996 113.601 -171.188 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.525 ' HB3' HG12 ' A' ' 22' ' ' VAL . 61.0 Cg_endo -68.81 156.46 65.36 Favored 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 121.406 1.404 . . . . 0.33000000000000002 112.439 -168.613 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 96.67 -14.89 63.59 Favored Glycine 0 N--CA 1.446 -0.69 0 N-CA-C 109.895 -1.282 . . . . 0.31 109.895 -168.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -120.23 172.95 7.42 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 114.802 -0.699 . . . . 1.46 109.699 176.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -97.21 108.92 21.75 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.902 -0.59 . . . . 1.1200000000000001 110.307 177.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.418 HD22 ' N ' ' A' ' 50' ' ' LEU . 2.6 mm? -99.12 131.78 44.91 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.902 -0.59 . . . . 0.38 109.763 -179.472 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.551 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 8.1 p30 -75.31 163.38 27.53 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.157 -0.474 . . . . 1.3899999999999999 110.819 179.486 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.44 HD13 HD12 ' A' ' 55' ' ' LEU . 4.4 mm? -52.03 -43.03 63.54 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 123.258 0.349 . . . . 0.92000000000000004 111.77 -176.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.1 m -56.87 -49.18 76.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.882 0.372 . . . . 0.68999999999999995 110.303 178.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 11.7 mt-30 -68.0 -29.19 68.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.011 -0.54 . . . . 1.74 111.467 178.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.551 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 77.4 mt -65.42 -43.05 91.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.998 0.428 . . . . 1.1499999999999999 110.236 176.323 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -72.35 -33.97 67.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.512 -0.313 . . . . 2.8300000000000001 110.465 178.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.25 -30.98 72.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.076 0.465 . . . . 0.31 110.617 177.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.53 -42.15 98.39 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.775 -0.648 . . . . 0.20999999999999999 110.74 176.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.61 -34.41 78.16 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.916 -0.584 . . . . 0.14000000000000001 110.821 178.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.32 -36.52 82.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.915 -0.584 . . . . 0.17000000000000001 111.128 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.472 ' HD2' ' CD1' ' A' ' 42' ' ' LEU . 94.0 mtt180 -57.89 -41.41 82.48 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.107 -0.497 . . . . 0.35999999999999999 110.428 177.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.675 HG12 HD13 ' A' ' 41' ' ' LEU . 68.3 mt -78.42 -34.9 18.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.526 -0.761 . . . . 0.16 110.533 -176.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.438 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -59.85 -47.39 91.23 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.765 -0.731 . . . . 0.22 111.692 176.279 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -71.28 -24.25 62.12 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.505 0.193 . . . . 2.1699999999999999 110.917 177.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.439 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 93.1 t80 -60.36 -49.41 77.7 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.116 0.484 . . . . 0.20999999999999999 110.019 176.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 8.1 m-85 -62.2 -42.27 99.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.593 -0.73 . . . . 0.20999999999999999 110.721 176.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . 0.438 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 49.8 mt-30 -61.06 -36.0 78.45 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.109 -0.496 . . . . 1.21 111.093 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -62.22 -35.47 78.98 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.1 0.476 . . . . 1.6799999999999999 110.347 176.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.439 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 73.1 mmtt -83.23 4.75 25.53 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.845 -0.616 . . . . 0.56999999999999995 110.98 -176.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 98.97 -2.99 58.39 Favored Glycine 0 N--CA 1.449 -0.494 0 CA-C-N 116.01 -0.541 . . . . 0.31 112.706 177.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 45.9 m-85 -88.58 75.18 8.35 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.336 0.588 . . . . 0.39000000000000001 109.721 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 21.9 t -74.07 -23.87 18.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.561 -0.745 . . . . 0.40999999999999998 110.313 -177.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 86.0 mt -81.31 -3.03 51.31 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.848 -0.615 . . . . 1.76 110.806 178.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -102.23 147.16 26.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.918 -0.583 . . . . 0.37 110.996 -178.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 26.1 tpt180 -160.19 136.15 8.52 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.944 -0.571 . . . . 1.8 109.73 177.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -99.11 140.54 33.11 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.646 -0.252 . . . . 0.17999999999999999 110.438 179.026 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 46.3 p90 -137.3 155.07 49.89 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.909 0.385 . . . . 0.38 110.407 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 9.9 tt -110.84 107.07 57.93 Favored Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 109.778 -0.453 . . . . 0.39000000000000001 109.778 -178.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo . . . . . 0 C--O 1.233 0.268 0 C-N-CA 123.004 2.469 . . . . 1.1200000000000001 112.298 -178.679 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . 0.56 ' O ' ' HA ' ' A' ' 22' ' ' VAL . . . . . . . . 0 N--CA 1.449 -0.495 0 N-CA-C 111.78 -0.528 . . . . 0.57999999999999996 111.78 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . 0.424 HG23 ' HG3' ' A' ' 24' ' ' ARG . 85.5 m -72.87 120.96 19.23 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 117.191 0.496 . . . . 0.46999999999999997 110.315 177.193 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 34.2 m -102.33 138.16 27.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 109.858 -0.423 . . . . 0.31 109.858 179.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.462 ' HD3' ' HB2' ' A' ' 28' ' ' SER . 23.0 ttm180 -107.19 129.01 54.91 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.15 0.5 . . . . 2.9199999999999999 111.107 -177.476 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.453 ' HB ' HD13 ' A' ' 27' ' ' LEU . 56.6 mt -113.65 130.74 67.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.543 -0.753 . . . . 0.23000000000000001 109.413 176.596 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -95.22 125.4 39.84 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.373 0.606 . . . . 1.3300000000000001 110.36 -179.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 71.7 t -98.71 103.47 14.74 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 115.287 -0.869 . . . . 0.27000000000000002 110.434 -177.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 52.3 tp -85.93 93.62 8.99 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.396 -0.594 . . . . 0.35999999999999999 109.396 176.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -72.17 -18.98 61.82 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.121 -0.491 . . . . 0.48999999999999999 110.423 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.157 0 CA-C-O 117.976 -1.458 . . . . 1.3899999999999999 111.037 179.398 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 75.1 t . . . . . 0 N--CA 1.443 -0.781 0 N-CA-C 109.67 -0.492 . . . . 0.52000000000000002 109.67 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.596 ' O ' ' HA2' ' A' ' 86' ' ' GLY . 50.8 tp -71.3 91.85 1.0 Allowed 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.574 -0.528 . . . . 0.91000000000000003 109.574 176.175 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.596 HG12 ' HB3' ' A' ' 46' ' ' PRO . 61.7 t -68.71 113.54 4.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.932 0 CA-C-N 115.339 -0.846 . . . . 0.31 110.582 -178.132 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -92.84 -32.36 14.65 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.545 -0.752 . . . . 1.1599999999999999 109.168 175.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 12.5 ptp180 -163.87 158.5 19.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.562 -0.745 . . . . 2.1600000000000001 110.342 -179.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.56 ' CE1' HG11 ' A' ' 22' ' ' VAL . 31.9 m-85 -105.25 142.0 35.79 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.985 -0.552 . . . . 0.34999999999999998 109.822 176.018 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 45.0 tp60 -123.16 128.27 49.83 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.198 -0.667 . . . . 1.3700000000000001 109.198 178.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.52 HD13 ' HB ' ' A' ' 90' ' ' ILE . 3.9 mm? -103.36 133.39 48.5 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.124 0.488 . . . . 0.25 110.436 -177.814 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.485 ' O ' ' HA ' ' A' ' 91' ' ' GLU . 23.1 t -127.51 126.2 41.81 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.899 -0.592 . . . . 0.94999999999999996 109.929 -178.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 100.97 -15.17 58.31 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.545 -0.836 . . . . 0.20999999999999999 112.372 179.086 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 15.1 p-10 -72.38 136.21 46.06 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.754 0.312 . . . . 0.44 110.663 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.8 tpp180 -130.12 -39.28 1.37 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.248 -0.433 . . . . 2.48 110.708 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 24.0 tp60 -68.41 -40.24 81.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.012 0.434 . . . . 1.9099999999999999 110.634 -179.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -126.59 134.66 50.75 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.027 -0.533 . . . . 0.25 109.64 179.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -79.31 176.19 9.91 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.943 -0.571 . . . . 0.62 111.593 -176.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.507 ' O ' HD13 ' A' ' 39' ' ' LEU . 6.4 m-20 -55.99 -57.01 13.9 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 116.147 -0.479 . . . . 0.58999999999999997 110.991 -178.502 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.434 ' HA ' HD22 ' A' ' 39' ' ' LEU . 74.2 mtp180 -58.03 -34.77 70.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.233 -0.439 . . . . 3.6600000000000001 111.502 -175.147 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 15.0 tpt180 -62.26 -46.14 90.14 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.096 -0.502 . . . . 2.2999999999999998 110.684 176.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.546 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -78.08 -27.54 48.59 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.138 -0.483 . . . . 0.19 111.311 -178.139 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.507 HD13 ' O ' ' A' ' 35' ' ' ASP . 1.8 mp -57.18 -35.15 69.24 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.085 -0.507 . . . . 1.77 111.318 177.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.5 -25.51 66.13 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.042 -0.526 . . . . 0.29999999999999999 111.697 178.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.575 HD13 HG12 ' A' ' 62' ' ' ILE . 4.0 mt -69.62 -28.06 65.61 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.155 0.503 . . . . 0.20000000000000001 110.45 177.014 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.559 HD21 HD11 ' A' ' 62' ' ' ILE . 0.4 OUTLIER -106.53 13.27 28.55 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.898 -0.592 . . . . 0.22 110.164 -178.299 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 9.3 p80 -48.86 -26.11 2.26 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.821 1.045 . . . . 0.55000000000000004 113.821 -172.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -105.08 5.97 32.89 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 111.98 0.363 . . . . 0.59999999999999998 111.98 -174.101 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 84.3 mt -94.67 -52.19 0.24 Allowed Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 113.84 1.052 . . . . 0.82999999999999996 113.84 -173.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.596 ' HB3' HG12 ' A' ' 22' ' ' VAL . 71.8 Cg_endo -74.61 157.41 44.41 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 121.233 1.289 . . . . 0.33000000000000002 112.254 -169.665 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 98.44 -5.9 60.86 Favored Glycine 0 N--CA 1.446 -0.648 0 N-CA-C 110.023 -1.231 . . . . 0.31 110.023 -169.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -121.15 170.52 9.48 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.733 -0.734 . . . . 1.46 109.085 176.253 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -100.07 107.56 19.5 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.477 -0.564 . . . . 1.1200000000000001 109.477 176.395 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -101.01 122.91 44.36 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.595 -0.729 . . . . 0.38 110.376 -175.068 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.61 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 31.2 p-10 -72.26 166.3 22.71 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.553 -0.294 . . . . 1.3899999999999999 110.805 177.587 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.485 ' HA ' HD12 ' A' ' 55' ' ' LEU . 4.6 mm? -48.34 -46.06 36.08 Favored 'General case' 0 C--N 1.329 -0.3 0 O-C-N 123.461 0.476 . . . . 0.92000000000000004 111.585 -177.26 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.443 ' HA ' ' NE2' ' A' ' 56' ' ' HIS . 13.1 m -50.61 -53.53 30.01 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.878 -0.601 . . . . 0.68999999999999995 111.113 178.605 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -72.7 -23.83 60.92 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.005 -0.543 . . . . 1.74 111.679 -178.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.61 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 85.5 mt -65.1 -53.0 52.18 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.579 -0.282 . . . . 1.1499999999999999 110.9 179.426 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.443 ' NE2' ' HA ' ' A' ' 53' ' ' SER . 31.5 p80 -74.34 -23.46 59.04 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.396 -0.522 . . . . 2.8300000000000001 111.203 -179.448 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.12 -33.85 75.23 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.989 0.423 . . . . 0.31 110.516 175.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.87 -34.87 76.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.782 -0.644 . . . . 0.20999999999999999 110.854 176.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.98 -30.37 69.63 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.942 -0.572 . . . . 0.14000000000000001 110.887 -179.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.85 -28.9 69.87 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.98 -0.555 . . . . 0.17000000000000001 110.829 179.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 78.0 mtt180 -63.06 -39.84 95.91 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.161 0.505 . . . . 0.35999999999999999 110.129 176.251 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.575 HG12 HD13 ' A' ' 41' ' ' LEU . 78.6 mt -79.05 -36.32 18.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.467 -0.788 . . . . 0.16 110.726 -177.294 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.633 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -59.94 -46.9 93.32 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.389 -0.91 . . . . 0.22 111.038 174.579 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.426 ' O ' ' HG3' ' A' ' 68' ' ' GLU . 21.6 t70 -63.51 -37.52 87.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.624 -0.288 . . . . 2.1699999999999999 110.653 176.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.421 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 82.8 t80 -53.22 -53.5 49.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.918 -0.583 . . . . 0.20999999999999999 110.834 177.003 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -59.63 -40.52 87.89 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.709 -0.678 . . . . 0.20999999999999999 111.184 178.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . 0.633 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 78.4 mt-30 -61.69 -37.89 85.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.483 -0.326 . . . . 1.21 111.226 -178.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 64' ' ' ASP . 44.0 mt-10 -70.27 -19.67 63.1 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.058 0.456 . . . . 1.6799999999999999 110.658 178.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.421 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 75.3 mmtt -90.74 6.47 43.98 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.022 -0.536 . . . . 0.56999999999999995 110.326 177.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 97.54 -8.95 64.38 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 121.06 -0.59 . . . . 0.31 112.555 177.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -88.46 73.29 8.75 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.381 0.61 . . . . 0.39000000000000001 109.8 -178.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 23.8 t -71.31 -28.57 32.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.45 -0.795 . . . . 0.40999999999999998 110.927 -176.039 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 10.8 mp -82.4 -3.47 55.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.282 -0.417 . . . . 1.76 110.92 179.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -91.39 136.24 33.25 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.073 -0.512 . . . . 0.37 110.494 179.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 17.1 tpt180 -149.03 131.73 15.94 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.945 -0.57 . . . . 1.8 110.071 -179.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.75 138.36 36.02 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.029 -0.532 . . . . 0.17999999999999999 109.93 176.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 52.9 p90 -137.45 155.49 49.26 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.555 -0.535 . . . . 0.38 109.555 179.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.433 HD13 ' HB3' ' A' ' 55' ' ' LEU . 3.8 tt -111.59 108.91 56.1 Favored Pre-proline 0 C--N 1.318 -0.782 0 N-CA-C 109.64 -0.504 . . . . 0.39000000000000001 109.64 -179.389 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 0.49 ' HG3' ' OE2' ' A' ' 91' ' ' GLU . 36.8 Cg_endo . . . . . 0 C--O 1.234 0.319 0 C-N-CA 122.768 2.312 . . . . 1.1200000000000001 112.165 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . 0.596 ' HA2' ' O ' ' A' ' 21' ' ' LEU . . . . . . . . 0 N--CA 1.445 -0.754 0 N-CA-C 111.94 -0.464 . . . . 0.57999999999999996 111.94 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 12.5 m -98.32 121.16 39.91 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.772 0.32 . . . . 0.46999999999999997 110.736 179.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.405 ' HB ' HD11 ' A' ' 78' ' ' LEU . 34.8 m -103.51 134.98 43.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 N-CA-C 109.658 -0.497 . . . . 0.31 109.658 176.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.484 ' O ' ' HD2' ' A' ' 79' ' ' PRO . 37.4 ttp180 -111.54 115.3 28.95 Favored 'General case' 0 C--N 1.32 -0.713 0 C-N-CA 120.554 -0.458 . . . . 2.9199999999999999 110.968 -177.289 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.52 ' HB ' HD13 ' A' ' 27' ' ' LEU . 60.9 mt -101.88 126.21 55.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.789 -0.641 . . . . 0.23000000000000001 109.779 177.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.49 ' OE2' ' HG3' ' A' ' 79' ' ' PRO . 53.8 mt-10 -94.76 125.23 39.28 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.17 0.509 . . . . 1.3300000000000001 110.271 -179.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.402 ' CG2' HD12 ' A' ' 27' ' ' LEU . 40.2 t -101.63 100.97 11.43 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-N 115.513 -0.767 . . . . 0.27000000000000002 110.588 -175.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 57.7 tp -86.18 90.05 8.02 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.359 -0.608 . . . . 0.35999999999999999 109.359 176.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -68.47 -27.42 66.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.685 -0.688 . . . . 0.48999999999999999 110.689 -176.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.153 0 CA-C-O 118.47 -1.183 . . . . 1.3899999999999999 111.584 178.695 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 41.3 t . . . . . 0 N--CA 1.449 -0.487 0 N-CA-C 109.671 -0.492 . . . . 0.52000000000000002 109.671 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.408 ' HB2' ' HG2' ' A' ' 49' ' ' GLU . 45.4 tp -68.51 97.52 0.78 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.189 0.518 . . . . 0.91000000000000003 110.02 177.249 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.583 HG12 ' HB3' ' A' ' 46' ' ' PRO . 57.7 t -75.68 120.33 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.996 0 CA-C-N 115.43 -0.804 . . . . 0.31 109.798 178.503 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 66.7 mttt -104.13 -22.39 13.42 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.789 -0.641 . . . . 1.1599999999999999 109.362 179.068 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -169.34 160.09 9.19 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.56 -0.745 . . . . 2.1600000000000001 110.623 178.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.512 ' CE1' HG11 ' A' ' 22' ' ' VAL . 21.4 m-85 -111.31 148.06 33.75 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.742 -0.663 . . . . 0.34999999999999998 109.231 176.034 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 60.4 tp60 -129.74 134.59 47.7 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 109.541 -0.54 . . . . 1.3700000000000001 109.541 174.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.474 ' HG ' HD23 ' A' ' 38' ' ' LEU . 3.4 mm? -103.62 135.09 45.85 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 121.052 0.453 . . . . 0.25 109.995 -178.527 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.538 ' O ' ' HA ' ' A' ' 91' ' ' GLU . 45.2 m -129.35 120.49 25.67 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.902 -0.59 . . . . 0.94999999999999996 110.255 177.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 111.86 -11.04 27.47 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.927 -0.654 . . . . 0.20999999999999999 112.038 -179.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 17.7 p-10 -84.67 139.65 31.88 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.137 0.494 . . . . 0.44 110.802 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.9 tpp180 -136.67 -32.82 0.81 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.389 -0.823 . . . . 2.48 109.898 177.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -66.48 -40.14 89.16 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.985 -0.552 . . . . 1.9099999999999999 111.307 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.425 ' CZ ' ' HG3' ' A' ' 69' ' ' LYS . 82.4 m-85 -126.34 137.39 53.46 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 110.104 -0.332 . . . . 0.25 110.104 179.197 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -72.91 168.1 19.64 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.972 -0.558 . . . . 0.62 110.923 -178.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.65 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 58.1 m-20 -53.61 -55.87 22.09 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 123.402 0.439 . . . . 0.58999999999999997 111.326 -175.167 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.424 ' HA ' HD12 ' A' ' 39' ' ' LEU . 61.0 ttp180 -57.73 -37.48 73.64 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.354 -0.384 . . . . 3.6600000000000001 111.581 -175.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 17.1 tpt180 -59.35 -36.0 74.91 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.107 0.479 . . . . 2.2999999999999998 110.452 177.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.605 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -87.14 -24.51 24.49 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.952 -0.567 . . . . 0.19 110.929 179.57 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.65 ' HG ' ' O ' ' A' ' 35' ' ' ASP . 83.4 mt -66.07 -34.59 78.41 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.6 -0.273 . . . . 1.77 111.187 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.8 -23.46 63.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.172 -0.467 . . . . 0.29999999999999999 111.311 178.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.614 HD13 HG12 ' A' ' 62' ' ' ILE . 5.7 mt -68.22 -29.6 68.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.026 0.441 . . . . 0.20000000000000001 110.581 176.026 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.596 HD21 HD11 ' A' ' 62' ' ' ILE . 0.4 OUTLIER -107.34 13.14 27.38 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.076 -0.511 . . . . 0.22 110.347 -177.629 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 5.3 p80 -50.43 -26.32 4.91 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 113.047 0.758 . . . . 0.55000000000000004 113.047 -173.114 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -97.94 0.99 47.51 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.216 0.45 . . . . 0.59999999999999998 112.216 -173.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.476 ' O ' HD21 ' A' ' 50' ' ' LEU . 79.6 mt -93.51 -56.28 0.23 Allowed Pre-proline 0 C--N 1.324 -0.538 0 N-CA-C 113.731 1.012 . . . . 0.82999999999999996 113.731 -173.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.583 ' HB3' HG12 ' A' ' 22' ' ' VAL . 87.5 Cg_endo -74.54 154.8 45.11 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 121.35 1.367 . . . . 0.33000000000000002 112.587 -167.291 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 103.38 -8.68 52.74 Favored Glycine 0 N--CA 1.447 -0.583 0 N-CA-C 109.95 -1.26 . . . . 0.31 109.95 -169.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -122.87 167.5 13.46 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 114.637 -0.782 . . . . 1.46 109.458 176.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.408 ' HG2' ' HB2' ' A' ' 21' ' ' LEU . 39.4 mt-10 -98.86 89.75 4.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.532 0.682 . . . . 1.1200000000000001 109.502 176.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.476 HD21 ' O ' ' A' ' 45' ' ' LEU . 1.9 mm? -79.52 135.69 36.7 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.739 -1.119 . . . . 0.38 109.946 -177.666 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -81.51 161.48 23.59 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.215 -0.661 . . . . 1.3899999999999999 109.215 175.2 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -46.67 -40.49 13.26 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 113.137 0.791 . . . . 0.92000000000000004 113.137 -173.061 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.7 m -58.1 -38.06 75.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.931 0.396 . . . . 0.68999999999999995 111.044 -178.556 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -72.49 -38.34 68.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.072 -0.513 . . . . 1.74 110.827 178.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.463 ' HB3' HD13 ' A' ' 78' ' ' LEU . 9.8 mp -60.56 -44.64 95.93 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.261 -0.427 . . . . 1.1499999999999999 111.421 176.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 77.9 m-70 -68.35 -31.79 71.42 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.893 -0.323 . . . . 2.8300000000000001 110.73 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.13 -28.89 69.74 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.23 0.538 . . . . 0.31 110.453 177.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.81 -39.58 94.72 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.519 -0.764 . . . . 0.20999999999999999 111.06 177.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.22 -34.72 78.66 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.858 -0.61 . . . . 0.14000000000000001 111.231 -178.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.88 -35.87 82.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 0.17000000000000001 110.947 -179.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 -58.82 -38.77 79.38 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.879 -0.6 . . . . 0.35999999999999999 110.446 178.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.614 HG12 HD13 ' A' ' 41' ' ' LEU . 66.2 mt -79.52 -37.77 18.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.285 -0.871 . . . . 0.16 110.871 -175.094 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -61.5 -44.65 97.72 Favored Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 120.389 -0.91 . . . . 0.22 111.65 177.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -73.96 -24.23 59.61 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.619 0.247 . . . . 2.1699999999999999 110.874 178.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.468 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 91.3 t80 -59.78 -48.8 80.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.121 0.486 . . . . 0.20999999999999999 109.862 174.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . 0.447 ' HB3' ' HB2' ' A' ' 71' ' ' TYR . 10.0 m-85 -59.82 -46.03 90.53 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.463 -0.79 . . . . 0.20999999999999999 111.173 177.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 17.6 mt-30 -59.83 -38.61 82.54 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.464 -0.334 . . . . 1.21 111.083 -179.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -61.91 -35.58 78.8 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.554 -0.535 . . . . 1.6799999999999999 109.554 178.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.468 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 69.6 mmtt -82.58 2.6 32.39 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.837 -0.619 . . . . 0.56999999999999995 111.113 -179.314 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 106.51 -7.78 39.91 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 121.047 -0.597 . . . . 0.31 112.936 175.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . 0.447 ' HB2' ' HB3' ' A' ' 66' ' ' TYR . 70.5 m-85 -89.26 73.68 8.01 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.153 0.502 . . . . 0.39000000000000001 109.805 -179.702 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 43.8 t -69.04 -29.02 41.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.779 -0.646 . . . . 0.40999999999999998 111.204 -175.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 67.3 mt -91.38 22.68 3.78 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.026 0.441 . . . . 1.76 111.042 177.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.416 ' HB1' ' HA ' ' A' ' 94' ' ' GLU . . . -121.22 120.29 34.77 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.068 -0.515 . . . . 0.37 110.547 178.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 19.5 mmm180 -128.95 170.82 12.97 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.073 -0.512 . . . . 1.8 109.739 177.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -133.18 132.75 41.93 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 109.707 -0.479 . . . . 0.17999999999999999 109.707 178.056 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 51.0 p90 -129.3 143.39 50.83 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.847 0.356 . . . . 0.38 110.171 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.463 HD13 ' HB3' ' A' ' 55' ' ' LEU . 6.6 tt -93.7 107.43 27.17 Favored Pre-proline 0 C--N 1.319 -0.732 0 N-CA-C 108.948 -0.76 . . . . 0.39000000000000001 108.948 178.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 0.427 ' HD2' ' HA ' ' A' ' 78' ' ' LEU . 12.4 Cg_endo . . . . . 0 C--N 1.348 0.546 0 C-N-CA 123.534 2.823 . . . . 1.1200000000000001 112.881 -175.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.838 0 N-CA-C 112.352 -0.299 . . . . 0.57999999999999996 112.352 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 19.6 m -91.91 120.66 32.79 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 120.925 0.393 . . . . 0.46999999999999997 110.627 179.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 31.0 m -108.53 132.52 56.19 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 N-CA-C 109.258 -0.645 . . . . 0.31 109.258 175.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.49 ' HD3' ' OG ' ' A' ' 28' ' ' SER . 27.2 ttm180 -109.32 128.79 55.37 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 121.13 0.49 . . . . 2.9199999999999999 110.9 -176.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 59.5 mt -113.45 135.06 54.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.399 -0.819 . . . . 0.23000000000000001 109.696 178.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.538 ' HA ' ' O ' ' A' ' 28' ' ' SER . 45.8 mt-10 -94.91 122.46 37.56 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.227 0.537 . . . . 1.3300000000000001 110.318 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 60.0 t -98.35 123.75 51.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 115.493 -0.776 . . . . 0.27000000000000002 110.103 -178.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 47.6 tp -108.97 94.8 5.24 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 109.315 -0.624 . . . . 0.35999999999999999 109.315 178.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.416 ' HA ' ' HB1' ' A' ' 74' ' ' ALA . 48.1 mt-10 -77.4 2.56 15.64 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.628 -0.715 . . . . 0.48999999999999999 111.035 -174.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.782 0 CA-C-O 118.818 -0.99 . . . . 1.3899999999999999 112.08 177.212 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 50.0 t . . . . . 0 N--CA 1.449 -0.494 0 N-CA-C 109.787 -0.449 . . . . 0.52000000000000002 109.787 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.494 ' HA ' ' HA ' ' A' ' 49' ' ' GLU . 55.3 tp -65.66 115.76 6.17 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.021 0.439 . . . . 0.91000000000000003 110.247 177.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.591 HG12 ' HB3' ' A' ' 46' ' ' PRO . 48.5 t -95.54 121.67 46.3 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 CA-C-N 115.842 -0.617 . . . . 0.31 110.353 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 80.2 mttt -107.35 -27.22 10.61 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.589 -0.732 . . . . 1.1599999999999999 109.704 177.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.8 ptp180 -161.74 161.71 29.39 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.837 -0.619 . . . . 2.1600000000000001 110.876 177.303 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.521 ' CE2' ' HG ' ' A' ' 42' ' ' LEU . 29.2 m-85 -110.72 137.04 48.9 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.715 -0.675 . . . . 0.34999999999999998 109.799 176.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 19.2 tp60 -119.12 129.45 55.05 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.409 -0.589 . . . . 1.3700000000000001 109.409 177.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.534 HD13 ' HB ' ' A' ' 90' ' ' ILE . 3.8 mm? -103.02 132.68 49.11 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.259 0.552 . . . . 0.25 110.113 -179.63 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 48.1 t -121.71 122.16 38.92 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.495 -0.775 . . . . 0.94999999999999996 109.667 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 103.79 -16.11 51.53 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.625 -0.798 . . . . 0.20999999999999999 112.331 179.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 20.7 p-10 -69.18 126.53 30.08 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.051 0.453 . . . . 0.44 110.367 179.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.576 ' HA ' ' NE ' ' A' ' 31' ' ' ARG . 1.9 mmp_? -125.97 -34.64 2.55 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.266 -0.425 . . . . 2.48 110.678 179.435 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.431 ' HG2' ' CZ ' ' A' ' 71' ' ' TYR . 57.5 tp60 -75.17 -38.29 60.94 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.258 -0.428 . . . . 1.9099999999999999 110.598 -179.697 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -123.44 146.91 47.65 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.605 -0.517 . . . . 0.25 109.605 178.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -92.41 169.71 10.35 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.27 -0.423 . . . . 0.62 111.233 -176.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.527 ' O ' HD13 ' A' ' 39' ' ' LEU . 4.1 m-20 -56.07 -52.87 62.74 Favored 'General case' 0 CA--C 1.517 -0.323 0 O-C-N 123.258 0.349 . . . . 0.58999999999999997 110.616 -177.579 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 61.9 ttp180 -52.79 -39.61 62.46 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.307 -0.406 . . . . 3.6600000000000001 111.1 -177.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 15.4 tpt180 -63.75 -50.09 70.45 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.925 -0.58 . . . . 2.2999999999999998 111.094 178.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.528 HD23 ' HG ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -73.56 -26.79 61.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.844 0.354 . . . . 0.19 111.261 -176.736 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.527 HD13 ' O ' ' A' ' 35' ' ' ASP . 2.3 mp -60.14 -32.93 71.48 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.154 -0.475 . . . . 1.77 111.781 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.54 -25.58 66.25 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.146 -0.479 . . . . 0.29999999999999999 111.452 179.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.523 HD13 HG12 ' A' ' 62' ' ' ILE . 1.7 mt -70.12 -27.49 64.62 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.888 0.375 . . . . 0.20000000000000001 110.431 176.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.616 HD21 HD11 ' A' ' 62' ' ' ILE . 0.4 OUTLIER -107.55 13.32 26.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.94 -0.573 . . . . 0.22 110.447 -177.184 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 6.5 p80 -51.92 -24.77 6.85 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.798 -0.637 . . . . 0.55000000000000004 112.554 -173.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -101.02 3.38 41.43 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.369 0.507 . . . . 0.59999999999999998 112.369 -172.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 86.9 mt -95.53 -54.87 0.22 Allowed Pre-proline 0 C--N 1.323 -0.556 0 N-CA-C 113.932 1.086 . . . . 0.82999999999999996 113.932 -172.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.591 ' HB3' HG12 ' A' ' 22' ' ' VAL . 75.3 Cg_endo -73.41 161.38 42.69 Favored 'Trans proline' 0 C--N 1.351 0.697 0 C-N-CA 121.318 1.345 . . . . 0.33000000000000002 112.678 -168.205 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 100.87 3.98 54.63 Favored Glycine 0 N--CA 1.449 -0.477 0 N-CA-C 110.594 -1.002 . . . . 0.31 110.594 -170.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -143.07 170.23 16.11 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.858 -0.671 . . . . 1.46 109.282 177.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.494 ' HA ' ' HA ' ' A' ' 21' ' ' LEU . 35.9 mt-10 -98.46 96.04 7.73 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.384 0.611 . . . . 1.1200000000000001 109.679 178.235 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.42 ' HA ' ' OE1' ' A' ' 54' ' ' GLN . 2.7 mm? -83.72 140.77 31.91 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.068 -0.969 . . . . 0.38 109.604 -178.216 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -88.87 161.55 16.63 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.484 -0.561 . . . . 1.3899999999999999 109.484 178.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -45.08 -43.4 9.52 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.462 0.912 . . . . 0.92000000000000004 113.462 -172.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.658 ' HA ' ' NE2' ' A' ' 56' ' ' HIS . 50.0 m -58.61 -37.12 75.17 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.929 0.395 . . . . 0.68999999999999995 110.971 179.562 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.42 ' OE1' ' HA ' ' A' ' 50' ' ' LEU . 99.5 mt-30 -72.2 -38.67 69.0 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.656 -0.702 . . . . 1.74 110.56 179.043 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.655 ' HB3' HD13 ' A' ' 78' ' ' LEU . 9.4 mp -58.87 -54.78 43.23 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 112.62 0.6 . . . . 1.1499999999999999 112.62 179.206 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.658 ' NE2' ' HA ' ' A' ' 53' ' ' SER . 32.7 p80 -72.76 -23.48 60.83 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.014 -0.674 . . . . 2.8300000000000001 111.294 -177.579 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.07 -32.94 73.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.288 0.565 . . . . 0.31 109.976 173.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.415 ' HB3' ' O ' ' A' ' 55' ' ' LEU . . . -63.63 -37.79 88.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.392 -0.822 . . . . 0.20999999999999999 110.638 175.393 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.07 -34.03 77.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.733 -0.667 . . . . 0.14000000000000001 110.686 179.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.58 -35.0 78.12 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.929 -0.578 . . . . 0.17000000000000001 111.013 178.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 88.6 mtt180 -59.06 -42.38 90.18 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.24 0.543 . . . . 0.35999999999999999 109.976 177.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.616 HD11 HD21 ' A' ' 42' ' ' LEU . 80.9 mt -77.6 -37.39 24.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.398 -0.819 . . . . 0.16 110.3 -177.349 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.606 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -57.55 -46.48 91.99 Favored Glycine 0 N--CA 1.442 -0.909 0 CA-C-N 115.447 -0.797 . . . . 0.22 111.583 176.168 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -68.97 -33.51 73.8 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.61 0.243 . . . . 2.1699999999999999 110.395 177.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.581 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 76.8 t80 -54.68 -49.38 70.79 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.016 -0.538 . . . . 0.20999999999999999 110.508 177.577 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -62.12 -47.16 85.85 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.004 -0.544 . . . . 0.20999999999999999 111.159 178.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . 0.606 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 14.3 mt-30 -57.48 -41.72 81.2 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.359 0.599 . . . . 1.21 110.45 179.49 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -58.37 -38.55 77.48 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.135 -0.939 . . . . 1.6799999999999999 110.798 178.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.581 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 68.9 mmtt -82.33 2.88 30.1 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.937 -0.574 . . . . 0.56999999999999995 111.058 -177.302 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.31 -14.6 30.57 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 121.017 -0.611 . . . . 0.31 112.683 176.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . 0.431 ' CZ ' ' HG2' ' A' ' 32' ' ' GLN . 60.7 m-85 -83.33 69.49 9.99 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.182 0.515 . . . . 0.39000000000000001 110.239 -177.37 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 41.1 t -69.89 -23.95 26.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.776 -0.647 . . . . 0.40999999999999998 110.841 -177.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 95.0 mt -83.04 -3.2 57.0 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 1.76 110.811 178.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -101.08 144.12 30.37 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.914 -0.585 . . . . 0.37 110.867 -178.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 20.7 tpt180 -154.33 137.33 15.49 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.015 -0.539 . . . . 1.8 110.033 178.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -102.41 135.49 43.94 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.271 -0.422 . . . . 0.17999999999999999 110.141 177.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 48.7 p90 -135.6 151.06 49.9 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.722 -0.473 . . . . 0.38 109.722 179.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.655 HD13 ' HB3' ' A' ' 55' ' ' LEU . 6.7 tt -107.54 109.47 62.53 Favored Pre-proline 0 C--N 1.32 -0.704 0 N-CA-C 109.5 -0.556 . . . . 0.39000000000000001 109.5 -179.487 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo . . . . . 0 N--CA 1.46 -0.469 0 C-N-CA 122.609 2.206 . . . . 1.1200000000000001 112.06 179.84 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.816 0 N-CA-C 112.469 -0.252 . . . . 0.57999999999999996 112.469 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 20.4 m -117.81 120.77 38.92 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 120.866 0.365 . . . . 0.46999999999999997 110.802 -177.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 34.3 m -103.1 137.02 32.93 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 109.638 -0.504 . . . . 0.31 109.638 176.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 30.4 ttm180 -113.58 117.6 32.07 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.122 0.486 . . . . 2.9199999999999999 110.778 -177.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.534 ' HB ' HD13 ' A' ' 27' ' ' LEU . 70.0 mt -103.83 129.73 55.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.465 -0.789 . . . . 0.23000000000000001 109.605 177.609 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -94.7 123.61 38.24 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.147 0.499 . . . . 1.3300000000000001 110.266 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 40.6 t -101.8 108.28 23.38 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 115.552 -0.749 . . . . 0.27000000000000002 110.256 -178.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 62.0 tp -90.11 96.57 10.73 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.236 -0.653 . . . . 0.35999999999999999 109.236 175.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.444 ' OE1' ' HB2' ' A' ' 31' ' ' ARG . 43.6 mt-10 -76.68 -31.13 57.06 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.016 0.436 . . . . 0.48999999999999999 110.461 -177.219 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.869 0 CA-C-O 118.244 -1.309 . . . . 1.3899999999999999 111.562 178.246 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 38.3 t . . . . . 0 N--CA 1.446 -0.644 0 N-CA-C 109.61 -0.515 . . . . 0.52000000000000002 109.61 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.431 ' O ' ' HA2' ' A' ' 86' ' ' GLY . 42.8 tp -71.99 90.66 1.17 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.233 0.539 . . . . 0.91000000000000003 110.194 176.417 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.544 HG12 ' HB3' ' A' ' 46' ' ' PRO . 56.7 t -72.85 129.33 35.99 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 CA-C-N 115.27 -0.877 . . . . 0.31 110.77 -177.314 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 54.5 mttp -112.48 -25.15 9.32 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.654 -0.703 . . . . 1.1599999999999999 109.586 177.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 13.1 ptp180 -163.22 157.43 20.36 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.791 -0.64 . . . . 2.1600000000000001 110.811 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.51 ' CE2' ' HG ' ' A' ' 42' ' ' LEU . 22.4 m-85 -111.27 149.03 31.63 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.664 -0.698 . . . . 0.34999999999999998 109.915 177.561 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.406 ' O ' ' HA ' ' A' ' 89' ' ' ARG . 59.6 tp60 -130.27 135.38 48.05 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 109.454 -0.573 . . . . 1.3700000000000001 109.454 176.302 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.47 ' HG ' HD23 ' A' ' 38' ' ' LEU . 3.6 mm? -103.73 143.43 32.8 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.004 0.431 . . . . 0.25 110.058 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 28.5 t -128.83 133.88 48.14 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.95 -0.568 . . . . 0.94999999999999996 109.996 -179.607 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 84.74 -3.77 86.17 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.714 -0.755 . . . . 0.20999999999999999 112.575 178.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 20.6 p-10 -76.06 130.36 38.23 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.964 0.411 . . . . 0.44 110.954 179.305 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.479 ' HA ' ' NE ' ' A' ' 31' ' ' ARG . 4.7 tpm_? -137.15 -33.42 0.75 Allowed 'General case' 0 C--N 1.321 -0.63 0 CA-C-N 116.291 -0.413 . . . . 2.48 110.639 178.419 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -68.14 -36.8 80.27 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.207 -0.452 . . . . 1.9099999999999999 110.396 177.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.44 ' CZ ' ' HG3' ' A' ' 69' ' ' LYS . 86.7 m-85 -129.48 137.41 50.82 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.084 -0.507 . . . . 0.25 109.993 176.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.605 ' OD1' ' HB3' ' A' ' 36' ' ' ARG . 4.1 p30 -74.61 164.26 26.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.122 -0.49 . . . . 0.62 110.839 -179.414 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.675 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 3.8 m-20 -50.46 -55.24 16.79 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 123.393 0.433 . . . . 0.58999999999999997 110.804 -177.553 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.605 ' HB3' ' OD1' ' A' ' 34' ' ' ASP . 6.0 ttp180 -46.25 -48.17 17.95 Favored 'General case' 0 C--N 1.33 -0.278 0 O-C-N 123.814 0.696 . . . . 3.6600000000000001 111.999 178.385 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -59.04 -35.46 73.35 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.964 -0.562 . . . . 2.2999999999999998 110.96 -178.321 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.593 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -87.22 -26.23 23.62 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.21 -0.45 . . . . 0.19 111.085 -179.913 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.675 ' HG ' ' O ' ' A' ' 35' ' ' ASP . 92.9 mt -62.98 -34.39 77.41 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.763 0.316 . . . . 1.77 111.204 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.29 -23.46 65.71 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.027 -0.533 . . . . 0.29999999999999999 111.305 178.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.604 HD13 HG12 ' A' ' 62' ' ' ILE . 5.2 mt -70.0 -26.98 64.33 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.864 0.364 . . . . 0.20000000000000001 110.659 177.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.627 HD21 HD11 ' A' ' 62' ' ' ILE . 0.4 OUTLIER -109.08 12.9 24.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.237 -0.438 . . . . 0.22 110.39 -178.026 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -51.39 -26.55 8.04 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.768 0.655 . . . . 0.55000000000000004 112.768 -174.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -104.84 11.82 33.3 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.137 0.421 . . . . 0.59999999999999998 112.137 -173.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 81.5 mt -99.56 -54.54 0.17 Allowed Pre-proline 0 C--N 1.324 -0.501 0 N-CA-C 113.723 1.008 . . . . 0.82999999999999996 113.723 -176.039 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.544 ' HB3' HG12 ' A' ' 22' ' ' VAL . 72.5 Cg_endo -73.37 165.75 31.71 Favored 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 121.324 1.349 . . . . 0.33000000000000002 112.845 -168.441 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 97.74 -12.42 64.38 Favored Glycine 0 N--CA 1.446 -0.682 0 N-CA-C 110.371 -1.092 . . . . 0.31 110.371 -171.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 53.3 mt-30 -117.11 175.06 5.77 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.66 -0.77 . . . . 1.46 109.559 176.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -99.5 101.18 12.34 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 121.283 0.563 . . . . 1.1200000000000001 109.816 174.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.51 131.97 35.28 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.189 -0.914 . . . . 0.38 110.097 -176.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.643 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 33.4 p30 -80.84 170.52 16.18 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 121.124 -0.23 . . . . 1.3899999999999999 110.452 178.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.508 ' HA ' HD12 ' A' ' 55' ' ' LEU . 4.4 mm? -50.73 -43.38 58.06 Favored 'General case' 0 N--CA 1.465 0.298 0 O-C-N 123.141 0.275 . . . . 0.92000000000000004 111.235 -177.535 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.49 ' HA ' ' NE2' ' A' ' 56' ' ' HIS . 14.9 m -54.39 -55.71 25.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.021 -0.536 . . . . 0.68999999999999995 110.619 178.375 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -62.62 -34.24 76.64 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.831 -0.622 . . . . 1.74 111.223 -179.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.643 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 89.8 mt -59.65 -57.0 14.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 1.1499999999999999 111.167 179.566 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.49 ' NE2' ' HA ' ' A' ' 53' ' ' SER . 34.5 p80 -74.0 -23.86 59.5 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.314 -0.554 . . . . 2.8300000000000001 110.867 -178.407 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.1 -30.95 72.0 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.98 0.419 . . . . 0.31 110.491 174.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.61 -38.94 86.35 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.885 -0.598 . . . . 0.20999999999999999 110.335 174.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.56 -32.93 74.03 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.622 -0.717 . . . . 0.14000000000000001 110.841 179.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.91 -32.16 73.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.965 -0.562 . . . . 0.17000000000000001 110.897 178.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 74.8 mtt180 -62.68 -39.51 94.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.915 -0.584 . . . . 0.35999999999999999 110.175 176.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.627 HD11 HD21 ' A' ' 42' ' ' LEU . 68.7 mt -79.8 -37.29 18.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.453 -0.794 . . . . 0.16 110.99 -175.338 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.571 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -59.66 -47.88 88.75 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.615 -0.803 . . . . 0.22 111.556 177.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.422 ' O ' ' HG3' ' A' ' 68' ' ' GLU . 28.5 t70 -68.86 -31.62 70.69 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.731 0.301 . . . . 2.1699999999999999 110.57 178.556 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.458 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 90.7 t80 -57.54 -51.37 69.75 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.092 -0.504 . . . . 0.20999999999999999 110.267 176.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . 0.429 ' HB3' ' HB2' ' A' ' 71' ' ' TYR . 4.3 m-85 -57.65 -42.54 83.65 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.537 -0.756 . . . . 0.20999999999999999 110.749 177.162 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . 0.571 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 91.0 mt-30 -62.07 -35.32 78.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 1.21 111.347 -178.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.422 ' HG3' ' O ' ' A' ' 64' ' ' ASP . 43.6 mt-10 -71.19 -23.31 62.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.873 0.368 . . . . 1.6799999999999999 110.837 179.309 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.458 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 74.5 mmtt -91.41 1.88 56.8 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.061 -0.518 . . . . 0.56999999999999995 110.676 -179.583 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.25 -14.17 28.26 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.734 -0.745 . . . . 0.31 112.86 176.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . 0.429 ' HB2' ' HB3' ' A' ' 66' ' ' TYR . 55.0 m-85 -87.06 67.66 9.8 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.243 0.544 . . . . 0.39000000000000001 109.852 -178.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 22.0 t -68.93 -23.43 27.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.735 -0.666 . . . . 0.40999999999999998 110.889 -175.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 97.8 mt -86.09 -8.54 57.82 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.04 -0.527 . . . . 1.76 111.111 179.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -82.98 140.45 32.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.17 -0.468 . . . . 0.37 110.574 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 5.0 tpp180 -144.54 131.71 20.59 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.166 -0.47 . . . . 1.8 109.884 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -102.51 136.28 42.62 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.97 -0.381 . . . . 0.17999999999999999 109.97 177.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 52.8 p90 -137.75 151.54 48.27 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.869 -0.419 . . . . 0.38 109.869 179.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.433 ' HA ' ' HD2' ' A' ' 79' ' ' PRO . 7.1 tt -105.89 113.04 64.2 Favored Pre-proline 0 C--N 1.32 -0.681 0 N-CA-C 109.908 -0.404 . . . . 0.39000000000000001 109.908 -178.509 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 0.455 ' HD2' ' O ' ' A' ' 89' ' ' ARG . 35.3 Cg_endo . . . . . 0 C--O 1.234 0.317 0 C-N-CA 122.748 2.299 . . . . 1.1200000000000001 111.459 176.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . 0.431 ' HA2' ' O ' ' A' ' 21' ' ' LEU . . . . . . . . 0 N--CA 1.444 -0.831 0 N-CA-C 111.572 -0.611 . . . . 0.57999999999999996 111.572 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 24.3 m -96.33 120.87 37.42 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-O 120.84 0.352 . . . . 0.46999999999999997 110.676 177.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 35.0 m -111.4 134.94 52.16 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 N-CA-C 109.201 -0.666 . . . . 0.31 109.201 175.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.455 ' O ' ' HD2' ' A' ' 79' ' ' PRO . 15.6 ttp180 -113.11 131.0 56.0 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 120.177 -0.609 . . . . 2.9199999999999999 110.666 -177.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 72.4 mt -112.63 131.05 65.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 115.354 -0.839 . . . . 0.23000000000000001 109.696 179.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -94.07 126.33 39.23 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.43 0.633 . . . . 1.3300000000000001 109.986 179.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 66.0 t -100.76 101.45 12.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 CA-C-N 115.161 -0.927 . . . . 0.27000000000000002 110.562 -176.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 63.1 tp -83.93 92.39 7.8 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.898 -0.779 . . . . 0.35999999999999999 108.898 175.019 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 57.8 mt-10 -69.47 -17.33 63.61 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.217 -0.447 . . . . 0.48999999999999999 111.017 -175.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.787 -1.007 . . . . 1.3899999999999999 112.643 174.656 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 23.8 t . . . . . 0 N--CA 1.451 -0.393 0 N-CA-C 110.24 -0.281 . . . . 0.52000000000000002 110.24 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 56.8 tp -71.44 106.07 3.8 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.385 0.612 . . . . 0.91000000000000003 109.609 174.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.518 HG12 ' HB3' ' A' ' 46' ' ' PRO . 56.4 t -91.64 118.72 37.62 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 CA-C-N 115.435 -0.802 . . . . 0.31 109.973 179.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -98.08 -26.03 14.74 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 109.111 -0.7 . . . . 1.1599999999999999 109.111 174.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 13.9 ptp180 -162.75 162.87 26.92 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.369 -0.832 . . . . 2.1600000000000001 110.712 -178.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.476 ' CE2' ' HG ' ' A' ' 42' ' ' LEU . 29.6 m-85 -111.12 154.87 23.68 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.694 -0.685 . . . . 0.34999999999999998 109.967 177.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.489 ' O ' ' HA ' ' A' ' 89' ' ' ARG . 8.1 tp-100 -137.3 140.1 41.33 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 109.065 -0.717 . . . . 1.3700000000000001 109.065 177.497 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.514 ' HG ' HD23 ' A' ' 38' ' ' LEU . 3.8 mm? -108.36 152.16 25.02 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 120.935 0.397 . . . . 0.25 110.403 -179.215 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 23.1 t -132.9 125.83 30.77 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.127 -0.488 . . . . 0.94999999999999996 110.254 177.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 90.86 -2.09 79.2 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.8 -0.714 . . . . 0.20999999999999999 113.009 175.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 14.7 p-10 -74.04 123.05 23.64 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.183 0.516 . . . . 0.44 111.072 179.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 29.8 mmm180 -121.43 -33.57 3.62 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.828 -0.624 . . . . 2.48 110.514 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -70.92 -42.25 70.13 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.007 -0.542 . . . . 1.9099999999999999 110.551 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 86.2 m-85 -128.68 137.08 51.43 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.033 -0.53 . . . . 0.25 109.749 179.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.649 ' OD2' ' HB3' ' A' ' 36' ' ' ARG . 4.6 p-10 -79.72 167.5 20.56 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.234 -0.439 . . . . 0.62 111.028 -177.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.461 ' O ' HD13 ' A' ' 39' ' ' LEU . 2.8 m-20 -54.22 -52.8 60.15 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 123.084 0.24 . . . . 0.58999999999999997 110.959 -176.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.649 ' HB3' ' OD2' ' A' ' 34' ' ' ASP . 8.7 ttp180 -45.25 -45.51 11.95 Favored 'General case' 0 C--N 1.327 -0.394 0 O-C-N 123.763 0.664 . . . . 3.6600000000000001 111.536 177.403 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 22.0 tpt85 -65.21 -42.88 93.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.803 -0.635 . . . . 2.2999999999999998 111.476 -178.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.572 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -79.91 -24.9 40.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.723 0.297 . . . . 0.19 111.377 -177.545 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.461 HD13 ' O ' ' A' ' 35' ' ' ASP . 2.2 mp -62.15 -36.37 81.6 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.339 -0.392 . . . . 1.77 111.328 178.506 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.59 -26.26 66.83 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.062 -0.517 . . . . 0.29999999999999999 111.051 178.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.592 HD13 HG12 ' A' ' 62' ' ' ILE . 5.9 mt -64.88 -30.51 71.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.008 0.432 . . . . 0.20000000000000001 110.98 176.165 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.61 HD21 HD11 ' A' ' 62' ' ' ILE . 0.4 OUTLIER -105.36 12.86 31.16 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.139 -0.482 . . . . 0.22 110.271 -177.713 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 7.1 p80 -47.3 -29.83 2.73 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.5 0.926 . . . . 0.55000000000000004 113.5 -173.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -104.2 11.25 35.22 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.246 0.461 . . . . 0.59999999999999998 112.246 -174.23 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 80.0 mt -97.08 -53.03 0.21 Allowed Pre-proline 0 C--N 1.323 -0.573 0 N-CA-C 113.591 0.96 . . . . 0.82999999999999996 113.591 -176.353 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.518 ' HB3' HG12 ' A' ' 22' ' ' VAL . 77.6 Cg_endo -75.9 175.59 11.12 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 121.428 1.418 . . . . 0.33000000000000002 113.023 -168.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 89.18 -6.78 83.26 Favored Glycine 0 N--CA 1.445 -0.712 0 N-CA-C 110.629 -0.989 . . . . 0.31 110.629 -172.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -124.75 175.48 7.21 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.979 -0.611 . . . . 1.46 109.72 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -100.59 96.36 7.31 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.402 0.62 . . . . 1.1200000000000001 109.83 176.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.445 HD23 ' CG2' ' A' ' 22' ' ' VAL . 2.7 mm? -84.42 134.55 34.46 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.016 -0.993 . . . . 0.38 110.231 -174.5 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.591 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 8.5 p30 -85.03 171.37 12.13 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.727 -0.472 . . . . 1.3899999999999999 109.727 177.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.524 ' HA ' HD12 ' A' ' 55' ' ' LEU . 4.0 mm? -48.8 -45.17 39.87 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.512 0.56 . . . . 0.92000000000000004 112.512 -175.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.567 ' HA ' ' NE2' ' A' ' 56' ' ' HIS . 69.1 m -57.46 -46.0 84.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.622 0.249 . . . . 0.68999999999999995 110.929 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.405 ' NE2' HD12 ' A' ' 50' ' ' LEU . 55.2 mt-30 -66.42 -32.64 74.14 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.982 0.42 . . . . 1.74 110.522 179.546 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.591 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 79.7 mt -62.67 -55.58 25.57 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.766 -0.652 . . . . 1.1499999999999999 111.279 -178.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.567 ' NE2' ' HA ' ' A' ' 53' ' ' SER . 34.0 p80 -74.76 -23.42 58.53 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.324 -0.55 . . . . 2.8300000000000001 111.184 -178.094 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.14 -31.97 70.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.184 0.516 . . . . 0.31 110.192 173.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.33 -45.57 92.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.624 -0.716 . . . . 0.20999999999999999 110.477 175.265 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.48 -34.99 78.98 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.662 -0.699 . . . . 0.14000000000000001 110.82 179.041 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.3 -42.51 99.42 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.872 -0.604 . . . . 0.17000000000000001 110.93 178.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 77.2 mtt180 -54.19 -40.9 67.98 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 121.183 0.516 . . . . 0.35999999999999999 110.642 177.153 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.61 HD11 HD21 ' A' ' 42' ' ' LEU . 67.4 mt -78.45 -37.5 21.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.53 -0.759 . . . . 0.16 110.579 -176.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.458 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -60.32 -42.11 98.68 Favored Glycine 0 N--CA 1.442 -0.913 0 CA-C-N 115.651 -0.704 . . . . 0.22 111.89 177.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -75.98 -26.48 56.82 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.54 0.209 . . . . 2.1699999999999999 110.551 177.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -59.97 -50.33 74.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.936 0.398 . . . . 0.20999999999999999 110.277 178.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . 0.444 ' HB3' ' HB2' ' A' ' 71' ' ' TYR . 10.3 m-85 -58.58 -44.97 89.98 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.729 -0.669 . . . . 0.20999999999999999 110.453 176.193 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . 0.458 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 79.7 mt-30 -59.97 -38.06 81.44 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.966 -0.561 . . . . 1.21 111.218 -179.758 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -69.42 -26.59 64.69 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.152 -0.477 . . . . 1.6799999999999999 110.632 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -88.97 4.78 46.98 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.004 -0.544 . . . . 0.56999999999999995 110.932 178.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 106.32 -14.96 43.22 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.819 -0.705 . . . . 0.31 112.881 176.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . 0.444 ' HB2' ' HB3' ' A' ' 66' ' ' TYR . 80.5 m-85 -82.3 71.56 9.36 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.191 0.52 . . . . 0.39000000000000001 110.186 -178.448 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 40.5 t -67.77 -28.69 42.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.629 -0.714 . . . . 0.40999999999999998 110.992 -176.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 43.4 tp -78.84 -8.93 59.26 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.038 -0.528 . . . . 1.76 110.908 -179.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -93.15 141.07 28.82 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.076 0.465 . . . . 0.37 111.241 -177.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 30.3 tpt180 -151.28 131.5 13.6 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.959 -0.564 . . . . 1.8 109.603 177.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.22 138.16 35.9 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.378 -0.374 . . . . 0.17999999999999999 110.203 178.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 49.0 p90 -135.78 142.59 44.95 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.415 -0.357 . . . . 0.38 110.053 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.8 tt -95.79 115.42 65.51 Favored Pre-proline 0 C--N 1.318 -0.784 0 N-CA-C 109.211 -0.663 . . . . 0.39000000000000001 109.211 179.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 0.403 ' HD2' ' O ' ' A' ' 89' ' ' ARG . 55.7 Cg_endo . . . . . 0 N--CA 1.462 -0.374 0 C-N-CA 122.39 2.06 . . . . 1.1200000000000001 111.796 178.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.688 0 N-CA-C 112.077 -0.409 . . . . 0.57999999999999996 112.077 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 25.8 m -127.04 121.67 32.23 Favored 'General case' 0 C--N 1.322 -0.595 0 O-C-N 122.692 -0.299 . . . . 0.46999999999999997 110.717 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 31.7 m -102.84 131.66 50.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 N-CA-C 109.716 -0.476 . . . . 0.31 109.716 175.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.489 ' HA ' ' O ' ' A' ' 26' ' ' GLN . 51.8 ttt180 -110.52 130.87 55.46 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.268 0.556 . . . . 2.9199999999999999 110.901 -177.316 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.421 ' HB ' HD13 ' A' ' 27' ' ' LEU . 67.2 mt -110.86 134.34 53.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.046 -0.979 . . . . 0.23000000000000001 109.868 -179.249 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -94.14 123.75 37.72 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.342 0.591 . . . . 1.3300000000000001 110.13 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 57.9 t -98.63 110.6 26.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 115.367 -0.833 . . . . 0.27000000000000002 110.501 -176.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 56.2 tp -94.35 95.13 8.69 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.356 -0.609 . . . . 0.35999999999999999 109.356 176.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 55.7 mt-10 -78.56 -9.9 59.52 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.895 -0.593 . . . . 0.48999999999999999 110.816 -176.526 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.934 -0.926 . . . . 1.3899999999999999 111.723 178.189 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 60.3 t . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.768 0.318 . . . . 0.52000000000000002 110.555 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.453 ' HA ' ' HA ' ' A' ' 49' ' ' GLU . 51.8 tp -69.46 101.37 1.56 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.047 0.451 . . . . 0.91000000000000003 110.478 177.427 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.554 HG12 ' HB3' ' A' ' 46' ' ' PRO . 60.8 t -80.68 126.54 39.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.704 -0.68 . . . . 0.31 110.172 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -108.52 -35.49 6.46 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.98 -0.555 . . . . 1.1599999999999999 110.289 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 12.6 ptp180 -155.11 160.96 41.36 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.231 -0.44 . . . . 2.1600000000000001 111.016 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.561 ' CE2' ' HG ' ' A' ' 42' ' ' LEU . 40.7 m-85 -114.78 141.02 48.42 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.735 -0.666 . . . . 0.34999999999999998 110.228 178.569 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 29.9 tp60 -129.08 127.56 41.76 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.355 -0.609 . . . . 1.3700000000000001 109.355 179.215 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.435 HD13 ' HB ' ' A' ' 90' ' ' ILE . 3.5 mm? -101.93 136.53 41.61 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.113 0.483 . . . . 0.25 109.8 -178.578 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.493 ' O ' ' HA ' ' A' ' 91' ' ' GLU . 74.1 m -132.16 131.25 42.07 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.757 -0.656 . . . . 0.94999999999999996 110.414 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 99.18 -11.71 61.96 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.764 -0.732 . . . . 0.20999999999999999 111.803 -177.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 17.3 p-10 -77.88 131.97 37.75 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.975 0.417 . . . . 0.44 110.58 179.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 28.5 mmm180 -126.23 -38.37 2.15 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.133 -0.485 . . . . 2.48 110.252 179.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 49.3 tp60 -68.5 -44.61 74.32 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.046 -0.524 . . . . 1.9099999999999999 110.67 -177.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.435 ' HD2' ' CZ ' ' A' ' 66' ' ' TYR . 83.1 m-85 -122.98 136.19 54.76 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.016 -0.538 . . . . 0.25 109.69 179.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -82.48 175.72 9.98 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.027 -0.533 . . . . 0.62 111.046 -175.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.434 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 72.5 m-20 -54.73 -48.8 72.08 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 116.222 -0.444 . . . . 0.58999999999999997 111.296 -177.489 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -62.34 -25.69 68.03 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.193 -0.458 . . . . 3.6600000000000001 111.319 -174.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.2 tpt180 -79.89 -36.35 36.65 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.874 -0.603 . . . . 2.2999999999999998 110.718 179.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.483 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -87.45 -34.35 18.74 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.053 0.39 . . . . 0.19 112.053 -176.456 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 35' ' ' ASP . 4.1 pp -67.0 -18.15 65.25 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 120.917 -0.313 . . . . 1.77 110.896 -179.065 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.49 -23.44 66.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.061 0.458 . . . . 0.29999999999999999 110.37 176.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.609 HD13 HG12 ' A' ' 62' ' ' ILE . 2.4 mt -70.46 -23.09 62.64 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.871 -0.604 . . . . 0.20000000000000001 110.45 175.636 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.614 HD21 HD11 ' A' ' 62' ' ' ILE . 0.7 OUTLIER -110.21 13.79 22.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.859 -0.61 . . . . 0.22 110.116 -179.444 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.9 p80 -56.19 -25.34 46.53 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.451 0.537 . . . . 0.55000000000000004 112.451 -172.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -103.57 9.57 37.4 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.659 0.266 . . . . 0.59999999999999998 111.152 -176.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.447 HD12 ' HA ' ' A' ' 45' ' ' LEU . 10.5 tp -97.52 -55.75 0.19 Allowed Pre-proline 0 C--N 1.32 -0.689 0 N-CA-C 113.792 1.034 . . . . 0.82999999999999996 113.792 -169.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.554 ' HB3' HG12 ' A' ' 22' ' ' VAL . 82.7 Cg_endo -76.03 172.83 15.54 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 121.567 1.512 . . . . 0.33000000000000002 112.825 -170.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.26 -0.67 64.01 Favored Glycine 0 N--CA 1.445 -0.728 0 N-CA-C 110.435 -1.066 . . . . 0.31 110.435 -172.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -131.33 174.62 9.88 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.954 -0.623 . . . . 1.46 109.621 178.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.453 ' HA ' ' HA ' ' A' ' 21' ' ' LEU . 37.4 mt-10 -95.58 95.56 8.46 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.385 0.612 . . . . 1.1200000000000001 110.178 175.572 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -85.39 136.12 33.59 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.256 -0.884 . . . . 0.38 109.408 178.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.8 t-20 -80.39 156.47 26.67 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.452 -0.573 . . . . 1.3899999999999999 109.452 178.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -49.76 -43.1 47.89 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 117.945 0.338 . . . . 0.92000000000000004 111.738 -175.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 11.2 m -52.25 -45.03 65.21 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.092 0.472 . . . . 0.68999999999999995 110.659 175.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -68.3 -39.2 82.11 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.629 -0.714 . . . . 1.74 111.152 179.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.65 ' HB3' HD13 ' A' ' 78' ' ' LEU . 10.9 mp -56.85 -46.99 81.4 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 120.719 0.295 . . . . 1.1499999999999999 111.265 173.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 80.8 m-70 -65.95 -34.82 79.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.883 0.373 . . . . 2.8300000000000001 110.451 178.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.7 -27.84 67.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.178 -0.464 . . . . 0.31 110.962 178.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.0 -38.49 91.28 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.193 0.521 . . . . 0.20999999999999999 110.233 175.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.18 -30.85 71.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.596 -0.729 . . . . 0.14000000000000001 110.546 177.427 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -66.16 -36.72 83.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.965 -0.562 . . . . 0.17000000000000001 110.895 179.056 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 80.7 mtt180 -55.35 -42.06 73.36 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.299 0.571 . . . . 0.35999999999999999 110.001 175.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.614 HD11 HD21 ' A' ' 42' ' ' LEU . 66.0 mt -77.91 -35.17 20.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.111 -0.949 . . . . 0.16 111.151 -175.626 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.626 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -58.89 -49.59 76.49 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.376 -0.916 . . . . 0.22 111.624 176.471 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -66.45 -28.32 68.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.541 0.21 . . . . 2.1699999999999999 110.957 178.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.543 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 87.7 t80 -58.99 -50.38 74.29 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.019 0.437 . . . . 0.20999999999999999 110.183 177.022 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . 0.435 ' CZ ' ' HD2' ' A' ' 33' ' ' PHE . 8.6 m-85 -61.66 -44.46 96.93 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.651 -0.704 . . . . 0.20999999999999999 110.964 177.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . 0.626 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 42.0 mt-30 -61.16 -35.49 77.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.11 -0.496 . . . . 1.21 111.033 -178.621 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -64.49 -35.66 81.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.219 0.533 . . . . 1.6799999999999999 110.589 176.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.543 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 69.6 mmtt -79.16 -4.12 48.91 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.982 -0.554 . . . . 0.56999999999999995 110.829 -177.284 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.67 -6.99 27.94 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.953 -0.642 . . . . 0.31 112.302 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . 0.419 ' HB2' ' HB3' ' A' ' 66' ' ' TYR . 43.3 m-85 -92.37 65.78 4.59 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.324 -0.621 . . . . 0.39000000000000001 109.324 179.515 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 43.8 t -66.0 -28.1 42.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.699 -0.682 . . . . 0.40999999999999998 110.836 -175.52 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 55.6 tp -73.66 -25.32 60.21 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.832 -0.622 . . . . 1.76 110.349 178.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -79.68 131.64 36.01 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.824 -0.626 . . . . 0.37 111.438 -175.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 20.5 mmm180 -140.37 155.13 46.88 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.645 -0.707 . . . . 1.8 109.918 176.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -113.51 135.05 54.32 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.954 -0.566 . . . . 0.17999999999999999 109.754 178.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 47.4 p90 -130.33 149.71 51.89 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.511 -0.551 . . . . 0.38 109.511 179.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.65 HD13 ' HB3' ' A' ' 55' ' ' LEU . 7.5 tt -106.24 108.43 61.73 Favored Pre-proline 0 C--N 1.316 -0.88 0 N-CA-C 110.018 -0.364 . . . . 0.39000000000000001 110.018 -178.008 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' A' ' 78' ' ' LEU . 18.0 Cg_endo . . . . . 0 C--O 1.233 0.271 0 C-N-CA 122.891 2.394 . . . . 1.1200000000000001 112.163 176.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.832 0 N-CA-C 111.436 -0.666 . . . . 0.57999999999999996 111.436 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 25.0 m -102.31 122.29 43.96 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 120.814 0.34 . . . . 0.46999999999999997 110.211 178.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 33.2 m -108.21 128.07 63.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 109.918 -0.401 . . . . 0.31 109.918 176.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 14.3 ttt180 -103.94 114.29 28.44 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 120.494 -0.482 . . . . 2.9199999999999999 110.43 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.435 ' HB ' HD13 ' A' ' 27' ' ' LEU . 49.1 mt -103.56 131.43 52.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 115.888 -0.596 . . . . 0.23000000000000001 109.772 178.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.493 ' HA ' ' O ' ' A' ' 28' ' ' SER . 38.6 mt-10 -96.75 125.95 41.57 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.36 0.6 . . . . 1.3300000000000001 110.591 -179.028 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 57.8 t -98.76 111.43 28.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.435 -0.802 . . . . 0.27000000000000002 110.215 -178.246 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 30.9 tp -94.63 89.02 5.61 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.076 -0.713 . . . . 0.35999999999999999 109.076 178.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 57.6 mt-10 -67.22 -15.67 63.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.508 -0.769 . . . . 0.48999999999999999 111.725 -174.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.964 0 CA-C-O 118.929 -0.928 . . . . 1.3899999999999999 111.764 178.904 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 21.8 t . . . . . 0 N--CA 1.447 -0.584 0 N-CA-C 109.846 -0.428 . . . . 0.52000000000000002 109.846 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -71.72 126.76 30.55 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.028 -0.73 . . . . 0.91000000000000003 109.028 175.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.487 HG12 ' HB3' ' A' ' 46' ' ' PRO . 63.9 t -108.36 116.89 52.69 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 CA-C-N 115.909 -0.587 . . . . 0.31 110.498 -176.138 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -97.85 -26.17 14.78 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.335 -0.848 . . . . 1.1599999999999999 109.382 178.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 4.3 ptp180 -168.05 161.9 12.89 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.839 -0.619 . . . . 2.1600000000000001 110.685 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.577 ' CE2' ' HG ' ' A' ' 42' ' ' LEU . 26.7 m-85 -110.91 137.14 48.92 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.696 -0.684 . . . . 0.34999999999999998 109.731 178.033 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.409 ' O ' ' HA ' ' A' ' 89' ' ' ARG . 7.2 tp-100 -114.72 129.18 56.65 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 109.544 -0.539 . . . . 1.3700000000000001 109.544 177.282 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.441 ' HG ' HD23 ' A' ' 38' ' ' LEU . 3.9 mm? -103.7 127.29 51.18 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.007 0.432 . . . . 0.25 110.098 -178.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.0 t -115.08 119.47 36.56 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.938 -0.574 . . . . 0.94999999999999996 110.164 -178.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 99.27 0.63 56.97 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.756 -0.735 . . . . 0.20999999999999999 112.758 178.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 20.0 p-10 -81.23 124.29 29.17 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.361 0.6 . . . . 0.44 111.259 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' ' 31' ' ' ARG . 15.3 mmm180 -128.22 -34.03 2.12 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.782 -0.645 . . . . 2.48 110.575 177.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -69.35 -32.68 71.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.108 -0.497 . . . . 1.9099999999999999 110.543 179.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 -136.94 141.68 42.66 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.406 -0.59 . . . . 0.25 109.406 175.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -81.06 169.7 17.13 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.433 -0.349 . . . . 0.62 110.721 -178.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.507 ' O ' HD13 ' A' ' 39' ' ' LEU . 1.0 OUTLIER -55.4 -54.99 36.79 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-N 116.455 -0.339 . . . . 0.58999999999999997 111.344 -176.048 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.512 ' HA ' HD22 ' A' ' 39' ' ' LEU . 62.8 ttt180 -58.69 -32.79 69.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.764 0.316 . . . . 3.6600000000000001 110.853 -175.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 20.2 tpt180 -64.59 -42.94 95.26 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.212 -0.449 . . . . 2.2999999999999998 110.575 176.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.505 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -78.79 -26.14 44.36 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.91 0.386 . . . . 0.19 110.916 179.651 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.512 HD22 ' HA ' ' A' ' 36' ' ' ARG . 1.4 mp -60.3 -31.47 70.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.145 -0.48 . . . . 1.77 111.116 177.668 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.73 -24.06 65.41 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.903 -0.59 . . . . 0.29999999999999999 111.403 176.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.512 HD13 HG12 ' A' ' 62' ' ' ILE . 3.8 mt -74.69 -24.49 58.78 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.123 0.487 . . . . 0.20000000000000001 110.513 176.366 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.671 HD21 HD11 ' A' ' 62' ' ' ILE . 0.4 OUTLIER -107.67 14.27 25.79 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.989 -0.551 . . . . 0.22 110.12 -179.041 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 8.1 p80 -53.9 -19.94 5.29 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 113.161 0.8 . . . . 0.55000000000000004 113.161 -171.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -110.65 11.0 22.85 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.082 0.401 . . . . 0.59999999999999998 112.082 -175.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 84.8 mt -100.31 -54.72 0.16 Allowed Pre-proline 0 CA--C 1.539 0.519 0 N-CA-C 113.823 1.046 . . . . 0.82999999999999996 113.823 -174.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.487 ' HB3' HG12 ' A' ' 22' ' ' VAL . 41.3 Cg_endo -69.92 165.82 29.88 Favored 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 121.345 1.363 . . . . 0.33000000000000002 112.788 -170.384 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.26 -24.26 29.75 Favored Glycine 0 N--CA 1.447 -0.567 0 N-CA-C 110.711 -0.955 . . . . 0.31 110.711 -171.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -109.08 169.79 8.46 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.284 -0.458 . . . . 1.46 110.165 175.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -97.93 110.74 23.25 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.705 -0.68 . . . . 1.1200000000000001 109.894 177.189 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.411 HD23 ' CG2' ' A' ' 22' ' ' VAL . 2.9 mm? -96.85 140.74 30.96 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.293 -0.867 . . . . 0.38 110.402 -174.13 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.67 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 36.1 p30 -85.44 171.34 11.88 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.938 -0.394 . . . . 1.3899999999999999 109.938 177.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.475 ' HA ' HD12 ' A' ' 55' ' ' LEU . 3.8 mm? -50.69 -45.01 58.08 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.515 0.197 . . . . 0.92000000000000004 111.521 -178.506 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.463 ' HA ' ' NE2' ' A' ' 56' ' ' HIS . 22.5 m -55.42 -51.1 67.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.327 -0.397 . . . . 0.68999999999999995 111.069 179.3 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -67.28 -30.83 70.8 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.111 -0.495 . . . . 1.74 111.185 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.67 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 84.3 mt -60.78 -55.03 38.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.404 -0.362 . . . . 1.1499999999999999 111.027 178.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.463 ' NE2' ' HA ' ' A' ' 53' ' ' SER . 34.8 p80 -75.88 -22.91 55.66 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.493 -0.483 . . . . 2.8300000000000001 111.183 -178.125 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.32 -33.31 72.21 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.132 0.492 . . . . 0.31 110.403 174.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.86 -39.7 90.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.676 -0.693 . . . . 0.20999999999999999 110.662 176.345 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.48 -34.99 78.3 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.802 -0.635 . . . . 0.14000000000000001 110.729 179.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.06 -39.19 94.0 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.873 -0.603 . . . . 0.17000000000000001 110.962 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 80.6 mtt180 -55.45 -42.59 74.46 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.266 0.555 . . . . 0.35999999999999999 110.334 176.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ILE . . . . . 0.671 HD11 HD21 ' A' ' 42' ' ' LEU . 72.6 mt -78.34 -37.52 21.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.533 -0.758 . . . . 0.16 110.699 -176.238 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.657 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -59.1 -45.36 95.41 Favored Glycine 0 N--CA 1.442 -0.929 0 C-N-CA 120.67 -0.776 . . . . 0.22 111.645 176.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -68.25 -33.41 74.34 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.818 0.342 . . . . 2.1699999999999999 110.52 178.2 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.458 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 90.4 t80 -57.27 -51.32 69.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.889 -0.596 . . . . 0.20999999999999999 110.628 178.231 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -59.61 -41.42 90.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.97 -0.559 . . . . 0.20999999999999999 111.157 178.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . 0.657 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 21.2 mt-30 -58.73 -44.8 90.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.034 -0.53 . . . . 1.21 111.087 -178.146 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -70.44 -17.27 62.99 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.84 0.352 . . . . 1.6799999999999999 111.339 -179.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.458 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 75.5 mmtt -91.2 4.89 51.1 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.802 0.334 . . . . 0.56999999999999995 110.642 179.704 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 102.61 -11.54 56.47 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.769 -0.729 . . . . 0.31 112.489 176.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -89.72 74.24 7.53 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.426 0.631 . . . . 0.39000000000000001 109.387 -179.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 28.7 t -74.34 -25.77 19.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.434 -0.803 . . . . 0.40999999999999998 111.091 -174.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 60.8 tp -78.19 -16.77 57.56 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.134 0.492 . . . . 1.76 110.029 176.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.512 ' HA ' ' O ' ' A' ' 93' ' ' LEU . . . -82.7 137.3 34.48 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.957 -0.565 . . . . 0.37 111.504 -178.286 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 21.5 tpt180 -152.12 132.6 13.81 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.7 -0.682 . . . . 1.8 109.602 176.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -95.81 135.13 37.94 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 110.288 -0.264 . . . . 0.17999999999999999 110.288 178.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 51.0 p90 -135.36 149.39 49.68 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.86 0.362 . . . . 0.38 110.27 179.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.5 tt -104.21 118.4 56.99 Favored Pre-proline 0 C--N 1.318 -0.791 0 N-CA-C 108.997 -0.742 . . . . 0.39000000000000001 108.997 178.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo . . . . . 0 C--O 1.234 0.292 0 C-N-CA 122.654 2.236 . . . . 1.1200000000000001 112.095 179.087 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.703 0 N-CA-C 111.599 -0.6 . . . . 0.57999999999999996 111.599 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 87.0 m -128.86 119.76 25.03 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.904 0.383 . . . . 0.46999999999999997 110.397 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 32.6 m -95.91 132.97 38.74 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 N-CA-C 109.676 -0.49 . . . . 0.31 109.676 178.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.409 ' HA ' ' O ' ' A' ' 26' ' ' GLN . 34.4 ttp180 -111.34 117.32 32.8 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.287 0.565 . . . . 2.9199999999999999 110.707 -177.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.415 ' HB ' HD13 ' A' ' 27' ' ' LEU . 71.9 mt -100.98 131.47 48.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 115.223 -0.899 . . . . 0.23000000000000001 109.669 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -94.21 117.95 30.86 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.371 0.605 . . . . 1.3300000000000001 110.068 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 55.4 t -92.85 109.57 21.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 115.426 -0.806 . . . . 0.27000000000000002 110.263 -177.349 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.512 ' O ' ' HA ' ' A' ' 74' ' ' ALA . 57.5 tp -89.9 90.72 8.3 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.47 -0.567 . . . . 0.35999999999999999 109.47 176.589 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -77.79 -12.32 59.96 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.203 0.525 . . . . 0.48999999999999999 110.465 -178.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.232 0 CA-C-O 118.279 -1.289 . . . . 1.3899999999999999 111.22 178.277 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.1 ttt . . . . . 0 N--CA 1.478 0.943 0 N-CA-C 109.669 -0.493 . . . . 15.85 109.669 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -60.53 112.98 2.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.091 -0.504 . . . . 12.76 111.604 -176.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 53.6 m80 -120.23 -81.9 0.64 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.763 -0.653 . . . . 13.359999999999999 109.765 175.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 37.7 p-80 -84.02 127.81 34.13 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.225 -0.443 . . . . 10.710000000000001 109.841 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.486 ' HB2' ' OE2' ' A' ' 49' ' ' GLU . 77.1 m80 -90.23 -44.36 9.79 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.655 -0.498 . . . . 9.0399999999999991 109.655 178.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 40.3 t-80 48.48 61.75 2.89 Favored 'General case' 0 N--CA 1.468 0.429 0 O-C-N 123.786 0.679 . . . . 9.7899999999999991 112.215 169.275 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 30.8 m170 -122.47 -3.11 8.88 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.271 0.558 . . . . 7.4100000000000001 109.813 174.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 54.1 t-80 -178.73 -39.5 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.735 -1.121 . . . . 6.4400000000000004 108.181 177.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.429 HG21 ' HA ' ' A' ' 48' ' ' GLN . 15.6 m -129.27 168.08 23.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 114.527 -1.215 . . . . 1.97 109.266 174.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -163.59 -169.71 2.01 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 110.466 -0.198 . . . . 4.2000000000000002 110.466 178.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.513 ' HA ' HG21 ' A' ' 19' ' ' THR . 3.9 p-10 -59.92 133.26 55.93 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.443 0.64 . . . . 4.3300000000000001 112.325 -174.219 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -133.93 165.31 25.3 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.308 -0.86 . . . . 4.3700000000000001 109.54 -178.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 22.9 t70 68.62 -75.94 0.06 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.336 0.654 . . . . 5.3600000000000003 110.343 -175.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -107.58 93.87 4.78 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.565 -0.902 . . . . 3.4199999999999999 108.565 174.169 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 63.9 mtt -78.27 143.18 37.27 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.702 -0.681 . . . . 4.4299999999999997 110.596 -177.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 82.23 12.82 80.16 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.97 -0.633 . . . . 3.4100000000000001 112.279 -177.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -118.26 -173.05 15.87 Favored Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 120.819 -0.705 . . . . 2.0899999999999999 111.836 178.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_exo -71.87 131.74 18.83 Favored 'Trans proline' 0 N--CA 1.459 -0.517 0 C-N-CA 122.515 2.143 . . . . 1.1599999999999999 111.372 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.513 HG21 ' HA ' ' A' ' 11' ' ' ASP . 17.3 p -135.59 154.18 51.43 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.223 -0.444 . . . . 0.72999999999999998 110.902 -179.461 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 39.2 t -123.51 123.68 67.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-N 116.04 -0.527 . . . . 0.52000000000000002 110.021 178.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.411 ' O ' ' HA2' ' A' ' 86' ' ' GLY . 35.9 tp -71.32 102.27 2.56 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.138 -0.689 . . . . 0.91000000000000003 109.138 174.114 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.602 HG12 ' HB3' ' A' ' 46' ' ' PRO . 75.7 t -76.15 115.54 17.87 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 CA-C-N 115.585 -0.734 . . . . 0.31 110.727 -176.707 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -98.88 -32.6 11.25 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.905 -0.589 . . . . 1.1599999999999999 109.848 176.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 7.1 ptm180 -158.68 163.09 37.18 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.083 -0.508 . . . . 2.1600000000000001 110.963 178.426 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.58 ' CE2' ' HG ' ' A' ' 42' ' ' LEU . 42.0 m-85 -111.18 139.12 46.82 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.534 -0.757 . . . . 0.34999999999999998 109.78 176.051 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.643 HE21 ' HA ' ' A' ' 26' ' ' GLN . 0.0 OUTLIER -120.59 128.99 53.56 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 109.559 -0.534 . . . . 1.3700000000000001 109.559 176.178 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.61 ' HG ' HD23 ' A' ' 38' ' ' LEU . 3.8 mm? -102.65 129.52 49.27 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.278 0.561 . . . . 0.25 110.013 -179.007 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 40.8 t -121.04 121.67 38.44 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.535 -0.757 . . . . 0.94999999999999996 110.227 -177.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 101.51 -7.46 56.03 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.835 -0.698 . . . . 0.20999999999999999 112.295 -179.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 20.6 p-10 -77.49 123.34 26.44 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.139 0.495 . . . . 0.44 110.935 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.451 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 30.1 mmm180 -124.33 -26.71 3.89 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.043 -0.526 . . . . 2.48 110.226 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -81.34 -36.02 30.21 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.886 -0.597 . . . . 1.9099999999999999 110.835 -179.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.437 ' HD2' ' CZ ' ' A' ' 66' ' ' TYR . 78.3 m-85 -130.92 135.39 47.62 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.139 -0.482 . . . . 0.25 110.336 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.582 ' OD1' ' HB3' ' A' ' 36' ' ' ARG . 1.7 p30 -77.04 169.45 18.32 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.904 -0.589 . . . . 0.62 111.16 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.505 ' O ' HD13 ' A' ' 39' ' ' LEU . 4.2 m-20 -52.81 -52.58 56.35 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 123.284 0.365 . . . . 0.58999999999999997 110.387 -179.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.582 ' HB3' ' OD1' ' A' ' 34' ' ' ASP . 6.7 ttp180 -45.32 -49.57 12.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.467 -0.788 . . . . 3.6600000000000001 111.975 179.456 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -59.77 -41.96 92.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.175 -0.466 . . . . 2.2999999999999998 111.372 -179.207 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.61 HD23 ' HG ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -82.51 -25.15 33.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.3 -0.409 . . . . 0.19 111.445 -175.799 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.505 HD13 ' O ' ' A' ' 35' ' ' ASP . 2.5 mp -63.11 -34.6 77.94 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.363 -0.38 . . . . 1.77 111.806 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.91 -21.99 66.42 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.478 -0.328 . . . . 0.29999999999999999 111.211 178.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.612 HD13 HG12 ' A' ' 62' ' ' ILE . 6.4 mt -69.87 -25.41 63.7 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.072 0.463 . . . . 0.20000000000000001 110.202 175.033 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.58 ' HG ' ' CE2' ' A' ' 25' ' ' PHE . 0.5 OUTLIER -108.04 14.21 25.39 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.799 -0.637 . . . . 0.22 110.171 -179.29 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 13.0 p80 -47.53 -27.02 1.61 Allowed 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 113.489 0.922 . . . . 0.55000000000000004 113.489 -174.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -104.21 11.29 35.14 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.486 0.55 . . . . 0.59999999999999998 112.486 -173.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 81.6 mt -102.38 -56.95 0.11 Allowed Pre-proline 0 C--N 1.323 -0.577 0 N-CA-C 114.005 1.113 . . . . 0.82999999999999996 114.005 -173.376 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.602 ' HB3' HG12 ' A' ' 22' ' ' VAL . 74.1 Cg_endo -72.26 164.07 36.75 Favored 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 121.36 1.373 . . . . 0.33000000000000002 113.145 -166.229 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 91.96 -0.36 72.7 Favored Glycine 0 N--CA 1.446 -0.684 0 N-CA-C 110.331 -1.108 . . . . 0.31 110.331 -170.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.429 ' HA ' HG21 ' A' ' 9' ' ' VAL . 44.0 mt-30 -129.57 171.33 12.71 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.075 -0.562 . . . . 1.46 109.77 -179.189 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.486 ' OE2' ' HB2' ' A' ' 5' ' ' HIS . 49.5 mt-10 -99.15 92.15 5.33 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.481 0.658 . . . . 1.1200000000000001 110.168 178.446 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -83.18 135.81 34.66 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 114.876 -1.056 . . . . 0.38 109.477 -179.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.584 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 28.2 p-10 -83.78 170.7 13.88 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.586 -0.524 . . . . 1.3899999999999999 109.586 178.15 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.517 HD13 HD12 ' A' ' 55' ' ' LEU . 3.6 mm? -55.33 -42.19 73.46 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.644 0.259 . . . . 0.92000000000000004 111.07 -176.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 11.5 m -59.48 -45.74 90.81 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.335 -0.393 . . . . 0.68999999999999995 111.193 -178.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -66.78 -33.95 76.75 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.891 0.377 . . . . 1.74 110.767 176.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.584 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 82.2 mt -63.36 -42.68 98.91 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.021 -0.536 . . . . 1.1499999999999999 110.854 177.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.51 ' HD2' ' O ' ' A' ' 52' ' ' LEU . 55.3 m-70 -69.76 -35.75 75.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.82 0.343 . . . . 2.8300000000000001 110.416 177.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.4 -33.86 76.83 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.24 -0.436 . . . . 0.31 110.934 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -57.45 -39.13 75.64 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.827 -0.624 . . . . 0.20999999999999999 111.012 177.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -68.44 -30.71 69.65 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.778 -0.646 . . . . 0.14000000000000001 111.322 -178.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.91 -32.03 73.55 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.213 -0.449 . . . . 0.17000000000000001 110.838 -179.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 77.5 mtt180 -58.84 -42.08 88.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.828 -0.623 . . . . 0.35999999999999999 110.172 176.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.612 HG12 HD13 ' A' ' 41' ' ' LEU . 62.3 mt -77.37 -35.86 22.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.363 -0.835 . . . . 0.16 110.761 -175.642 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.518 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -60.97 -36.17 91.79 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.859 -0.686 . . . . 0.22 112.197 178.456 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -80.61 -31.81 36.53 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.883 0.373 . . . . 2.1699999999999999 110.47 177.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.444 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 90.8 t80 -54.45 -50.75 66.94 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.825 -0.625 . . . . 0.20999999999999999 110.627 177.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . 0.46 ' HB3' ' HB2' ' A' ' 71' ' ' TYR . 8.5 m-85 -59.53 -39.64 84.59 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.589 -0.732 . . . . 0.20999999999999999 111.313 178.704 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . 0.518 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 77.3 mt-30 -60.39 -38.29 83.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.252 -0.431 . . . . 1.21 111.267 -177.713 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -73.08 -19.35 61.18 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.031 0.443 . . . . 1.6799999999999999 111.071 -179.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.444 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 73.6 mmtt -88.38 -4.43 58.66 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.147 -0.479 . . . . 0.56999999999999995 110.058 178.079 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.31 -8.27 30.76 Favored Glycine 0 N--CA 1.448 -0.53 0 CA-C-N 115.84 -0.618 . . . . 0.31 112.402 178.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . 0.46 ' HB2' ' HB3' ' A' ' 66' ' ' TYR . 44.3 m-85 -90.53 72.51 6.89 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.235 0.541 . . . . 0.39000000000000001 109.795 -179.452 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 21.2 t -72.53 -24.63 21.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.735 -0.666 . . . . 0.40999999999999998 110.85 -175.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 96.1 mt -80.72 -9.89 59.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.837 -0.619 . . . . 1.76 110.849 178.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.554 ' HA ' ' O ' ' A' ' 93' ' ' LEU . . . -85.94 139.95 30.77 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.065 -0.516 . . . . 0.37 111.437 -176.166 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 13.4 tpt180 -147.32 131.42 17.31 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.765 -0.652 . . . . 1.8 110.044 177.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -102.02 132.88 47.61 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.806 -0.442 . . . . 0.17999999999999999 109.806 175.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 48.1 p90 -139.55 142.84 37.18 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.688 0.28 . . . . 0.38 110.316 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.613 HD23 ' H ' ' A' ' 80' ' ' ALA . 7.0 tt -92.98 106.95 21.26 Favored Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 109.167 -0.679 . . . . 0.39000000000000001 109.167 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -77.28 -8.2 17.33 Favored 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 123.029 2.486 . . . . 1.1200000000000001 113.009 -172.593 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.613 ' H ' HD23 ' A' ' 78' ' ' LEU . . . 66.2 -91.31 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 O-C-N 123.904 0.752 . . . . 2.0 110.719 -177.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 52.74 53.37 12.27 Favored 'General case' 0 C--O 1.235 0.297 0 O-C-N 123.424 0.453 . . . . 3.7200000000000002 110.564 178.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 58.9 82.24 0.15 Allowed 'General case' 0 C--O 1.233 0.205 0 CA-C-O 121.518 0.675 . . . . 3.7599999999999998 110.805 -177.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.416 HG21 HG12 ' A' ' 88' ' ' VAL . 55.6 mt -69.34 145.05 13.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.246 -0.888 . . . . 1.23 111.067 -176.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.434 ' NE2' ' H ' ' A' ' 84' ' ' GLN . 0.8 OUTLIER -67.11 153.87 42.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.014 -0.539 . . . . 1.5600000000000001 109.74 178.937 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -80.07 52.44 1.53 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.484 0.659 . . . . 1.54 110.999 -179.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . 0.411 ' HA2' ' O ' ' A' ' 21' ' ' LEU . . . 162.24 -45.11 0.36 Allowed Glycine 0 N--CA 1.444 -0.777 0 CA-C-N 115.566 -0.743 . . . . 0.57999999999999996 111.638 -179.437 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 17.8 m -95.85 121.65 37.8 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.034 0.445 . . . . 0.46999999999999997 110.424 176.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.416 HG12 HG21 ' A' ' 83' ' ' ILE . 35.0 m -104.0 137.33 33.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 109.283 -0.636 . . . . 0.31 109.283 174.334 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.472 ' O ' ' HG ' ' A' ' 78' ' ' LEU . 27.4 ttm180 -114.38 135.29 54.25 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.447 -0.501 . . . . 2.9199999999999999 111.404 -176.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.441 ' HB ' HD13 ' A' ' 27' ' ' LEU . 59.4 mt -120.26 136.68 56.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.564 -0.744 . . . . 0.23000000000000001 110.239 179.013 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 44.9 mm-40 -92.97 120.49 33.34 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.862 -0.422 . . . . 1.3300000000000001 109.862 179.022 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 40.0 t -102.07 102.05 13.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 116.113 -0.494 . . . . 0.27000000000000002 110.72 -179.023 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.554 ' O ' ' HA ' ' A' ' 74' ' ' ALA . 61.3 tp -86.48 88.66 7.68 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.968 -0.56 . . . . 0.35999999999999999 109.497 175.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.451 ' CD ' ' H ' ' A' ' 31' ' ' ARG . 50.1 mt-10 -74.22 -34.21 63.62 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.207 0.527 . . . . 0.48999999999999999 110.389 -178.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.184 0 CA-C-O 118.322 -1.265 . . . . 1.3899999999999999 111.118 -178.864 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.3 ttp . . . . . 0 N--CA 1.478 0.969 0 CA-C-O 120.592 0.234 . . . . 15.85 110.869 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 52.3 54.55 10.53 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 113.183 0.809 . . . . 12.76 113.183 172.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 7.3 m-70 -94.61 53.66 1.68 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.089 0.471 . . . . 13.359999999999999 110.719 176.034 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 7.2 p80 -166.88 131.24 2.0 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.479 -0.782 . . . . 10.710000000000001 109.314 176.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 74.8 t60 -155.87 78.82 0.99 Allowed 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.648 -0.501 . . . . 9.0399999999999991 109.648 -179.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 15.0 t-80 -88.86 -37.54 15.26 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.981 -0.554 . . . . 9.7899999999999991 110.224 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 30.5 m80 -67.54 136.96 55.34 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.996 -0.547 . . . . 7.4100000000000001 110.337 178.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 64.7 t60 -130.75 -26.56 2.2 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.551 -0.75 . . . . 6.4400000000000004 109.973 -178.009 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.524 HG21 ' HA ' ' A' ' 48' ' ' GLN . 52.1 t -133.64 -61.21 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.004 -0.544 . . . . 1.97 110.187 -178.515 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 35.8 t70 48.21 52.93 12.55 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.854 0.835 . . . . 4.2000000000000002 110.548 -177.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -132.53 46.9 2.57 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.282 -0.872 . . . . 4.3300000000000001 109.107 -179.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -132.77 149.47 52.27 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.328 -0.851 . . . . 4.3700000000000001 109.825 -177.356 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -61.62 99.85 0.13 Allowed 'General case' 0 C--N 1.329 -0.296 0 O-C-N 123.577 0.548 . . . . 5.3600000000000003 110.876 -177.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.45 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 4.6 tmmm? -95.18 72.83 3.35 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.888 -0.596 . . . . 3.4199999999999999 109.477 -176.404 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 53.1 ttm -114.17 -42.28 3.38 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.888 -0.596 . . . . 4.4299999999999997 110.444 178.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -78.99 -12.64 83.92 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.883 -0.675 . . . . 3.4100000000000001 112.602 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.45 ' O ' ' HG2' ' A' ' 14' ' ' LYS . . . 160.17 166.18 18.51 Favored Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 120.87 -0.681 . . . . 2.0899999999999999 111.905 179.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -57.37 150.9 56.2 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 123.433 2.756 . . . . 1.1599999999999999 112.519 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.545 ' HA ' ' HA ' ' A' ' 51' ' ' ASN . 24.2 p -80.73 139.32 36.17 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.207 0.527 . . . . 0.72999999999999998 111.335 -178.263 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 59.1 t -115.63 119.56 62.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.626 -0.716 . . . . 0.52000000000000002 110.034 178.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.438 ' HB2' ' HG2' ' A' ' 49' ' ' GLU . 48.7 tp -65.82 115.99 6.52 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.353 -0.385 . . . . 0.91000000000000003 110.081 175.41 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.545 HG11 ' CE1' ' A' ' 25' ' ' PHE . 51.7 t -100.69 136.52 31.83 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 CA-C-N 115.902 -0.59 . . . . 0.31 109.692 177.368 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -118.64 -24.46 6.72 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 109.797 -0.446 . . . . 1.1599999999999999 109.797 176.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 16.3 ptp180 -162.69 154.3 18.01 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.06 -0.518 . . . . 2.1600000000000001 110.67 175.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.545 ' CE1' HG11 ' A' ' 22' ' ' VAL . 33.2 m-85 -106.32 145.54 31.53 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.909 -0.587 . . . . 0.34999999999999998 110.498 178.093 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.469 ' O ' ' HA ' ' A' ' 89' ' ' ARG . 50.1 tp60 -125.08 129.39 50.14 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 109.371 -0.603 . . . . 1.3700000000000001 109.371 176.401 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.478 HD13 ' HB ' ' A' ' 90' ' ' ILE . 4.1 mm? -103.31 136.93 42.16 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.675 -0.491 . . . . 0.25 109.675 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.5 t -124.76 128.98 49.6 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.384 -0.371 . . . . 0.94999999999999996 110.05 -179.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 96.48 -11.07 67.03 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.632 -0.794 . . . . 0.20999999999999999 112.562 178.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 6.2 p-10 -67.67 144.95 55.25 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.906 0.384 . . . . 0.44 110.61 178.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.458 ' HB3' ' OE1' ' A' ' 94' ' ' GLU . 21.8 tpp180 -143.57 -37.72 0.34 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.795 -0.639 . . . . 2.48 110.161 179.355 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -68.62 -43.67 75.87 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.669 -0.696 . . . . 1.9099999999999999 110.517 179.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -125.08 151.94 45.0 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.991 -0.744 . . . . 0.25 108.991 175.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -96.78 172.45 7.88 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.199 -0.297 . . . . 0.62 110.199 -178.387 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.529 ' O ' HD13 ' A' ' 39' ' ' LEU . 4.9 m-20 -50.7 -51.35 50.43 Favored 'General case' 0 C--O 1.221 -0.404 0 O-C-N 123.31 0.381 . . . . 0.58999999999999997 110.785 -178.649 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 72.9 mtp180 -55.38 -33.67 63.66 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.946 -0.57 . . . . 3.6600000000000001 111.967 -175.038 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 31.5 tpt85 -77.22 -41.91 39.46 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.683 -0.235 . . . . 2.2999999999999998 110.829 -178.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.501 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -76.17 -27.37 56.92 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.983 0.421 . . . . 0.19 110.8 -178.515 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.529 HD13 ' O ' ' A' ' 35' ' ' ASP . 3.8 mp -60.9 -30.4 70.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.868 -0.605 . . . . 1.77 111.053 176.297 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.63 -23.32 65.97 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.727 -0.67 . . . . 0.29999999999999999 111.633 178.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.549 HD13 HG12 ' A' ' 62' ' ' ILE . 2.3 mt -75.05 -26.65 59.56 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.344 0.592 . . . . 0.20000000000000001 110.3 176.574 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.546 HD21 HD11 ' A' ' 62' ' ' ILE . 0.4 OUTLIER -105.49 14.26 28.9 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.648 -0.706 . . . . 0.22 109.886 -179.086 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 8.3 p80 -51.5 -22.86 3.43 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.408 0.892 . . . . 0.55000000000000004 113.408 -171.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -107.83 -0.4 21.62 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.816 0.302 . . . . 0.59999999999999998 111.816 -174.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 64.1 mt -84.45 -54.05 0.49 Allowed Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 113.462 0.912 . . . . 0.82999999999999996 113.462 -173.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.514 ' HB3' HG12 ' A' ' 22' ' ' VAL . 73.8 Cg_endo -74.22 155.45 46.74 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 121.275 1.316 . . . . 0.33000000000000002 112.051 -170.275 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 99.23 -17.14 58.36 Favored Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 109.444 -1.462 . . . . 0.31 109.444 -167.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.524 ' HA ' HG21 ' A' ' 9' ' ' VAL . 16.4 mt-30 -116.4 173.3 6.68 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.267 -0.966 . . . . 1.46 109.532 176.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.438 ' HG2' ' HB2' ' A' ' 21' ' ' LEU . 43.0 mt-10 -107.51 106.93 17.55 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.234 0.54 . . . . 1.1200000000000001 109.972 178.554 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.474 HD12 ' NE2' ' A' ' 54' ' ' GLN . 2.6 mm? -93.56 126.46 38.73 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.911 -1.04 . . . . 0.38 110.318 -173.646 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.545 ' HA ' ' HA ' ' A' ' 19' ' ' THR . 4.0 p30 -77.25 167.79 21.13 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 121.266 -0.174 . . . . 1.3899999999999999 110.597 178.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.446 ' HA ' HD12 ' A' ' 55' ' ' LEU . 4.2 mm? -46.43 -45.06 17.8 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.453 0.538 . . . . 0.92000000000000004 112.453 -176.181 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.409 ' HA ' ' NE2' ' A' ' 56' ' ' HIS . 33.2 m -56.59 -46.77 80.64 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.697 0.284 . . . . 0.68999999999999995 111.032 -178.21 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.474 ' NE2' HD12 ' A' ' 50' ' ' LEU . 9.8 mt-30 -77.47 -23.72 50.34 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.422 -0.354 . . . . 1.74 111.348 -178.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 78.8 mt -61.41 -53.42 56.8 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.658 0.266 . . . . 1.1499999999999999 110.366 176.369 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.409 ' NE2' ' HA ' ' A' ' 53' ' ' SER . 34.6 p80 -77.38 -23.65 50.73 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.392 -0.523 . . . . 2.8300000000000001 111.125 -179.333 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.21 -32.15 73.62 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.139 0.495 . . . . 0.31 110.044 174.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.02 -41.36 92.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.62 -0.718 . . . . 0.20999999999999999 110.253 175.007 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.16 -36.79 82.56 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.529 -0.76 . . . . 0.14000000000000001 110.659 178.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.56 -34.6 78.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.911 -0.586 . . . . 0.17000000000000001 111.09 179.361 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 93.6 mtt180 -57.31 -41.54 80.06 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.419 0.628 . . . . 0.35999999999999999 110.034 175.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.549 HG12 HD13 ' A' ' 41' ' ' LEU . 76.9 mt -75.9 -36.72 33.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.154 -0.93 . . . . 0.16 110.717 -177.031 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.575 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -58.9 -47.98 87.88 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.688 -0.767 . . . . 0.22 111.689 177.038 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -68.35 -30.92 69.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.711 0.291 . . . . 2.1699999999999999 110.552 178.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.437 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 86.9 t80 -57.79 -49.37 76.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.998 -0.546 . . . . 0.20999999999999999 110.376 177.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 -61.58 -46.66 88.95 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.686 -0.688 . . . . 0.20999999999999999 111.169 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . 0.575 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 15.7 mt-30 -56.84 -40.42 76.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.16 0.505 . . . . 1.21 110.536 179.452 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -63.72 -30.07 71.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.264 -0.88 . . . . 1.6799999999999999 110.73 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.437 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 75.8 mmtt -90.04 6.8 40.76 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.902 -0.59 . . . . 0.56999999999999995 110.927 -178.681 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 104.31 -12.18 51.49 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.953 -0.641 . . . . 0.31 112.914 176.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -88.76 70.16 8.72 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.212 0.529 . . . . 0.39000000000000001 109.602 -179.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 26.1 t -71.1 -24.33 24.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.759 -0.655 . . . . 0.40999999999999998 110.579 -176.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 50.3 tp -80.75 -7.16 59.29 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.668 -0.696 . . . . 1.76 110.389 178.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -99.92 134.86 42.21 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.183 0.516 . . . . 0.37 111.466 -176.234 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 16.7 mmm180 -141.86 164.28 30.63 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.553 -0.749 . . . . 1.8 109.509 176.334 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -127.53 137.5 52.64 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.971 -0.381 . . . . 0.17999999999999999 109.971 179.551 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 48.1 p90 -132.39 143.16 49.64 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.9 0.381 . . . . 0.38 110.298 -179.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.433 ' HA ' ' HD2' ' A' ' 79' ' ' PRO . 8.1 tt -96.18 110.83 54.21 Favored Pre-proline 0 C--N 1.32 -0.705 0 N-CA-C 109.164 -0.68 . . . . 0.39000000000000001 109.164 178.046 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.433 ' HD2' ' HA ' ' A' ' 78' ' ' LEU . 11.8 Cg_endo -57.83 111.32 0.81 Allowed 'Trans proline' 0 N--CA 1.463 -0.282 0 C-N-CA 122.677 2.251 . . . . 1.1200000000000001 111.701 177.569 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -87.69 -1.5 58.0 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.877 -0.601 . . . . 2.0 111.547 -175.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -81.64 100.39 9.41 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.796 -0.446 . . . . 3.7200000000000002 109.796 178.058 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 62.31 71.24 0.54 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.344 -0.844 . . . . 3.7599999999999998 110.499 -177.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 21.2 mt -71.81 141.91 16.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.325 -0.852 . . . . 1.23 110.336 177.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 -89.02 159.58 17.52 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.332 -0.395 . . . . 1.5600000000000001 109.973 177.193 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -107.24 149.65 27.51 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.697 -0.482 . . . . 1.54 109.697 179.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 78.18 -66.02 3.23 Favored Glycine 0 N--CA 1.445 -0.709 0 N-CA-C 111.271 -0.732 . . . . 0.57999999999999996 111.271 -175.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 25.8 m -100.65 120.57 40.26 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.288 -0.634 . . . . 0.46999999999999997 109.288 173.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 29.6 m -116.36 131.43 68.94 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.938 0 N-CA-C 109.847 -0.427 . . . . 0.31 109.847 179.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.469 ' HA ' ' O ' ' A' ' 26' ' ' GLN . 25.0 ttp180 -106.26 128.71 54.16 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.351 0.596 . . . . 2.9199999999999999 111.221 -174.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.478 ' HB ' HD13 ' A' ' 27' ' ' LEU . 63.1 mt -113.89 134.83 55.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.042 -0.981 . . . . 0.23000000000000001 109.187 177.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -96.49 128.26 43.26 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.216 0.531 . . . . 1.3300000000000001 110.693 -179.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.424 ' CG2' HD12 ' A' ' 27' ' ' LEU . 47.7 t -102.63 124.55 56.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.445 -0.798 . . . . 0.27000000000000002 110.259 -178.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 56.7 tp -107.85 99.93 9.35 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.525 -0.546 . . . . 0.35999999999999999 109.525 177.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.458 ' OE1' ' HB3' ' A' ' 31' ' ' ARG . 69.4 mt-10 -87.61 33.64 0.7 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.889 -0.596 . . . . 0.48999999999999999 111.045 -175.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.901 0 CA-C-O 118.65 -1.084 . . . . 1.3899999999999999 112.13 179.882 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 88.3 mmm . . . . . 0 N--CA 1.479 1.021 0 CA-C-O 120.794 0.33 . . . . 15.85 110.622 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -80.44 102.18 9.5 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.184 -0.462 . . . . 12.76 110.366 178.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 12.8 p-80 -104.61 41.78 1.28 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.961 -0.563 . . . . 13.359999999999999 110.974 -177.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 36.9 t-80 -65.14 124.43 22.11 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.275 -0.421 . . . . 10.710000000000001 110.295 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 78.0 t60 -59.26 127.68 33.35 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.862 -0.608 . . . . 9.0399999999999991 110.735 -179.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 40.0 m80 -97.41 152.07 19.32 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.544 -0.753 . . . . 9.7899999999999991 109.321 178.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 17.7 t-80 -67.3 -26.52 66.56 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.17 -0.678 . . . . 7.4100000000000001 109.17 174.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . 0.415 ' HB3' ' HB3' ' A' ' 11' ' ' ASP . 32.6 m170 -83.02 86.47 6.99 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.717 -0.846 . . . . 6.4400000000000004 108.717 171.272 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.481 ' HB ' ' HA ' ' A' ' 48' ' ' GLN . 46.5 t -67.92 113.41 3.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.496 -0.32 . . . . 1.97 111.187 -175.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 17.2 t70 55.17 70.07 0.67 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.257 -0.883 . . . . 4.2000000000000002 110.739 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.415 ' HB3' ' HB3' ' A' ' 8' ' ' HIS . 7.4 p-10 -98.17 151.73 20.11 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.584 -0.734 . . . . 4.3300000000000001 111.023 -177.074 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.601 ' H ' HG21 ' A' ' 19' ' ' THR . 10.2 m-20 -113.91 153.67 28.84 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.556 -0.747 . . . . 4.3700000000000001 109.311 176.063 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -55.94 -71.6 0.09 Allowed 'General case' 0 C--N 1.327 -0.396 0 O-C-N 123.265 0.353 . . . . 5.3600000000000003 110.96 -177.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.471 ' HD2' ' O ' ' A' ' 14' ' ' LYS . 1.4 tmmt? -166.22 72.87 0.16 Allowed 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.083 -0.71 . . . . 3.4199999999999999 109.083 177.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 47.4 ttp -98.53 91.33 5.11 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.819 -0.628 . . . . 4.4299999999999997 109.954 -179.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . 0.416 ' HA3' ' OG ' ' A' ' 53' ' ' SER . . . 86.35 -9.47 70.22 Favored Glycine 0 N--CA 1.448 -0.562 0 CA-C-N 115.619 -0.719 . . . . 3.4100000000000001 111.445 -175.448 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 147.78 158.2 7.8 Favored Glycine 0 N--CA 1.443 -0.844 0 N-CA-C 111.372 -0.691 . . . . 2.0899999999999999 111.372 -179.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -59.31 138.43 84.5 Favored 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.998 2.465 . . . . 1.1599999999999999 112.142 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.601 HG21 ' H ' ' A' ' 12' ' ' ASP . 32.5 p -71.84 140.93 49.58 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.944 -0.571 . . . . 0.72999999999999998 111.918 -174.487 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 32.8 t -109.86 127.61 66.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 115.591 -0.731 . . . . 0.52000000000000002 110.189 178.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.499 ' O ' ' HA2' ' A' ' 86' ' ' GLY . 24.7 tp -72.91 92.0 1.59 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.081 -0.711 . . . . 0.91000000000000003 109.081 174.261 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.56 ' HA ' ' O ' ' A' ' 86' ' ' GLY . 98.8 t -70.66 123.8 25.46 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.048 0 CA-C-N 115.295 -0.866 . . . . 0.31 111.149 -174.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.424 ' HG2' ' HA3' ' A' ' 86' ' ' GLY . 10.7 mmtp -80.84 -40.45 24.86 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.544 -0.753 . . . . 1.1599999999999999 109.449 176.1 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.424 ' HG3' HG23 ' A' ' 87' ' ' THR . 4.6 ptp180 -174.59 169.57 3.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 114.493 -1.23 . . . . 2.1600000000000001 109.392 -179.111 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.525 ' CE1' HG11 ' A' ' 22' ' ' VAL . 33.6 m-85 -106.04 125.1 50.58 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.002 -0.544 . . . . 0.34999999999999998 110.525 178.527 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.408 ' O ' ' HA ' ' A' ' 89' ' ' ARG . 11.9 tp60 -104.63 127.51 52.4 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.325 -0.852 . . . . 1.3700000000000001 108.721 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.453 HD13 ' HB ' ' A' ' 90' ' ' ILE . 3.7 mm? -102.97 134.91 45.62 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.148 0.499 . . . . 0.25 110.321 -177.591 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.462 ' HB2' ' HD3' ' A' ' 89' ' ' ARG . 28.4 t -127.76 135.04 49.59 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.763 -0.653 . . . . 0.94999999999999996 109.797 -178.504 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 91.11 -11.36 72.4 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.672 -0.775 . . . . 0.20999999999999999 112.646 179.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 15.5 p-10 -75.17 137.64 41.46 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.75 0.31 . . . . 0.44 110.688 179.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 30.1 tpt180 -128.2 -44.58 1.42 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.406 -0.361 . . . . 2.48 110.942 177.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 21.8 tp60 -64.85 -40.85 95.81 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.972 0.415 . . . . 1.9099999999999999 110.612 -177.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 -125.63 133.37 52.24 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.936 -0.764 . . . . 0.25 108.936 177.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -88.76 178.08 6.56 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.613 -0.435 . . . . 0.62 110.629 -178.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -47.61 -48.83 28.2 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 123.743 0.652 . . . . 0.58999999999999997 111.909 -176.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 79.0 mtm180 -55.17 -38.22 68.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.835 -0.621 . . . . 3.6600000000000001 111.799 -173.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 37.1 tpt85 -77.57 -38.65 47.99 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.346 -0.388 . . . . 2.2999999999999998 110.883 -176.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.59 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -81.67 -32.57 31.74 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 111.982 0.364 . . . . 0.19 111.982 -174.319 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.5 pp -68.19 -18.83 64.69 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.913 -0.315 . . . . 1.77 110.92 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.46 -24.04 63.74 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.248 -0.433 . . . . 0.29999999999999999 110.653 177.16 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.675 HD13 HG12 ' A' ' 62' ' ' ILE . 1.9 mt -67.44 -22.84 65.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.331 0.586 . . . . 0.20000000000000001 110.143 175.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.505 HD21 HD11 ' A' ' 62' ' ' ILE . 0.7 OUTLIER -111.93 13.26 20.83 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.712 -0.676 . . . . 0.22 110.403 -179.041 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 5.4 p80 -51.11 -21.87 2.16 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 113.488 0.921 . . . . 0.55000000000000004 113.488 -172.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -94.88 -8.89 35.9 Favored 'General case' 0 C--N 1.328 -0.359 0 O-C-N 122.261 -0.274 . . . . 0.59999999999999998 111.643 -175.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.401 ' O ' HD21 ' A' ' 50' ' ' LEU . 87.7 mt -87.21 -58.18 0.29 Allowed Pre-proline 0 C--N 1.325 -0.495 0 N-CA-C 113.601 0.963 . . . . 0.82999999999999996 113.601 -171.188 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.525 ' HB3' HG12 ' A' ' 22' ' ' VAL . 61.0 Cg_endo -68.81 156.46 65.36 Favored 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 121.406 1.404 . . . . 0.33000000000000002 112.439 -168.613 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 96.67 -14.89 63.59 Favored Glycine 0 N--CA 1.446 -0.69 0 N-CA-C 109.895 -1.282 . . . . 0.31 109.895 -168.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.481 ' HA ' ' HB ' ' A' ' 9' ' ' VAL . 28.5 mt-30 -120.23 172.95 7.42 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 114.802 -0.699 . . . . 1.46 109.699 176.203 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.558 ' HB3' ' HB ' ' A' ' 19' ' ' THR . 4.4 mt-10 -97.21 108.92 21.75 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.902 -0.59 . . . . 1.1200000000000001 110.307 177.279 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.418 HD22 ' N ' ' A' ' 50' ' ' LEU . 2.6 mm? -99.12 131.78 44.91 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.902 -0.59 . . . . 0.38 109.763 -179.472 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.551 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 8.1 p30 -75.31 163.38 27.53 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.157 -0.474 . . . . 1.3899999999999999 110.819 179.486 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.44 HD13 HD12 ' A' ' 55' ' ' LEU . 4.4 mm? -52.03 -43.03 63.54 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 123.258 0.349 . . . . 0.92000000000000004 111.77 -176.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.416 ' OG ' ' HA3' ' A' ' 16' ' ' GLY . 5.1 m -56.87 -49.18 76.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.882 0.372 . . . . 0.68999999999999995 110.303 178.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 11.7 mt-30 -68.0 -29.19 68.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.011 -0.54 . . . . 1.74 111.467 178.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.551 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 77.4 mt -65.42 -43.05 91.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.998 0.428 . . . . 1.1499999999999999 110.236 176.323 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -72.35 -33.97 67.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.512 -0.313 . . . . 2.8300000000000001 110.465 178.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.25 -30.98 72.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.076 0.465 . . . . 0.31 110.617 177.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.53 -42.15 98.39 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.775 -0.648 . . . . 0.20999999999999999 110.74 176.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.61 -34.41 78.16 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.916 -0.584 . . . . 0.14000000000000001 110.821 178.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.32 -36.52 82.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.915 -0.584 . . . . 0.17000000000000001 111.128 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.472 ' HD2' ' CD1' ' A' ' 42' ' ' LEU . 94.0 mtt180 -57.89 -41.41 82.48 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.107 -0.497 . . . . 0.35999999999999999 110.428 177.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.675 HG12 HD13 ' A' ' 41' ' ' LEU . 68.3 mt -78.42 -34.9 18.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.526 -0.761 . . . . 0.16 110.533 -176.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.438 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -59.85 -47.39 91.23 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.765 -0.731 . . . . 0.22 111.692 176.279 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -71.28 -24.25 62.12 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.505 0.193 . . . . 2.1699999999999999 110.917 177.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.439 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 93.1 t80 -60.36 -49.41 77.7 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.116 0.484 . . . . 0.20999999999999999 110.019 176.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 8.1 m-85 -62.2 -42.27 99.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.593 -0.73 . . . . 0.20999999999999999 110.721 176.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . 0.438 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 49.8 mt-30 -61.06 -36.0 78.45 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.109 -0.496 . . . . 1.21 111.093 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -62.22 -35.47 78.98 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.1 0.476 . . . . 1.6799999999999999 110.347 176.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.439 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 73.1 mmtt -83.23 4.75 25.53 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.845 -0.616 . . . . 0.56999999999999995 110.98 -176.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 98.97 -2.99 58.39 Favored Glycine 0 N--CA 1.449 -0.494 0 CA-C-N 116.01 -0.541 . . . . 0.31 112.706 177.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 45.9 m-85 -88.58 75.18 8.35 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.336 0.588 . . . . 0.39000000000000001 109.721 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 21.9 t -74.07 -23.87 18.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.561 -0.745 . . . . 0.40999999999999998 110.313 -177.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 86.0 mt -81.31 -3.03 51.31 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.848 -0.615 . . . . 1.76 110.806 178.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -102.23 147.16 26.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.918 -0.583 . . . . 0.37 110.996 -178.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 26.1 tpt180 -160.19 136.15 8.52 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.944 -0.571 . . . . 1.8 109.73 177.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -99.11 140.54 33.11 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.646 -0.252 . . . . 0.17999999999999999 110.438 179.026 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 46.3 p90 -137.3 155.07 49.89 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.909 0.385 . . . . 0.38 110.407 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 9.9 tt -110.84 107.07 57.93 Favored Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 109.778 -0.453 . . . . 0.39000000000000001 109.778 -178.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -76.91 83.39 2.12 Favored 'Trans proline' 0 C--O 1.233 0.268 0 C-N-CA 123.004 2.469 . . . . 1.1200000000000001 112.298 -178.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -76.75 78.19 3.37 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.173 -0.467 . . . . 2.0 111.303 -176.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -145.78 -54.86 0.28 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.09 -0.505 . . . . 3.7200000000000002 111.109 178.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 45.8 mm-40 -119.01 35.7 4.72 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.859 0.362 . . . . 3.7599999999999998 110.921 -178.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 56.4 mt -92.67 127.88 44.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.26 -0.427 . . . . 1.23 110.437 178.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.476 ' H ' ' CD ' ' A' ' 84' ' ' GLN . 5.0 pm0 -64.46 164.83 10.83 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.603 -0.726 . . . . 1.5600000000000001 110.705 177.703 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -81.24 149.42 29.03 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.066 -0.515 . . . . 1.54 110.053 178.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . 0.56 ' O ' ' HA ' ' A' ' 22' ' ' VAL . . . 89.58 -90.3 1.62 Allowed Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 121.03 -0.605 . . . . 0.57999999999999996 111.78 -176.731 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.424 HG23 ' HG3' ' A' ' 24' ' ' ARG . 85.5 m -72.87 120.96 19.23 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 117.191 0.496 . . . . 0.46999999999999997 110.315 177.193 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 34.2 m -102.33 138.16 27.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 109.858 -0.423 . . . . 0.31 109.858 179.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.462 ' HD3' ' HB2' ' A' ' 28' ' ' SER . 23.0 ttm180 -107.19 129.01 54.91 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.15 0.5 . . . . 2.9199999999999999 111.107 -177.476 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.453 ' HB ' HD13 ' A' ' 27' ' ' LEU . 56.6 mt -113.65 130.74 67.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.543 -0.753 . . . . 0.23000000000000001 109.413 176.596 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -95.22 125.4 39.84 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.373 0.606 . . . . 1.3300000000000001 110.36 -179.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 71.7 t -98.71 103.47 14.74 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 115.287 -0.869 . . . . 0.27000000000000002 110.434 -177.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 52.3 tp -85.93 93.62 8.99 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.396 -0.594 . . . . 0.35999999999999999 109.396 176.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -72.17 -18.98 61.82 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.121 -0.491 . . . . 0.48999999999999999 110.423 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.157 0 CA-C-O 117.976 -1.458 . . . . 1.3899999999999999 111.037 179.398 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.6 ttm . . . . . 0 N--CA 1.478 0.975 0 CA-C-O 120.895 0.378 . . . . 15.85 110.71 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -88.09 86.16 7.06 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.901 0.381 . . . . 12.76 111.066 -176.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 46.6 m80 -84.3 87.64 7.21 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.216 -0.447 . . . . 13.359999999999999 110.698 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 49.3 m-70 -76.18 -37.02 58.41 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.991 0.424 . . . . 10.710000000000001 110.16 178.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.408 ' CD2' ' H ' ' A' ' 5' ' ' HIS . 6.3 p80 -86.27 126.71 34.5 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.911 -0.586 . . . . 9.0399999999999991 110.135 177.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . 0.448 ' O ' HD22 ' A' ' 21' ' ' LEU . 88.1 m-70 -115.05 -179.75 3.72 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.64 -0.504 . . . . 9.7899999999999991 109.64 -179.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 46.1 m80 57.96 66.14 1.17 Allowed 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.192 0.52 . . . . 7.4100000000000001 110.028 -175.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 68.9 m-70 -70.78 141.21 51.42 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.362 -0.835 . . . . 6.4400000000000004 112.497 -170.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 53.8 t -113.4 -39.64 3.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.761 0 CA-C-N 114.417 -1.265 . . . . 1.97 108.327 173.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.5 t70 171.61 121.61 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 114.926 -1.034 . . . . 4.2000000000000002 109.856 175.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -116.65 25.2 10.74 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 122.017 0.913 . . . . 4.3300000000000001 109.616 -179.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -82.76 -36.8 25.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.537 -0.756 . . . . 4.3700000000000001 110.207 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -76.75 67.83 2.89 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.149 -0.478 . . . . 5.3600000000000003 109.868 173.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.439 ' HG3' ' HA ' ' A' ' 18' ' ' PRO . 15.0 ttmm -100.24 -74.69 0.6 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.916 -0.584 . . . . 3.4199999999999999 111.288 -175.074 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 64.8 mtm 52.54 76.62 0.18 Allowed 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.49 -0.777 . . . . 4.4299999999999997 111.38 -177.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 106.33 -100.35 1.62 Allowed Glycine 0 N--CA 1.444 -0.768 0 C-N-CA 120.721 -0.752 . . . . 3.4100000000000001 112.195 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -85.36 136.91 14.84 Favored Glycine 0 N--CA 1.444 -0.798 0 C-N-CA 120.705 -0.76 . . . . 2.0899999999999999 112.455 -178.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.439 ' HA ' ' HG3' ' A' ' 14' ' ' LYS . 11.3 Cg_endo -55.52 147.48 58.17 Favored 'Trans proline' 0 C--O 1.236 0.376 0 C-N-CA 123.355 2.703 . . . . 1.1599999999999999 112.014 177.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.555 ' HA ' ' HA ' ' A' ' 51' ' ' ASN . 40.6 p -64.28 140.41 58.87 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.919 -0.582 . . . . 0.72999999999999998 111.418 -176.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 75.1 t -99.05 121.07 49.21 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-N 115.581 -0.736 . . . . 0.52000000000000002 109.67 176.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.596 ' O ' ' HA2' ' A' ' 86' ' ' GLY . 50.8 tp -71.3 91.85 1.0 Allowed 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.574 -0.528 . . . . 0.91000000000000003 109.574 176.175 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.596 HG12 ' HB3' ' A' ' 46' ' ' PRO . 61.7 t -68.71 113.54 4.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.932 0 CA-C-N 115.339 -0.846 . . . . 0.31 110.582 -178.132 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -92.84 -32.36 14.65 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.545 -0.752 . . . . 1.1599999999999999 109.168 175.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 12.5 ptp180 -163.87 158.5 19.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.562 -0.745 . . . . 2.1600000000000001 110.342 -179.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.56 ' CE1' HG11 ' A' ' 22' ' ' VAL . 31.9 m-85 -105.25 142.0 35.79 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.985 -0.552 . . . . 0.34999999999999998 109.822 176.018 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 45.0 tp60 -123.16 128.27 49.83 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.198 -0.667 . . . . 1.3700000000000001 109.198 178.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.52 HD13 ' HB ' ' A' ' 90' ' ' ILE . 3.9 mm? -103.36 133.39 48.5 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.124 0.488 . . . . 0.25 110.436 -177.814 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.485 ' O ' ' HA ' ' A' ' 91' ' ' GLU . 23.1 t -127.51 126.2 41.81 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.899 -0.592 . . . . 0.94999999999999996 109.929 -178.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 100.97 -15.17 58.31 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.545 -0.836 . . . . 0.20999999999999999 112.372 179.086 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 15.1 p-10 -72.38 136.21 46.06 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.754 0.312 . . . . 0.44 110.663 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.8 tpp180 -130.12 -39.28 1.37 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.248 -0.433 . . . . 2.48 110.708 178.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 24.0 tp60 -68.41 -40.24 81.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.012 0.434 . . . . 1.9099999999999999 110.634 -179.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -126.59 134.66 50.75 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.027 -0.533 . . . . 0.25 109.64 179.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -79.31 176.19 9.91 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.943 -0.571 . . . . 0.62 111.593 -176.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.507 ' O ' HD13 ' A' ' 39' ' ' LEU . 6.4 m-20 -55.99 -57.01 13.9 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 116.147 -0.479 . . . . 0.58999999999999997 110.991 -178.502 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.434 ' HA ' HD22 ' A' ' 39' ' ' LEU . 74.2 mtp180 -58.03 -34.77 70.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.233 -0.439 . . . . 3.6600000000000001 111.502 -175.147 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 15.0 tpt180 -62.26 -46.14 90.14 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.096 -0.502 . . . . 2.2999999999999998 110.684 176.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.546 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -78.08 -27.54 48.59 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.138 -0.483 . . . . 0.19 111.311 -178.139 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.507 HD13 ' O ' ' A' ' 35' ' ' ASP . 1.8 mp -57.18 -35.15 69.24 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.085 -0.507 . . . . 1.77 111.318 177.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.5 -25.51 66.13 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.042 -0.526 . . . . 0.29999999999999999 111.697 178.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.575 HD13 HG12 ' A' ' 62' ' ' ILE . 4.0 mt -69.62 -28.06 65.61 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.155 0.503 . . . . 0.20000000000000001 110.45 177.014 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.559 HD21 HD11 ' A' ' 62' ' ' ILE . 0.4 OUTLIER -106.53 13.27 28.55 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.898 -0.592 . . . . 0.22 110.164 -178.299 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 9.3 p80 -48.86 -26.11 2.26 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.821 1.045 . . . . 0.55000000000000004 113.821 -172.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -105.08 5.97 32.89 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 111.98 0.363 . . . . 0.59999999999999998 111.98 -174.101 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 84.3 mt -94.67 -52.19 0.24 Allowed Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 113.84 1.052 . . . . 0.82999999999999996 113.84 -173.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.596 ' HB3' HG12 ' A' ' 22' ' ' VAL . 71.8 Cg_endo -74.61 157.41 44.41 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 121.233 1.289 . . . . 0.33000000000000002 112.254 -169.665 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 98.44 -5.9 60.86 Favored Glycine 0 N--CA 1.446 -0.648 0 N-CA-C 110.023 -1.231 . . . . 0.31 110.023 -169.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -121.15 170.52 9.48 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.733 -0.734 . . . . 1.46 109.085 176.253 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -100.07 107.56 19.5 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.477 -0.564 . . . . 1.1200000000000001 109.477 176.395 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -101.01 122.91 44.36 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.595 -0.729 . . . . 0.38 110.376 -175.068 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.61 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 31.2 p-10 -72.26 166.3 22.71 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.553 -0.294 . . . . 1.3899999999999999 110.805 177.587 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.485 ' HA ' HD12 ' A' ' 55' ' ' LEU . 4.6 mm? -48.34 -46.06 36.08 Favored 'General case' 0 C--N 1.329 -0.3 0 O-C-N 123.461 0.476 . . . . 0.92000000000000004 111.585 -177.26 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.443 ' HA ' ' NE2' ' A' ' 56' ' ' HIS . 13.1 m -50.61 -53.53 30.01 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.878 -0.601 . . . . 0.68999999999999995 111.113 178.605 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -72.7 -23.83 60.92 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.005 -0.543 . . . . 1.74 111.679 -178.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.61 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 85.5 mt -65.1 -53.0 52.18 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.579 -0.282 . . . . 1.1499999999999999 110.9 179.426 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.443 ' NE2' ' HA ' ' A' ' 53' ' ' SER . 31.5 p80 -74.34 -23.46 59.04 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.396 -0.522 . . . . 2.8300000000000001 111.203 -179.448 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.12 -33.85 75.23 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.989 0.423 . . . . 0.31 110.516 175.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.87 -34.87 76.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.782 -0.644 . . . . 0.20999999999999999 110.854 176.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.98 -30.37 69.63 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.942 -0.572 . . . . 0.14000000000000001 110.887 -179.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.85 -28.9 69.87 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.98 -0.555 . . . . 0.17000000000000001 110.829 179.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 78.0 mtt180 -63.06 -39.84 95.91 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.161 0.505 . . . . 0.35999999999999999 110.129 176.251 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.575 HG12 HD13 ' A' ' 41' ' ' LEU . 78.6 mt -79.05 -36.32 18.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.467 -0.788 . . . . 0.16 110.726 -177.294 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.633 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -59.94 -46.9 93.32 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.389 -0.91 . . . . 0.22 111.038 174.579 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.426 ' O ' ' HG3' ' A' ' 68' ' ' GLU . 21.6 t70 -63.51 -37.52 87.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.624 -0.288 . . . . 2.1699999999999999 110.653 176.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.421 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 82.8 t80 -53.22 -53.5 49.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.918 -0.583 . . . . 0.20999999999999999 110.834 177.003 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -59.63 -40.52 87.89 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.709 -0.678 . . . . 0.20999999999999999 111.184 178.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . 0.633 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 78.4 mt-30 -61.69 -37.89 85.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.483 -0.326 . . . . 1.21 111.226 -178.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 64' ' ' ASP . 44.0 mt-10 -70.27 -19.67 63.1 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.058 0.456 . . . . 1.6799999999999999 110.658 178.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.421 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 75.3 mmtt -90.74 6.47 43.98 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.022 -0.536 . . . . 0.56999999999999995 110.326 177.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 97.54 -8.95 64.38 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 121.06 -0.59 . . . . 0.31 112.555 177.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -88.46 73.29 8.75 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.381 0.61 . . . . 0.39000000000000001 109.8 -178.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 23.8 t -71.31 -28.57 32.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.45 -0.795 . . . . 0.40999999999999998 110.927 -176.039 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 10.8 mp -82.4 -3.47 55.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.282 -0.417 . . . . 1.76 110.92 179.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -91.39 136.24 33.25 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.073 -0.512 . . . . 0.37 110.494 179.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 17.1 tpt180 -149.03 131.73 15.94 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.945 -0.57 . . . . 1.8 110.071 -179.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.75 138.36 36.02 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.029 -0.532 . . . . 0.17999999999999999 109.93 176.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 52.9 p90 -137.45 155.49 49.26 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.555 -0.535 . . . . 0.38 109.555 179.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.433 HD13 ' HB3' ' A' ' 55' ' ' LEU . 3.8 tt -111.59 108.91 56.1 Favored Pre-proline 0 C--N 1.318 -0.782 0 N-CA-C 109.64 -0.504 . . . . 0.39000000000000001 109.64 -179.389 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.49 ' HG3' ' OE2' ' A' ' 91' ' ' GLU . 36.8 Cg_endo -64.66 105.12 0.6 Allowed 'Trans proline' 0 C--O 1.234 0.319 0 C-N-CA 122.768 2.312 . . . . 1.1200000000000001 112.165 -179.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -80.85 64.13 5.5 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.341 0.591 . . . . 2.0 110.81 -178.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -116.9 78.45 1.21 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.634 -0.712 . . . . 3.7200000000000002 109.921 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 60.27 62.34 1.61 Allowed 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.964 -0.562 . . . . 3.7599999999999998 110.716 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 56.4 mt -62.49 137.82 23.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.367 -0.833 . . . . 1.23 111.087 -178.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.435 ' HB2' ' O ' ' A' ' 87' ' ' THR . 38.9 mt-30 -59.63 146.21 41.83 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.378 -0.828 . . . . 1.5600000000000001 110.107 177.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -79.69 34.18 0.27 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.098 0.475 . . . . 1.54 111.525 -176.063 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . 0.596 ' HA2' ' O ' ' A' ' 21' ' ' LEU . . . -170.75 -51.06 0.04 OUTLIER Glycine 0 N--CA 1.445 -0.754 0 C-N-CA 121.032 -0.604 . . . . 0.57999999999999996 111.94 -178.448 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.435 ' O ' ' HB2' ' A' ' 84' ' ' GLN . 12.5 m -98.32 121.16 39.91 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.772 0.32 . . . . 0.46999999999999997 110.736 179.318 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.405 ' HB ' HD11 ' A' ' 78' ' ' LEU . 34.8 m -103.51 134.98 43.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 N-CA-C 109.658 -0.497 . . . . 0.31 109.658 176.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.484 ' O ' ' HD2' ' A' ' 79' ' ' PRO . 37.4 ttp180 -111.54 115.3 28.95 Favored 'General case' 0 C--N 1.32 -0.713 0 C-N-CA 120.554 -0.458 . . . . 2.9199999999999999 110.968 -177.289 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.52 ' HB ' HD13 ' A' ' 27' ' ' LEU . 60.9 mt -101.88 126.21 55.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.789 -0.641 . . . . 0.23000000000000001 109.779 177.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.49 ' OE2' ' HG3' ' A' ' 79' ' ' PRO . 53.8 mt-10 -94.76 125.23 39.28 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.17 0.509 . . . . 1.3300000000000001 110.271 -179.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.402 ' CG2' HD12 ' A' ' 27' ' ' LEU . 40.2 t -101.63 100.97 11.43 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-N 115.513 -0.767 . . . . 0.27000000000000002 110.588 -175.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 57.7 tp -86.18 90.05 8.02 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.359 -0.608 . . . . 0.35999999999999999 109.359 176.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -68.47 -27.42 66.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.685 -0.688 . . . . 0.48999999999999999 110.689 -176.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.153 0 CA-C-O 118.47 -1.183 . . . . 1.3899999999999999 111.584 178.695 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 92.4 mmm . . . . . 0 N--CA 1.479 1.009 0 CA-C-O 120.985 0.422 . . . . 15.85 110.191 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -135.04 10.64 3.58 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.289 0.566 . . . . 12.76 110.292 178.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 13.7 m170 -82.1 150.69 27.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.718 -0.674 . . . . 13.359999999999999 109.908 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 37.8 m80 58.95 40.86 21.97 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.315 0.578 . . . . 10.710000000000001 109.886 -172.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 13.9 t-80 -165.77 -33.94 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.284 -0.871 . . . . 9.0399999999999991 110.375 179.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -64.13 -36.5 84.24 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.313 -0.403 . . . . 9.7899999999999991 110.342 178.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 11.9 p80 -137.37 117.26 13.22 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.11 0.481 . . . . 7.4100000000000001 110.506 173.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 29.2 p80 -88.78 -6.66 57.25 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.318 0.58 . . . . 6.4400000000000004 109.479 176.221 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.636 HG13 ' HG3' ' A' ' 49' ' ' GLU . 11.6 p -85.86 146.77 6.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.214 -0.903 . . . . 1.97 110.107 177.121 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -132.76 -173.02 3.06 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.443 -0.577 . . . . 4.2000000000000002 109.443 176.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -66.61 87.76 0.13 Allowed 'General case' 0 C--O 1.234 0.278 0 CA-C-O 120.81 0.338 . . . . 4.3300000000000001 110.971 178.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -78.29 -47.44 17.84 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.268 -0.424 . . . . 4.3700000000000001 110.197 178.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -135.51 108.83 7.8 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.128 -0.487 . . . . 5.3600000000000003 110.534 179.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -134.61 83.71 2.05 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.216 -0.661 . . . . 3.4199999999999999 109.216 179.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 87.5 mtp -123.38 -47.23 2.0 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.17 -0.468 . . . . 4.4299999999999997 110.989 179.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -82.49 -14.71 75.53 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.807 -0.711 . . . . 3.4100000000000001 112.179 -178.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 172.5 163.09 25.76 Favored Glycine 0 N--CA 1.443 -0.835 0 N-CA-C 111.478 -0.649 . . . . 2.0899999999999999 111.478 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -58.31 155.12 36.85 Favored 'Trans proline' 0 C--O 1.232 0.217 0 C-N-CA 123.186 2.591 . . . . 1.1599999999999999 112.213 178.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.405 ' HA ' ' HA ' ' A' ' 51' ' ' ASN . 77.9 p -93.03 139.28 30.7 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-O 121.045 0.45 . . . . 0.72999999999999998 110.41 -179.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 41.3 t -117.9 121.87 68.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 116.104 -0.498 . . . . 0.52000000000000002 109.671 177.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.408 ' HB2' ' HG2' ' A' ' 49' ' ' GLU . 45.4 tp -68.51 97.52 0.78 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.189 0.518 . . . . 0.91000000000000003 110.02 177.249 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.583 HG12 ' HB3' ' A' ' 46' ' ' PRO . 57.7 t -75.68 120.33 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.996 0 CA-C-N 115.43 -0.804 . . . . 0.31 109.798 178.503 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 66.7 mttt -104.13 -22.39 13.42 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.789 -0.641 . . . . 1.1599999999999999 109.362 179.068 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -169.34 160.09 9.19 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.56 -0.745 . . . . 2.1600000000000001 110.623 178.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.512 ' CE1' HG11 ' A' ' 22' ' ' VAL . 21.4 m-85 -111.31 148.06 33.75 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.742 -0.663 . . . . 0.34999999999999998 109.231 176.034 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 60.4 tp60 -129.74 134.59 47.7 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 109.541 -0.54 . . . . 1.3700000000000001 109.541 174.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.474 ' HG ' HD23 ' A' ' 38' ' ' LEU . 3.4 mm? -103.62 135.09 45.85 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 121.052 0.453 . . . . 0.25 109.995 -178.527 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.538 ' O ' ' HA ' ' A' ' 91' ' ' GLU . 45.2 m -129.35 120.49 25.67 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.902 -0.59 . . . . 0.94999999999999996 110.255 177.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 111.86 -11.04 27.47 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.927 -0.654 . . . . 0.20999999999999999 112.038 -179.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 17.7 p-10 -84.67 139.65 31.88 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.137 0.494 . . . . 0.44 110.802 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.9 tpp180 -136.67 -32.82 0.81 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.389 -0.823 . . . . 2.48 109.898 177.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -66.48 -40.14 89.16 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.985 -0.552 . . . . 1.9099999999999999 111.307 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.425 ' CZ ' ' HG3' ' A' ' 69' ' ' LYS . 82.4 m-85 -126.34 137.39 53.46 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 110.104 -0.332 . . . . 0.25 110.104 179.197 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -72.91 168.1 19.64 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.972 -0.558 . . . . 0.62 110.923 -178.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.65 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 58.1 m-20 -53.61 -55.87 22.09 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 123.402 0.439 . . . . 0.58999999999999997 111.326 -175.167 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.424 ' HA ' HD12 ' A' ' 39' ' ' LEU . 61.0 ttp180 -57.73 -37.48 73.64 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.354 -0.384 . . . . 3.6600000000000001 111.581 -175.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 17.1 tpt180 -59.35 -36.0 74.91 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.107 0.479 . . . . 2.2999999999999998 110.452 177.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.605 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -87.14 -24.51 24.49 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.952 -0.567 . . . . 0.19 110.929 179.57 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.65 ' HG ' ' O ' ' A' ' 35' ' ' ASP . 83.4 mt -66.07 -34.59 78.41 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.6 -0.273 . . . . 1.77 111.187 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.8 -23.46 63.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.172 -0.467 . . . . 0.29999999999999999 111.311 178.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.614 HD13 HG12 ' A' ' 62' ' ' ILE . 5.7 mt -68.22 -29.6 68.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.026 0.441 . . . . 0.20000000000000001 110.581 176.026 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.596 HD21 HD11 ' A' ' 62' ' ' ILE . 0.4 OUTLIER -107.34 13.14 27.38 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.076 -0.511 . . . . 0.22 110.347 -177.629 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 5.3 p80 -50.43 -26.32 4.91 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 113.047 0.758 . . . . 0.55000000000000004 113.047 -173.114 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -97.94 0.99 47.51 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.216 0.45 . . . . 0.59999999999999998 112.216 -173.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.476 ' O ' HD21 ' A' ' 50' ' ' LEU . 79.6 mt -93.51 -56.28 0.23 Allowed Pre-proline 0 C--N 1.324 -0.538 0 N-CA-C 113.731 1.012 . . . . 0.82999999999999996 113.731 -173.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.583 ' HB3' HG12 ' A' ' 22' ' ' VAL . 87.5 Cg_endo -74.54 154.8 45.11 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 121.35 1.367 . . . . 0.33000000000000002 112.587 -167.291 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 103.38 -8.68 52.74 Favored Glycine 0 N--CA 1.447 -0.583 0 N-CA-C 109.95 -1.26 . . . . 0.31 109.95 -169.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.582 ' HA ' HG11 ' A' ' 9' ' ' VAL . 27.7 mt-30 -122.87 167.5 13.46 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 114.637 -0.782 . . . . 1.46 109.458 176.174 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.636 ' HG3' HG13 ' A' ' 9' ' ' VAL . 39.4 mt-10 -98.86 89.75 4.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.532 0.682 . . . . 1.1200000000000001 109.502 176.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.476 HD21 ' O ' ' A' ' 45' ' ' LEU . 1.9 mm? -79.52 135.69 36.7 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.739 -1.119 . . . . 0.38 109.946 -177.666 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.405 ' HA ' ' HA ' ' A' ' 19' ' ' THR . 2.7 p30 -81.51 161.48 23.59 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.215 -0.661 . . . . 1.3899999999999999 109.215 175.2 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -46.67 -40.49 13.26 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 113.137 0.791 . . . . 0.92000000000000004 113.137 -173.061 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.7 m -58.1 -38.06 75.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.931 0.396 . . . . 0.68999999999999995 111.044 -178.556 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -72.49 -38.34 68.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.072 -0.513 . . . . 1.74 110.827 178.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.463 ' HB3' HD13 ' A' ' 78' ' ' LEU . 9.8 mp -60.56 -44.64 95.93 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.261 -0.427 . . . . 1.1499999999999999 111.421 176.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 77.9 m-70 -68.35 -31.79 71.42 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.893 -0.323 . . . . 2.8300000000000001 110.73 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.13 -28.89 69.74 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.23 0.538 . . . . 0.31 110.453 177.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.81 -39.58 94.72 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.519 -0.764 . . . . 0.20999999999999999 111.06 177.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.22 -34.72 78.66 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.858 -0.61 . . . . 0.14000000000000001 111.231 -178.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.88 -35.87 82.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 0.17000000000000001 110.947 -179.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 -58.82 -38.77 79.38 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.879 -0.6 . . . . 0.35999999999999999 110.446 178.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.614 HG12 HD13 ' A' ' 41' ' ' LEU . 66.2 mt -79.52 -37.77 18.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.285 -0.871 . . . . 0.16 110.871 -175.094 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -61.5 -44.65 97.72 Favored Glycine 0 N--CA 1.446 -0.693 0 C-N-CA 120.389 -0.91 . . . . 0.22 111.65 177.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -73.96 -24.23 59.61 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.619 0.247 . . . . 2.1699999999999999 110.874 178.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.468 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 91.3 t80 -59.78 -48.8 80.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.121 0.486 . . . . 0.20999999999999999 109.862 174.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . 0.447 ' HB3' ' HB2' ' A' ' 71' ' ' TYR . 10.0 m-85 -59.82 -46.03 90.53 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.463 -0.79 . . . . 0.20999999999999999 111.173 177.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 17.6 mt-30 -59.83 -38.61 82.54 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.464 -0.334 . . . . 1.21 111.083 -179.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -61.91 -35.58 78.8 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.554 -0.535 . . . . 1.6799999999999999 109.554 178.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.468 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 69.6 mmtt -82.58 2.6 32.39 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.837 -0.619 . . . . 0.56999999999999995 111.113 -179.314 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 106.51 -7.78 39.91 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 121.047 -0.597 . . . . 0.31 112.936 175.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . 0.447 ' HB2' ' HB3' ' A' ' 66' ' ' TYR . 70.5 m-85 -89.26 73.68 8.01 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.153 0.502 . . . . 0.39000000000000001 109.805 -179.702 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 43.8 t -69.04 -29.02 41.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.779 -0.646 . . . . 0.40999999999999998 111.204 -175.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 67.3 mt -91.38 22.68 3.78 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.026 0.441 . . . . 1.76 111.042 177.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.416 ' HB1' ' HA ' ' A' ' 94' ' ' GLU . . . -121.22 120.29 34.77 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.068 -0.515 . . . . 0.37 110.547 178.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 19.5 mmm180 -128.95 170.82 12.97 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.073 -0.512 . . . . 1.8 109.739 177.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -133.18 132.75 41.93 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 109.707 -0.479 . . . . 0.17999999999999999 109.707 178.056 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 51.0 p90 -129.3 143.39 50.83 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.847 0.356 . . . . 0.38 110.171 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.492 HD23 ' H ' ' A' ' 80' ' ' ALA . 6.6 tt -93.7 107.43 27.17 Favored Pre-proline 0 C--N 1.319 -0.732 0 N-CA-C 108.948 -0.76 . . . . 0.39000000000000001 108.948 178.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.427 ' HD2' ' HA ' ' A' ' 78' ' ' LEU . 12.4 Cg_endo -55.8 -34.7 91.97 Favored 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 123.534 2.823 . . . . 1.1200000000000001 112.881 -175.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.492 ' H ' HD23 ' A' ' 78' ' ' LEU . . . 63.75 -96.23 0.05 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.259 -0.882 . . . . 2.0 111.215 178.364 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 67.58 -64.84 0.26 Allowed 'General case' 0 N--CA 1.467 0.376 0 O-C-N 123.889 0.743 . . . . 3.7200000000000002 110.724 -177.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.428 ' O ' ' HB ' ' A' ' 83' ' ' ILE . 34.0 tt0 -139.95 -49.19 0.47 Allowed 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.536 -0.542 . . . . 3.7599999999999998 109.536 177.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.428 ' HB ' ' O ' ' A' ' 82' ' ' GLU . 39.4 mt 75.07 142.16 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 CA-C-N 115.714 -0.675 . . . . 1.23 111.485 179.397 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -87.64 157.28 19.14 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.393 -0.821 . . . . 1.5600000000000001 110.593 -176.045 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -76.82 85.54 3.41 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.141 0.496 . . . . 1.54 110.417 177.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 128.61 -58.71 0.7 Allowed Glycine 0 N--CA 1.443 -0.838 0 C-N-CA 120.661 -0.781 . . . . 0.57999999999999996 112.352 177.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 19.6 m -91.91 120.66 32.79 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 120.925 0.393 . . . . 0.46999999999999997 110.627 179.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 31.0 m -108.53 132.52 56.19 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 N-CA-C 109.258 -0.645 . . . . 0.31 109.258 175.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.49 ' HD3' ' OG ' ' A' ' 28' ' ' SER . 27.2 ttm180 -109.32 128.79 55.37 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 121.13 0.49 . . . . 2.9199999999999999 110.9 -176.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 59.5 mt -113.45 135.06 54.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.399 -0.819 . . . . 0.23000000000000001 109.696 178.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.538 ' HA ' ' O ' ' A' ' 28' ' ' SER . 45.8 mt-10 -94.91 122.46 37.56 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.227 0.537 . . . . 1.3300000000000001 110.318 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 60.0 t -98.35 123.75 51.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 115.493 -0.776 . . . . 0.27000000000000002 110.103 -178.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 47.6 tp -108.97 94.8 5.24 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 109.315 -0.624 . . . . 0.35999999999999999 109.315 178.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.416 ' HA ' ' HB1' ' A' ' 74' ' ' ALA . 48.1 mt-10 -77.4 2.56 15.64 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.628 -0.715 . . . . 0.48999999999999999 111.035 -174.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.782 0 CA-C-O 118.818 -0.99 . . . . 1.3899999999999999 112.08 177.212 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 83.5 mtp . . . . . 0 N--CA 1.478 0.947 0 N-CA-C 110.262 -0.273 . . . . 15.85 110.262 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -68.03 109.3 3.42 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.27 -0.423 . . . . 12.76 110.584 -178.249 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 57.8 m80 -88.66 31.98 0.81 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.146 -0.479 . . . . 13.359999999999999 111.194 -176.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 7.3 p80 -148.97 115.99 6.04 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.207 0.527 . . . . 10.710000000000001 110.024 177.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 62.2 m80 -86.33 -14.75 42.66 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.248 0.547 . . . . 9.0399999999999991 109.767 177.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 21.3 m-70 -86.22 123.89 32.0 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.525 -0.761 . . . . 9.7899999999999991 109.669 175.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 79.4 m80 -100.75 -1.67 34.41 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.245 -0.434 . . . . 7.4100000000000001 110.491 -179.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 31.2 m170 -105.9 40.8 1.5 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.07 -0.514 . . . . 6.4400000000000004 110.11 177.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.438 HG22 ' O ' ' A' ' 47' ' ' GLY . 60.2 t -65.83 121.62 15.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.113 0.483 . . . . 1.97 110.145 178.523 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.565 ' H ' ' HG2' ' A' ' 48' ' ' GLN . 53.3 m-20 -109.24 148.03 31.63 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.622 -0.717 . . . . 4.2000000000000002 110.823 -175.457 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -80.57 -15.88 55.56 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 108.688 -0.856 . . . . 4.3300000000000001 108.688 172.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 17.6 t70 66.57 -79.55 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 114.455 -1.248 . . . . 4.3700000000000001 111.237 176.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -169.69 90.75 0.2 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.95 0.405 . . . . 5.3600000000000003 110.095 178.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 4.7 tmmm? -75.07 82.79 2.28 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.943 -0.572 . . . . 3.4199999999999999 110.218 -179.031 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 87.9 mmm -136.63 136.05 38.83 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.733 -0.667 . . . . 4.4299999999999997 109.609 175.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 85.19 -2.64 88.1 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.716 -0.754 . . . . 3.4100000000000001 111.91 -176.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 160.67 145.51 4.31 Favored Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 121.23 -0.51 . . . . 2.0899999999999999 112.246 178.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -54.01 157.03 11.46 Favored 'Trans proline' 0 C--O 1.235 0.343 0 C-N-CA 123.83 3.02 . . . . 1.1599999999999999 113.21 175.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.502 ' HA ' ' HA ' ' A' ' 51' ' ' ASN . 25.1 p -98.47 140.15 33.15 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.707 -0.679 . . . . 0.72999999999999998 111.529 -177.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 50.0 t -117.27 121.48 67.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.806 -0.633 . . . . 0.52000000000000002 109.787 177.339 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.494 ' HA ' ' HA ' ' A' ' 49' ' ' GLU . 55.3 tp -65.66 115.76 6.17 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.021 0.439 . . . . 0.91000000000000003 110.247 177.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.591 HG12 ' HB3' ' A' ' 46' ' ' PRO . 48.5 t -95.54 121.67 46.3 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 CA-C-N 115.842 -0.617 . . . . 0.31 110.353 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 80.2 mttt -107.35 -27.22 10.61 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.589 -0.732 . . . . 1.1599999999999999 109.704 177.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.8 ptp180 -161.74 161.71 29.39 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.837 -0.619 . . . . 2.1600000000000001 110.876 177.303 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.521 ' CE2' ' HG ' ' A' ' 42' ' ' LEU . 29.2 m-85 -110.72 137.04 48.9 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.715 -0.675 . . . . 0.34999999999999998 109.799 176.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 19.2 tp60 -119.12 129.45 55.05 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.409 -0.589 . . . . 1.3700000000000001 109.409 177.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.534 HD13 ' HB ' ' A' ' 90' ' ' ILE . 3.8 mm? -103.02 132.68 49.11 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.259 0.552 . . . . 0.25 110.113 -179.63 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 48.1 t -121.71 122.16 38.92 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.495 -0.775 . . . . 0.94999999999999996 109.667 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 103.79 -16.11 51.53 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.625 -0.798 . . . . 0.20999999999999999 112.331 179.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 20.7 p-10 -69.18 126.53 30.08 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.051 0.453 . . . . 0.44 110.367 179.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.576 ' HA ' ' NE ' ' A' ' 31' ' ' ARG . 1.9 mmp_? -125.97 -34.64 2.55 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.266 -0.425 . . . . 2.48 110.678 179.435 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.431 ' HG2' ' CZ ' ' A' ' 71' ' ' TYR . 57.5 tp60 -75.17 -38.29 60.94 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.258 -0.428 . . . . 1.9099999999999999 110.598 -179.697 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -123.44 146.91 47.65 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.605 -0.517 . . . . 0.25 109.605 178.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -92.41 169.71 10.35 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.27 -0.423 . . . . 0.62 111.233 -176.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.527 ' O ' HD13 ' A' ' 39' ' ' LEU . 4.1 m-20 -56.07 -52.87 62.74 Favored 'General case' 0 CA--C 1.517 -0.323 0 O-C-N 123.258 0.349 . . . . 0.58999999999999997 110.616 -177.579 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 61.9 ttp180 -52.79 -39.61 62.46 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.307 -0.406 . . . . 3.6600000000000001 111.1 -177.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 15.4 tpt180 -63.75 -50.09 70.45 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.925 -0.58 . . . . 2.2999999999999998 111.094 178.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.528 HD23 ' HG ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -73.56 -26.79 61.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.844 0.354 . . . . 0.19 111.261 -176.736 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.527 HD13 ' O ' ' A' ' 35' ' ' ASP . 2.3 mp -60.14 -32.93 71.48 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.154 -0.475 . . . . 1.77 111.781 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.54 -25.58 66.25 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.146 -0.479 . . . . 0.29999999999999999 111.452 179.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.523 HD13 HG12 ' A' ' 62' ' ' ILE . 1.7 mt -70.12 -27.49 64.62 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.888 0.375 . . . . 0.20000000000000001 110.431 176.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.616 HD21 HD11 ' A' ' 62' ' ' ILE . 0.4 OUTLIER -107.55 13.32 26.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.94 -0.573 . . . . 0.22 110.447 -177.184 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 6.5 p80 -51.92 -24.77 6.85 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.798 -0.637 . . . . 0.55000000000000004 112.554 -173.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -101.02 3.38 41.43 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.369 0.507 . . . . 0.59999999999999998 112.369 -172.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 86.9 mt -95.53 -54.87 0.22 Allowed Pre-proline 0 C--N 1.323 -0.556 0 N-CA-C 113.932 1.086 . . . . 0.82999999999999996 113.932 -172.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.591 ' HB3' HG12 ' A' ' 22' ' ' VAL . 75.3 Cg_endo -73.41 161.38 42.69 Favored 'Trans proline' 0 C--N 1.351 0.697 0 C-N-CA 121.318 1.345 . . . . 0.33000000000000002 112.678 -168.205 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.438 ' O ' HG22 ' A' ' 9' ' ' VAL . . . 100.87 3.98 54.63 Favored Glycine 0 N--CA 1.449 -0.477 0 N-CA-C 110.594 -1.002 . . . . 0.31 110.594 -170.275 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.565 ' HG2' ' H ' ' A' ' 10' ' ' ASP . 78.2 mt-30 -143.07 170.23 16.11 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.858 -0.671 . . . . 1.46 109.282 177.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.494 ' HA ' ' HA ' ' A' ' 21' ' ' LEU . 35.9 mt-10 -98.46 96.04 7.73 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.384 0.611 . . . . 1.1200000000000001 109.679 178.235 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.42 ' HA ' ' OE1' ' A' ' 54' ' ' GLN . 2.7 mm? -83.72 140.77 31.91 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.068 -0.969 . . . . 0.38 109.604 -178.216 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.502 ' HA ' ' HA ' ' A' ' 19' ' ' THR . 9.6 p30 -88.87 161.55 16.63 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.484 -0.561 . . . . 1.3899999999999999 109.484 178.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -45.08 -43.4 9.52 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.462 0.912 . . . . 0.92000000000000004 113.462 -172.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.658 ' HA ' ' NE2' ' A' ' 56' ' ' HIS . 50.0 m -58.61 -37.12 75.17 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.929 0.395 . . . . 0.68999999999999995 110.971 179.562 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.42 ' OE1' ' HA ' ' A' ' 50' ' ' LEU . 99.5 mt-30 -72.2 -38.67 69.0 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.656 -0.702 . . . . 1.74 110.56 179.043 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.655 ' HB3' HD13 ' A' ' 78' ' ' LEU . 9.4 mp -58.87 -54.78 43.23 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 112.62 0.6 . . . . 1.1499999999999999 112.62 179.206 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.658 ' NE2' ' HA ' ' A' ' 53' ' ' SER . 32.7 p80 -72.76 -23.48 60.83 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.014 -0.674 . . . . 2.8300000000000001 111.294 -177.579 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.07 -32.94 73.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.288 0.565 . . . . 0.31 109.976 173.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.415 ' HB3' ' O ' ' A' ' 55' ' ' LEU . . . -63.63 -37.79 88.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.392 -0.822 . . . . 0.20999999999999999 110.638 175.393 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.07 -34.03 77.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.733 -0.667 . . . . 0.14000000000000001 110.686 179.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.58 -35.0 78.12 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.929 -0.578 . . . . 0.17000000000000001 111.013 178.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 88.6 mtt180 -59.06 -42.38 90.18 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.24 0.543 . . . . 0.35999999999999999 109.976 177.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.616 HD11 HD21 ' A' ' 42' ' ' LEU . 80.9 mt -77.6 -37.39 24.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.398 -0.819 . . . . 0.16 110.3 -177.349 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.606 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -57.55 -46.48 91.99 Favored Glycine 0 N--CA 1.442 -0.909 0 CA-C-N 115.447 -0.797 . . . . 0.22 111.583 176.168 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -68.97 -33.51 73.8 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.61 0.243 . . . . 2.1699999999999999 110.395 177.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.581 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 76.8 t80 -54.68 -49.38 70.79 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.016 -0.538 . . . . 0.20999999999999999 110.508 177.577 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -62.12 -47.16 85.85 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.004 -0.544 . . . . 0.20999999999999999 111.159 178.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . 0.606 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 14.3 mt-30 -57.48 -41.72 81.2 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.359 0.599 . . . . 1.21 110.45 179.49 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -58.37 -38.55 77.48 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.135 -0.939 . . . . 1.6799999999999999 110.798 178.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.581 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 68.9 mmtt -82.33 2.88 30.1 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.937 -0.574 . . . . 0.56999999999999995 111.058 -177.302 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 110.31 -14.6 30.57 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 121.017 -0.611 . . . . 0.31 112.683 176.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . 0.431 ' CZ ' ' HG2' ' A' ' 32' ' ' GLN . 60.7 m-85 -83.33 69.49 9.99 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.182 0.515 . . . . 0.39000000000000001 110.239 -177.37 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 41.1 t -69.89 -23.95 26.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.776 -0.647 . . . . 0.40999999999999998 110.841 -177.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 95.0 mt -83.04 -3.2 57.0 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 1.76 110.811 178.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -101.08 144.12 30.37 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.914 -0.585 . . . . 0.37 110.867 -178.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 20.7 tpt180 -154.33 137.33 15.49 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.015 -0.539 . . . . 1.8 110.033 178.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -102.41 135.49 43.94 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.271 -0.422 . . . . 0.17999999999999999 110.141 177.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 48.7 p90 -135.6 151.06 49.9 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.722 -0.473 . . . . 0.38 109.722 179.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.655 HD13 ' HB3' ' A' ' 55' ' ' LEU . 6.7 tt -107.54 109.47 62.53 Favored Pre-proline 0 C--N 1.32 -0.704 0 N-CA-C 109.5 -0.556 . . . . 0.39000000000000001 109.5 -179.487 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.69 116.78 4.85 Favored 'Trans proline' 0 N--CA 1.46 -0.469 0 C-N-CA 122.609 2.206 . . . . 1.1200000000000001 112.06 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -82.76 54.85 2.82 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.269 0.557 . . . . 2.0 110.217 178.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -93.65 -49.98 5.61 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.563 -0.744 . . . . 3.7200000000000002 111.0 -175.072 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -132.25 -70.06 0.57 Allowed 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.449 -0.574 . . . . 3.7599999999999998 109.449 -177.044 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 38.6 mt 58.2 80.09 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.367 0 CA-C-N 115.593 -0.73 . . . . 1.23 111.127 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.519 ' NE2' ' H ' ' A' ' 84' ' ' GLN . 0.5 OUTLIER -57.28 130.03 44.41 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.414 -0.812 . . . . 1.5600000000000001 110.159 174.754 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -52.56 122.53 9.11 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.303 0.573 . . . . 1.54 110.786 -177.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 109.91 -41.89 2.11 Favored Glycine 0 N--CA 1.444 -0.816 0 C-N-CA 120.843 -0.694 . . . . 0.57999999999999996 112.469 -178.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 20.4 m -117.81 120.77 38.92 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 120.866 0.365 . . . . 0.46999999999999997 110.802 -177.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 34.3 m -103.1 137.02 32.93 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 109.638 -0.504 . . . . 0.31 109.638 176.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 30.4 ttm180 -113.58 117.6 32.07 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.122 0.486 . . . . 2.9199999999999999 110.778 -177.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.534 ' HB ' HD13 ' A' ' 27' ' ' LEU . 70.0 mt -103.83 129.73 55.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.465 -0.789 . . . . 0.23000000000000001 109.605 177.609 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -94.7 123.61 38.24 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.147 0.499 . . . . 1.3300000000000001 110.266 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 40.6 t -101.8 108.28 23.38 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 115.552 -0.749 . . . . 0.27000000000000002 110.256 -178.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 62.0 tp -90.11 96.57 10.73 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.236 -0.653 . . . . 0.35999999999999999 109.236 175.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.444 ' OE1' ' HB2' ' A' ' 31' ' ' ARG . 43.6 mt-10 -76.68 -31.13 57.06 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.016 0.436 . . . . 0.48999999999999999 110.461 -177.219 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.869 0 CA-C-O 118.244 -1.309 . . . . 1.3899999999999999 111.562 178.246 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.8 ptp . . . . . 0 N--CA 1.483 1.222 0 CA-C-O 120.457 0.17 . . . . 15.85 111.194 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.23 -35.1 73.63 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.017 0.437 . . . . 12.76 110.293 179.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 9.8 t-80 -82.23 86.45 6.65 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.791 -0.64 . . . . 13.359999999999999 109.357 177.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 50.6 m80 -70.33 120.66 16.33 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.38 -0.827 . . . . 10.710000000000001 111.499 -173.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 28.8 p-80 -94.09 98.17 10.81 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.588 0.708 . . . . 9.0399999999999991 110.508 177.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 43.1 t-80 -86.21 -28.68 23.72 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.61 -0.723 . . . . 9.7899999999999991 110.243 -179.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -143.2 81.24 1.71 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.347 0.594 . . . . 7.4100000000000001 111.07 -178.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 28.7 t-80 -73.67 89.78 1.78 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.863 -0.608 . . . . 6.4400000000000004 109.874 176.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 60.4 t -75.68 87.57 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-O 121.396 0.617 . . . . 1.97 110.399 179.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -68.86 125.34 26.29 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.187 -0.915 . . . . 4.2000000000000002 109.529 177.532 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -54.09 120.37 6.34 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.491 0.662 . . . . 4.3300000000000001 111.507 -175.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -107.25 -2.33 20.89 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.36 -0.836 . . . . 4.3700000000000001 110.938 -178.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -137.79 137.7 38.48 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.219 -0.446 . . . . 5.3600000000000003 110.631 -177.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.425 ' HD2' ' O ' ' A' ' 14' ' ' LYS . 1.1 tmmm? -148.5 48.36 1.03 Allowed 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 107.914 -1.143 . . . . 3.4199999999999999 107.914 170.038 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 87.0 mtp -105.79 -26.03 11.93 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.359 -0.837 . . . . 4.4299999999999997 109.844 178.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . 0.453 ' O ' ' HB2' ' A' ' 52' ' ' LEU . . . -108.81 47.35 1.05 Allowed Glycine 0 N--CA 1.444 -0.831 0 CA-C-N 115.544 -0.753 . . . . 3.4100000000000001 111.383 176.69 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 89.09 161.93 37.99 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 121.041 -0.599 . . . . 2.0899999999999999 112.241 -179.115 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -63.46 132.43 35.72 Favored 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 122.57 2.18 . . . . 1.1599999999999999 111.709 176.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.548 ' HB ' ' HB3' ' A' ' 49' ' ' GLU . 29.6 p -73.01 145.5 46.62 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.401 0.619 . . . . 0.72999999999999998 112.229 -175.239 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.506 HG13 ' HA ' ' A' ' 85' ' ' ASP . 38.3 t -113.89 123.22 69.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 115.114 -0.948 . . . . 0.52000000000000002 109.61 175.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.431 ' O ' ' HA2' ' A' ' 86' ' ' GLY . 42.8 tp -71.99 90.66 1.17 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.233 0.539 . . . . 0.91000000000000003 110.194 176.417 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.544 HG12 ' HB3' ' A' ' 46' ' ' PRO . 56.7 t -72.85 129.33 35.99 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 CA-C-N 115.27 -0.877 . . . . 0.31 110.77 -177.314 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 54.5 mttp -112.48 -25.15 9.32 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.654 -0.703 . . . . 1.1599999999999999 109.586 177.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 13.1 ptp180 -163.22 157.43 20.36 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.791 -0.64 . . . . 2.1600000000000001 110.811 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.51 ' CE2' ' HG ' ' A' ' 42' ' ' LEU . 22.4 m-85 -111.27 149.03 31.63 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.664 -0.698 . . . . 0.34999999999999998 109.915 177.561 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.406 ' O ' ' HA ' ' A' ' 89' ' ' ARG . 59.6 tp60 -130.27 135.38 48.05 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 109.454 -0.573 . . . . 1.3700000000000001 109.454 176.302 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.47 ' HG ' HD23 ' A' ' 38' ' ' LEU . 3.6 mm? -103.73 143.43 32.8 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.004 0.431 . . . . 0.25 110.058 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 28.5 t -128.83 133.88 48.14 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.95 -0.568 . . . . 0.94999999999999996 109.996 -179.607 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 84.74 -3.77 86.17 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.714 -0.755 . . . . 0.20999999999999999 112.575 178.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 20.6 p-10 -76.06 130.36 38.23 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.964 0.411 . . . . 0.44 110.954 179.305 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.479 ' HA ' ' NE ' ' A' ' 31' ' ' ARG . 4.7 tpm_? -137.15 -33.42 0.75 Allowed 'General case' 0 C--N 1.321 -0.63 0 CA-C-N 116.291 -0.413 . . . . 2.48 110.639 178.419 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -68.14 -36.8 80.27 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.207 -0.452 . . . . 1.9099999999999999 110.396 177.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.44 ' CZ ' ' HG3' ' A' ' 69' ' ' LYS . 86.7 m-85 -129.48 137.41 50.82 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.084 -0.507 . . . . 0.25 109.993 176.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.605 ' OD1' ' HB3' ' A' ' 36' ' ' ARG . 4.1 p30 -74.61 164.26 26.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.122 -0.49 . . . . 0.62 110.839 -179.414 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.675 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 3.8 m-20 -50.46 -55.24 16.79 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 123.393 0.433 . . . . 0.58999999999999997 110.804 -177.553 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.605 ' HB3' ' OD1' ' A' ' 34' ' ' ASP . 6.0 ttp180 -46.25 -48.17 17.95 Favored 'General case' 0 C--N 1.33 -0.278 0 O-C-N 123.814 0.696 . . . . 3.6600000000000001 111.999 178.385 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -59.04 -35.46 73.35 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.964 -0.562 . . . . 2.2999999999999998 110.96 -178.321 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.593 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -87.22 -26.23 23.62 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.21 -0.45 . . . . 0.19 111.085 -179.913 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.675 ' HG ' ' O ' ' A' ' 35' ' ' ASP . 92.9 mt -62.98 -34.39 77.41 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.763 0.316 . . . . 1.77 111.204 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.29 -23.46 65.71 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.027 -0.533 . . . . 0.29999999999999999 111.305 178.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.604 HD13 HG12 ' A' ' 62' ' ' ILE . 5.2 mt -70.0 -26.98 64.33 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.864 0.364 . . . . 0.20000000000000001 110.659 177.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.627 HD21 HD11 ' A' ' 62' ' ' ILE . 0.4 OUTLIER -109.08 12.9 24.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.237 -0.438 . . . . 0.22 110.39 -178.026 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -51.39 -26.55 8.04 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.768 0.655 . . . . 0.55000000000000004 112.768 -174.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -104.84 11.82 33.3 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.137 0.421 . . . . 0.59999999999999998 112.137 -173.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 81.5 mt -99.56 -54.54 0.17 Allowed Pre-proline 0 C--N 1.324 -0.501 0 N-CA-C 113.723 1.008 . . . . 0.82999999999999996 113.723 -176.039 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.544 ' HB3' HG12 ' A' ' 22' ' ' VAL . 72.5 Cg_endo -73.37 165.75 31.71 Favored 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 121.324 1.349 . . . . 0.33000000000000002 112.845 -168.441 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 97.74 -12.42 64.38 Favored Glycine 0 N--CA 1.446 -0.682 0 N-CA-C 110.371 -1.092 . . . . 0.31 110.371 -171.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 53.3 mt-30 -117.11 175.06 5.77 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.66 -0.77 . . . . 1.46 109.559 176.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.548 ' HB3' ' HB ' ' A' ' 19' ' ' THR . 17.9 mt-10 -99.5 101.18 12.34 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 121.283 0.563 . . . . 1.1200000000000001 109.816 174.358 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -89.51 131.97 35.28 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.189 -0.914 . . . . 0.38 110.097 -176.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.643 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 33.4 p30 -80.84 170.52 16.18 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 121.124 -0.23 . . . . 1.3899999999999999 110.452 178.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.508 ' HA ' HD12 ' A' ' 55' ' ' LEU . 4.4 mm? -50.73 -43.38 58.06 Favored 'General case' 0 N--CA 1.465 0.298 0 O-C-N 123.141 0.275 . . . . 0.92000000000000004 111.235 -177.535 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.49 ' HA ' ' NE2' ' A' ' 56' ' ' HIS . 14.9 m -54.39 -55.71 25.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.021 -0.536 . . . . 0.68999999999999995 110.619 178.375 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -62.62 -34.24 76.64 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.831 -0.622 . . . . 1.74 111.223 -179.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.643 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 89.8 mt -59.65 -57.0 14.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 1.1499999999999999 111.167 179.566 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.49 ' NE2' ' HA ' ' A' ' 53' ' ' SER . 34.5 p80 -74.0 -23.86 59.5 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.314 -0.554 . . . . 2.8300000000000001 110.867 -178.407 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.1 -30.95 72.0 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.98 0.419 . . . . 0.31 110.491 174.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.61 -38.94 86.35 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.885 -0.598 . . . . 0.20999999999999999 110.335 174.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.56 -32.93 74.03 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.622 -0.717 . . . . 0.14000000000000001 110.841 179.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.91 -32.16 73.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.965 -0.562 . . . . 0.17000000000000001 110.897 178.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 74.8 mtt180 -62.68 -39.51 94.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.915 -0.584 . . . . 0.35999999999999999 110.175 176.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.627 HD11 HD21 ' A' ' 42' ' ' LEU . 68.7 mt -79.8 -37.29 18.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.453 -0.794 . . . . 0.16 110.99 -175.338 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.571 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -59.66 -47.88 88.75 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.615 -0.803 . . . . 0.22 111.556 177.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.422 ' O ' ' HG3' ' A' ' 68' ' ' GLU . 28.5 t70 -68.86 -31.62 70.69 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.731 0.301 . . . . 2.1699999999999999 110.57 178.556 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.458 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 90.7 t80 -57.54 -51.37 69.75 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.092 -0.504 . . . . 0.20999999999999999 110.267 176.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . 0.429 ' HB3' ' HB2' ' A' ' 71' ' ' TYR . 4.3 m-85 -57.65 -42.54 83.65 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.537 -0.756 . . . . 0.20999999999999999 110.749 177.162 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . 0.571 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 91.0 mt-30 -62.07 -35.32 78.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 1.21 111.347 -178.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.422 ' HG3' ' O ' ' A' ' 64' ' ' ASP . 43.6 mt-10 -71.19 -23.31 62.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.873 0.368 . . . . 1.6799999999999999 110.837 179.309 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.458 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 74.5 mmtt -91.41 1.88 56.8 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.061 -0.518 . . . . 0.56999999999999995 110.676 -179.583 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.25 -14.17 28.26 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.734 -0.745 . . . . 0.31 112.86 176.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . 0.429 ' HB2' ' HB3' ' A' ' 66' ' ' TYR . 55.0 m-85 -87.06 67.66 9.8 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.243 0.544 . . . . 0.39000000000000001 109.852 -178.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 22.0 t -68.93 -23.43 27.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.735 -0.666 . . . . 0.40999999999999998 110.889 -175.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 97.8 mt -86.09 -8.54 57.82 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.04 -0.527 . . . . 1.76 111.111 179.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -82.98 140.45 32.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.17 -0.468 . . . . 0.37 110.574 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 5.0 tpp180 -144.54 131.71 20.59 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.166 -0.47 . . . . 1.8 109.884 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -102.51 136.28 42.62 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.97 -0.381 . . . . 0.17999999999999999 109.97 177.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 52.8 p90 -137.75 151.54 48.27 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.869 -0.419 . . . . 0.38 109.869 179.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.433 ' HA ' ' HD2' ' A' ' 79' ' ' PRO . 7.1 tt -105.89 113.04 64.2 Favored Pre-proline 0 C--N 1.32 -0.681 0 N-CA-C 109.908 -0.404 . . . . 0.39000000000000001 109.908 -178.509 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.455 ' HD2' ' O ' ' A' ' 89' ' ' ARG . 35.3 Cg_endo -64.94 100.54 0.36 Allowed 'Trans proline' 0 C--O 1.234 0.317 0 C-N-CA 122.748 2.299 . . . . 1.1200000000000001 111.459 176.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -95.27 33.68 1.53 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.944 -0.571 . . . . 2.0 111.654 -173.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 54.8 tp60 -76.79 -52.78 8.91 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.502 -0.555 . . . . 3.7200000000000002 109.502 177.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -137.5 120.11 16.11 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.853 -0.612 . . . . 3.7599999999999998 109.73 175.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 45.5 mt -125.85 111.77 28.14 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-N 116.316 -0.402 . . . . 1.23 110.714 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.522 ' H ' ' CD ' ' A' ' 84' ' ' GLN . 1.9 pm0 -64.51 145.5 56.02 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.598 -0.728 . . . . 1.5600000000000001 109.938 174.034 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.506 ' HA ' HG13 ' A' ' 20' ' ' VAL . 9.8 p-10 -75.53 74.85 2.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.777 0.799 . . . . 1.54 111.553 -175.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . 0.431 ' HA2' ' O ' ' A' ' 21' ' ' LEU . . . 162.92 -57.42 0.29 Allowed Glycine 0 N--CA 1.444 -0.831 0 CA-C-N 115.699 -0.682 . . . . 0.57999999999999996 111.572 176.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 24.3 m -96.33 120.87 37.42 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-O 120.84 0.352 . . . . 0.46999999999999997 110.676 177.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 35.0 m -111.4 134.94 52.16 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 N-CA-C 109.201 -0.666 . . . . 0.31 109.201 175.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.455 ' O ' ' HD2' ' A' ' 79' ' ' PRO . 15.6 ttp180 -113.11 131.0 56.0 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 120.177 -0.609 . . . . 2.9199999999999999 110.666 -177.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 72.4 mt -112.63 131.05 65.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 115.354 -0.839 . . . . 0.23000000000000001 109.696 179.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -94.07 126.33 39.23 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.43 0.633 . . . . 1.3300000000000001 109.986 179.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 66.0 t -100.76 101.45 12.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 CA-C-N 115.161 -0.927 . . . . 0.27000000000000002 110.562 -176.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 63.1 tp -83.93 92.39 7.8 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.898 -0.779 . . . . 0.35999999999999999 108.898 175.019 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 57.8 mt-10 -69.47 -17.33 63.61 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.217 -0.447 . . . . 0.48999999999999999 111.017 -175.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.787 -1.007 . . . . 1.3899999999999999 112.643 174.656 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.2 mtm . . . . . 0 N--CA 1.482 1.138 0 CA-C-O 120.688 0.28 . . . . 15.85 110.893 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -138.41 107.28 5.96 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.761 0.315 . . . . 12.76 110.306 -178.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 69.6 m80 -99.46 -14.58 19.04 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.271 -0.422 . . . . 13.359999999999999 110.923 -178.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 65.2 m80 -102.43 68.17 1.05 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.301 -0.408 . . . . 10.710000000000001 111.27 -175.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 39.5 m80 -88.17 -61.61 1.68 Allowed 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.705 -0.85 . . . . 9.0399999999999991 108.705 172.353 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 15.2 m-70 -131.38 2.5 4.2 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.902 -0.59 . . . . 9.7899999999999991 110.519 174.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 25.1 m170 -81.52 128.62 34.1 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.763 -0.458 . . . . 7.4100000000000001 109.763 176.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . 0.421 ' O ' ' HB ' ' A' ' 9' ' ' VAL . 81.6 t60 63.91 93.12 0.06 Allowed 'General case' 0 C--N 1.332 -0.155 0 O-C-N 123.885 0.741 . . . . 6.4400000000000004 109.814 -172.078 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.421 ' HB ' ' O ' ' A' ' 8' ' ' HIS . 87.1 t 72.77 116.46 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 115.774 -0.648 . . . . 1.97 111.576 -179.405 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -121.67 155.0 36.09 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.624 -0.717 . . . . 4.2000000000000002 109.559 176.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -105.89 16.83 24.59 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.441 -0.345 . . . . 4.3300000000000001 111.095 -177.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 62.58 21.98 13.02 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 115.836 -0.62 . . . . 4.3700000000000001 111.653 -179.03 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 58.62 56.95 3.97 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 116.256 -0.429 . . . . 5.3600000000000003 111.099 -179.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.4 ' HE3' ' HB3' ' A' ' 14' ' ' LYS . 0.8 OUTLIER 56.39 74.6 0.39 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.467 0.651 . . . . 3.4199999999999999 110.324 -178.708 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 52.9 ttm -118.94 128.3 54.28 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.76 -0.654 . . . . 4.4299999999999997 109.882 178.085 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 77.95 36.95 30.67 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.548 -0.834 . . . . 3.4100000000000001 111.369 -177.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 91.48 175.39 43.24 Favored Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 120.76 -0.733 . . . . 2.0899999999999999 111.917 -176.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_endo -58.66 146.97 89.79 Favored 'Trans proline' 0 CA--C 1.53 0.287 0 C-N-CA 122.826 2.351 . . . . 1.1599999999999999 112.165 176.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 14.7 p -111.83 142.16 44.56 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.303 -0.408 . . . . 0.72999999999999998 111.402 -177.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 23.8 t -118.85 122.81 70.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.043 -0.526 . . . . 0.52000000000000002 110.24 178.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 56.8 tp -71.44 106.07 3.8 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.385 0.612 . . . . 0.91000000000000003 109.609 174.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.518 HG12 ' HB3' ' A' ' 46' ' ' PRO . 56.4 t -91.64 118.72 37.62 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 CA-C-N 115.435 -0.802 . . . . 0.31 109.973 179.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -98.08 -26.03 14.74 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 109.111 -0.7 . . . . 1.1599999999999999 109.111 174.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 13.9 ptp180 -162.75 162.87 26.92 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.369 -0.832 . . . . 2.1600000000000001 110.712 -178.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.476 ' CE2' ' HG ' ' A' ' 42' ' ' LEU . 29.6 m-85 -111.12 154.87 23.68 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.694 -0.685 . . . . 0.34999999999999998 109.967 177.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.489 ' O ' ' HA ' ' A' ' 89' ' ' ARG . 8.1 tp-100 -137.3 140.1 41.33 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 109.065 -0.717 . . . . 1.3700000000000001 109.065 177.497 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.514 ' HG ' HD23 ' A' ' 38' ' ' LEU . 3.8 mm? -108.36 152.16 25.02 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 120.935 0.397 . . . . 0.25 110.403 -179.215 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 23.1 t -132.9 125.83 30.77 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.127 -0.488 . . . . 0.94999999999999996 110.254 177.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 90.86 -2.09 79.2 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.8 -0.714 . . . . 0.20999999999999999 113.009 175.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 14.7 p-10 -74.04 123.05 23.64 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.183 0.516 . . . . 0.44 111.072 179.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 29.8 mmm180 -121.43 -33.57 3.62 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.828 -0.624 . . . . 2.48 110.514 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -70.92 -42.25 70.13 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.007 -0.542 . . . . 1.9099999999999999 110.551 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 86.2 m-85 -128.68 137.08 51.43 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.033 -0.53 . . . . 0.25 109.749 179.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.649 ' OD2' ' HB3' ' A' ' 36' ' ' ARG . 4.6 p-10 -79.72 167.5 20.56 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.234 -0.439 . . . . 0.62 111.028 -177.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.461 ' O ' HD13 ' A' ' 39' ' ' LEU . 2.8 m-20 -54.22 -52.8 60.15 Favored 'General case' 0 N--CA 1.467 0.422 0 O-C-N 123.084 0.24 . . . . 0.58999999999999997 110.959 -176.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.649 ' HB3' ' OD2' ' A' ' 34' ' ' ASP . 8.7 ttp180 -45.25 -45.51 11.95 Favored 'General case' 0 C--N 1.327 -0.394 0 O-C-N 123.763 0.664 . . . . 3.6600000000000001 111.536 177.403 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 22.0 tpt85 -65.21 -42.88 93.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.803 -0.635 . . . . 2.2999999999999998 111.476 -178.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.572 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -79.91 -24.9 40.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.723 0.297 . . . . 0.19 111.377 -177.545 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.461 HD13 ' O ' ' A' ' 35' ' ' ASP . 2.2 mp -62.15 -36.37 81.6 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.339 -0.392 . . . . 1.77 111.328 178.506 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.59 -26.26 66.83 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.062 -0.517 . . . . 0.29999999999999999 111.051 178.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.592 HD13 HG12 ' A' ' 62' ' ' ILE . 5.9 mt -64.88 -30.51 71.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.008 0.432 . . . . 0.20000000000000001 110.98 176.165 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.61 HD21 HD11 ' A' ' 62' ' ' ILE . 0.4 OUTLIER -105.36 12.86 31.16 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.139 -0.482 . . . . 0.22 110.271 -177.713 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 7.1 p80 -47.3 -29.83 2.73 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.5 0.926 . . . . 0.55000000000000004 113.5 -173.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -104.2 11.25 35.22 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.246 0.461 . . . . 0.59999999999999998 112.246 -174.23 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 80.0 mt -97.08 -53.03 0.21 Allowed Pre-proline 0 C--N 1.323 -0.573 0 N-CA-C 113.591 0.96 . . . . 0.82999999999999996 113.591 -176.353 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.518 ' HB3' HG12 ' A' ' 22' ' ' VAL . 77.6 Cg_endo -75.9 175.59 11.12 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 121.428 1.418 . . . . 0.33000000000000002 113.023 -168.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.406 ' O ' HG21 ' A' ' 9' ' ' VAL . . . 89.18 -6.78 83.26 Favored Glycine 0 N--CA 1.445 -0.712 0 N-CA-C 110.629 -0.989 . . . . 0.31 110.629 -172.003 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -124.75 175.48 7.21 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.979 -0.611 . . . . 1.46 109.72 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -100.59 96.36 7.31 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.402 0.62 . . . . 1.1200000000000001 109.83 176.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.445 HD23 ' CG2' ' A' ' 22' ' ' VAL . 2.7 mm? -84.42 134.55 34.46 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.016 -0.993 . . . . 0.38 110.231 -174.5 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.591 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 8.5 p30 -85.03 171.37 12.13 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.727 -0.472 . . . . 1.3899999999999999 109.727 177.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.524 ' HA ' HD12 ' A' ' 55' ' ' LEU . 4.0 mm? -48.8 -45.17 39.87 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.512 0.56 . . . . 0.92000000000000004 112.512 -175.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.567 ' HA ' ' NE2' ' A' ' 56' ' ' HIS . 69.1 m -57.46 -46.0 84.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.622 0.249 . . . . 0.68999999999999995 110.929 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.405 ' NE2' HD12 ' A' ' 50' ' ' LEU . 55.2 mt-30 -66.42 -32.64 74.14 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.982 0.42 . . . . 1.74 110.522 179.546 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.591 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 79.7 mt -62.67 -55.58 25.57 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.766 -0.652 . . . . 1.1499999999999999 111.279 -178.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.567 ' NE2' ' HA ' ' A' ' 53' ' ' SER . 34.0 p80 -74.76 -23.42 58.53 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.324 -0.55 . . . . 2.8300000000000001 111.184 -178.094 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.14 -31.97 70.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.184 0.516 . . . . 0.31 110.192 173.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.33 -45.57 92.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.624 -0.716 . . . . 0.20999999999999999 110.477 175.265 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.48 -34.99 78.98 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.662 -0.699 . . . . 0.14000000000000001 110.82 179.041 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.3 -42.51 99.42 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.872 -0.604 . . . . 0.17000000000000001 110.93 178.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 77.2 mtt180 -54.19 -40.9 67.98 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 121.183 0.516 . . . . 0.35999999999999999 110.642 177.153 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.61 HD11 HD21 ' A' ' 42' ' ' LEU . 67.4 mt -78.45 -37.5 21.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.53 -0.759 . . . . 0.16 110.579 -176.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.458 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -60.32 -42.11 98.68 Favored Glycine 0 N--CA 1.442 -0.913 0 CA-C-N 115.651 -0.704 . . . . 0.22 111.89 177.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -75.98 -26.48 56.82 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.54 0.209 . . . . 2.1699999999999999 110.551 177.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -59.97 -50.33 74.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.936 0.398 . . . . 0.20999999999999999 110.277 178.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . 0.444 ' HB3' ' HB2' ' A' ' 71' ' ' TYR . 10.3 m-85 -58.58 -44.97 89.98 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.729 -0.669 . . . . 0.20999999999999999 110.453 176.193 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . 0.458 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 79.7 mt-30 -59.97 -38.06 81.44 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.966 -0.561 . . . . 1.21 111.218 -179.758 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -69.42 -26.59 64.69 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.152 -0.477 . . . . 1.6799999999999999 110.632 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -88.97 4.78 46.98 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.004 -0.544 . . . . 0.56999999999999995 110.932 178.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 106.32 -14.96 43.22 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.819 -0.705 . . . . 0.31 112.881 176.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . 0.444 ' HB2' ' HB3' ' A' ' 66' ' ' TYR . 80.5 m-85 -82.3 71.56 9.36 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.191 0.52 . . . . 0.39000000000000001 110.186 -178.448 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 40.5 t -67.77 -28.69 42.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.629 -0.714 . . . . 0.40999999999999998 110.992 -176.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 43.4 tp -78.84 -8.93 59.26 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.038 -0.528 . . . . 1.76 110.908 -179.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -93.15 141.07 28.82 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.076 0.465 . . . . 0.37 111.241 -177.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 30.3 tpt180 -151.28 131.5 13.6 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.959 -0.564 . . . . 1.8 109.603 177.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -98.22 138.16 35.9 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.378 -0.374 . . . . 0.17999999999999999 110.203 178.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 49.0 p90 -135.78 142.59 44.95 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.415 -0.357 . . . . 0.38 110.053 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.8 tt -95.79 115.42 65.51 Favored Pre-proline 0 C--N 1.318 -0.784 0 N-CA-C 109.211 -0.663 . . . . 0.39000000000000001 109.211 179.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.403 ' HD2' ' O ' ' A' ' 89' ' ' ARG . 55.7 Cg_endo -70.57 93.23 0.59 Allowed 'Trans proline' 0 N--CA 1.462 -0.374 0 C-N-CA 122.39 2.06 . . . . 1.1200000000000001 111.796 178.315 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -89.46 63.65 6.44 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.254 -0.43 . . . . 2.0 110.884 -178.138 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -97.77 -33.46 11.26 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.933 -0.576 . . . . 3.7200000000000002 110.007 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -149.31 -62.12 0.22 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.359 -0.837 . . . . 3.7599999999999998 109.704 -177.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 50.3 mt 66.39 106.37 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.297 0 CA-C-N 115.56 -0.745 . . . . 1.23 112.387 178.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.482 ' H ' ' CD ' ' A' ' 84' ' ' GLN . 4.1 pm0 -61.0 140.8 57.74 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.745 -0.661 . . . . 1.5600000000000001 109.678 171.086 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -77.57 140.63 39.73 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.993 -0.373 . . . . 1.54 109.993 -178.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 102.16 -45.32 1.38 Allowed Glycine 0 N--CA 1.446 -0.688 0 C-N-CA 120.836 -0.697 . . . . 0.57999999999999996 112.077 -178.086 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 25.8 m -127.04 121.67 32.23 Favored 'General case' 0 C--N 1.322 -0.595 0 O-C-N 122.692 -0.299 . . . . 0.46999999999999997 110.717 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 31.7 m -102.84 131.66 50.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 N-CA-C 109.716 -0.476 . . . . 0.31 109.716 175.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.489 ' HA ' ' O ' ' A' ' 26' ' ' GLN . 51.8 ttt180 -110.52 130.87 55.46 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.268 0.556 . . . . 2.9199999999999999 110.901 -177.316 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.421 ' HB ' HD13 ' A' ' 27' ' ' LEU . 67.2 mt -110.86 134.34 53.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.046 -0.979 . . . . 0.23000000000000001 109.868 -179.249 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -94.14 123.75 37.72 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.342 0.591 . . . . 1.3300000000000001 110.13 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 57.9 t -98.63 110.6 26.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 115.367 -0.833 . . . . 0.27000000000000002 110.501 -176.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 56.2 tp -94.35 95.13 8.69 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.356 -0.609 . . . . 0.35999999999999999 109.356 176.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 55.7 mt-10 -78.56 -9.9 59.52 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.895 -0.593 . . . . 0.48999999999999999 110.816 -176.526 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.934 -0.926 . . . . 1.3899999999999999 111.723 178.189 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.8 ptt? . . . . . 0 N--CA 1.48 1.058 0 CA-C-O 120.56 0.219 . . . . 15.85 111.157 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -93.02 -20.57 20.43 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.085 0.469 . . . . 12.76 110.899 -179.108 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -80.83 80.37 7.31 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.839 -0.619 . . . . 13.359999999999999 109.561 178.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 49.7 m80 69.74 169.18 0.3 Allowed 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.226 -0.897 . . . . 10.710000000000001 111.064 -176.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 62.9 m80 -135.81 58.59 1.74 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.748 -0.66 . . . . 9.0399999999999991 109.458 179.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 25.5 p80 -103.86 31.76 4.3 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.361 -0.836 . . . . 9.7899999999999991 111.581 -172.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 28.8 m170 -75.25 63.04 1.31 Allowed 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 121.257 0.551 . . . . 7.4100000000000001 110.521 176.023 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 41.2 m80 -141.76 84.78 1.91 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.993 -0.743 . . . . 6.4400000000000004 108.993 -178.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.434 ' HB ' ' HG2' ' A' ' 48' ' ' GLN . 45.2 t -72.07 100.74 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 116.056 -0.52 . . . . 1.97 111.317 -174.53 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -95.64 12.91 28.05 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.681 -0.69 . . . . 4.2000000000000002 109.907 176.028 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -87.59 2.09 51.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.798 -0.637 . . . . 4.3300000000000001 111.126 -178.298 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -88.33 108.89 19.57 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.999 0.428 . . . . 4.3700000000000001 109.986 177.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -76.98 170.33 16.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.737 -0.665 . . . . 5.3600000000000003 112.107 -172.258 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.53 ' HB3' HG23 ' A' ' 19' ' ' THR . 1.6 pptp? -145.44 156.07 43.52 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.35 -0.841 . . . . 3.4199999999999999 110.33 178.442 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 26.1 ttt -139.1 -52.7 0.56 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.472 -0.331 . . . . 4.4299999999999997 110.535 179.164 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -66.22 -42.56 94.18 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.753 -0.737 . . . . 3.4100000000000001 112.096 178.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -158.97 150.37 20.92 Favored Glycine 0 N--CA 1.447 -0.592 0 C-N-CA 120.839 -0.696 . . . . 2.0899999999999999 111.73 178.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -55.05 139.15 79.94 Favored 'Trans proline' 0 C--O 1.235 0.344 0 C-N-CA 123.336 2.691 . . . . 1.1599999999999999 113.234 179.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.53 HG23 ' HB3' ' A' ' 14' ' ' LYS . 3.3 p -87.79 153.91 20.97 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.711 -0.677 . . . . 0.72999999999999998 110.599 179.295 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 60.3 t -114.56 125.53 71.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.768 0.318 . . . . 0.52000000000000002 110.555 178.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.453 ' HA ' ' HA ' ' A' ' 49' ' ' GLU . 51.8 tp -69.46 101.37 1.56 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.047 0.451 . . . . 0.91000000000000003 110.478 177.427 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.554 HG12 ' HB3' ' A' ' 46' ' ' PRO . 60.8 t -80.68 126.54 39.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.704 -0.68 . . . . 0.31 110.172 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -108.52 -35.49 6.46 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.98 -0.555 . . . . 1.1599999999999999 110.289 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 12.6 ptp180 -155.11 160.96 41.36 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.231 -0.44 . . . . 2.1600000000000001 111.016 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.561 ' CE2' ' HG ' ' A' ' 42' ' ' LEU . 40.7 m-85 -114.78 141.02 48.42 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.735 -0.666 . . . . 0.34999999999999998 110.228 178.569 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 29.9 tp60 -129.08 127.56 41.76 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.355 -0.609 . . . . 1.3700000000000001 109.355 179.215 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.435 HD13 ' HB ' ' A' ' 90' ' ' ILE . 3.5 mm? -101.93 136.53 41.61 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.113 0.483 . . . . 0.25 109.8 -178.578 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.493 ' O ' ' HA ' ' A' ' 91' ' ' GLU . 74.1 m -132.16 131.25 42.07 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.757 -0.656 . . . . 0.94999999999999996 110.414 179.626 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 99.18 -11.71 61.96 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.764 -0.732 . . . . 0.20999999999999999 111.803 -177.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 17.3 p-10 -77.88 131.97 37.75 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.975 0.417 . . . . 0.44 110.58 179.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 28.5 mmm180 -126.23 -38.37 2.15 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.133 -0.485 . . . . 2.48 110.252 179.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 49.3 tp60 -68.5 -44.61 74.32 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.046 -0.524 . . . . 1.9099999999999999 110.67 -177.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.435 ' HD2' ' CZ ' ' A' ' 66' ' ' TYR . 83.1 m-85 -122.98 136.19 54.76 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.016 -0.538 . . . . 0.25 109.69 179.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -82.48 175.72 9.98 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.027 -0.533 . . . . 0.62 111.046 -175.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.434 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 72.5 m-20 -54.73 -48.8 72.08 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 116.222 -0.444 . . . . 0.58999999999999997 111.296 -177.489 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -62.34 -25.69 68.03 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.193 -0.458 . . . . 3.6600000000000001 111.319 -174.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.2 tpt180 -79.89 -36.35 36.65 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.874 -0.603 . . . . 2.2999999999999998 110.718 179.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.483 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -87.45 -34.35 18.74 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.053 0.39 . . . . 0.19 112.053 -176.456 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 35' ' ' ASP . 4.1 pp -67.0 -18.15 65.25 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 120.917 -0.313 . . . . 1.77 110.896 -179.065 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.49 -23.44 66.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.061 0.458 . . . . 0.29999999999999999 110.37 176.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.609 HD13 HG12 ' A' ' 62' ' ' ILE . 2.4 mt -70.46 -23.09 62.64 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.871 -0.604 . . . . 0.20000000000000001 110.45 175.636 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.614 HD21 HD11 ' A' ' 62' ' ' ILE . 0.7 OUTLIER -110.21 13.79 22.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.859 -0.61 . . . . 0.22 110.116 -179.444 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.9 p80 -56.19 -25.34 46.53 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.451 0.537 . . . . 0.55000000000000004 112.451 -172.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -103.57 9.57 37.4 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.659 0.266 . . . . 0.59999999999999998 111.152 -176.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.447 HD12 ' HA ' ' A' ' 45' ' ' LEU . 10.5 tp -97.52 -55.75 0.19 Allowed Pre-proline 0 C--N 1.32 -0.689 0 N-CA-C 113.792 1.034 . . . . 0.82999999999999996 113.792 -169.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.554 ' HB3' HG12 ' A' ' 22' ' ' VAL . 82.7 Cg_endo -76.03 172.83 15.54 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 121.567 1.512 . . . . 0.33000000000000002 112.825 -170.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.26 -0.67 64.01 Favored Glycine 0 N--CA 1.445 -0.728 0 N-CA-C 110.435 -1.066 . . . . 0.31 110.435 -172.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.434 ' HG2' ' HB ' ' A' ' 9' ' ' VAL . 53.6 mt-30 -131.33 174.62 9.88 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.954 -0.623 . . . . 1.46 109.621 178.301 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.453 ' HA ' ' HA ' ' A' ' 21' ' ' LEU . 37.4 mt-10 -95.58 95.56 8.46 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.385 0.612 . . . . 1.1200000000000001 110.178 175.572 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -85.39 136.12 33.59 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.256 -0.884 . . . . 0.38 109.408 178.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.8 t-20 -80.39 156.47 26.67 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.452 -0.573 . . . . 1.3899999999999999 109.452 178.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -49.76 -43.1 47.89 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 117.945 0.338 . . . . 0.92000000000000004 111.738 -175.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 11.2 m -52.25 -45.03 65.21 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.092 0.472 . . . . 0.68999999999999995 110.659 175.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -68.3 -39.2 82.11 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.629 -0.714 . . . . 1.74 111.152 179.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.65 ' HB3' HD13 ' A' ' 78' ' ' LEU . 10.9 mp -56.85 -46.99 81.4 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-O 120.719 0.295 . . . . 1.1499999999999999 111.265 173.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 80.8 m-70 -65.95 -34.82 79.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.883 0.373 . . . . 2.8300000000000001 110.451 178.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.7 -27.84 67.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.178 -0.464 . . . . 0.31 110.962 178.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.0 -38.49 91.28 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.193 0.521 . . . . 0.20999999999999999 110.233 175.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.18 -30.85 71.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.596 -0.729 . . . . 0.14000000000000001 110.546 177.427 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -66.16 -36.72 83.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.965 -0.562 . . . . 0.17000000000000001 110.895 179.056 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 80.7 mtt180 -55.35 -42.06 73.36 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.299 0.571 . . . . 0.35999999999999999 110.001 175.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.614 HD11 HD21 ' A' ' 42' ' ' LEU . 66.0 mt -77.91 -35.17 20.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.111 -0.949 . . . . 0.16 111.151 -175.626 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.626 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -58.89 -49.59 76.49 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.376 -0.916 . . . . 0.22 111.624 176.471 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -66.45 -28.32 68.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.541 0.21 . . . . 2.1699999999999999 110.957 178.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.543 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 87.7 t80 -58.99 -50.38 74.29 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.019 0.437 . . . . 0.20999999999999999 110.183 177.022 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . 0.435 ' CZ ' ' HD2' ' A' ' 33' ' ' PHE . 8.6 m-85 -61.66 -44.46 96.93 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.651 -0.704 . . . . 0.20999999999999999 110.964 177.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . 0.626 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 42.0 mt-30 -61.16 -35.49 77.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.11 -0.496 . . . . 1.21 111.033 -178.621 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -64.49 -35.66 81.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.219 0.533 . . . . 1.6799999999999999 110.589 176.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.543 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 69.6 mmtt -79.16 -4.12 48.91 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.982 -0.554 . . . . 0.56999999999999995 110.829 -177.284 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.67 -6.99 27.94 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.953 -0.642 . . . . 0.31 112.302 179.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . 0.419 ' HB2' ' HB3' ' A' ' 66' ' ' TYR . 43.3 m-85 -92.37 65.78 4.59 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.324 -0.621 . . . . 0.39000000000000001 109.324 179.515 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 43.8 t -66.0 -28.1 42.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.699 -0.682 . . . . 0.40999999999999998 110.836 -175.52 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 55.6 tp -73.66 -25.32 60.21 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.832 -0.622 . . . . 1.76 110.349 178.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -79.68 131.64 36.01 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.824 -0.626 . . . . 0.37 111.438 -175.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 20.5 mmm180 -140.37 155.13 46.88 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.645 -0.707 . . . . 1.8 109.918 176.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -113.51 135.05 54.32 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.954 -0.566 . . . . 0.17999999999999999 109.754 178.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 47.4 p90 -130.33 149.71 51.89 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.511 -0.551 . . . . 0.38 109.511 179.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.65 HD13 ' HB3' ' A' ' 55' ' ' LEU . 7.5 tt -106.24 108.43 61.73 Favored Pre-proline 0 C--N 1.316 -0.88 0 N-CA-C 110.018 -0.364 . . . . 0.39000000000000001 110.018 -178.008 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' A' ' 78' ' ' LEU . 18.0 Cg_endo -59.8 105.81 0.29 Allowed 'Trans proline' 0 C--O 1.233 0.271 0 C-N-CA 122.891 2.394 . . . . 1.1200000000000001 112.163 176.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.89 160.54 29.81 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.89 -0.596 . . . . 2.0 110.83 -179.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 64.06 13.05 7.44 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 123.502 0.501 . . . . 3.7200000000000002 111.51 -178.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -133.56 33.36 3.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 122.176 0.989 . . . . 3.7599999999999998 108.561 178.157 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 53.5 mt -108.58 149.52 11.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 114.595 -1.184 . . . . 1.23 110.615 -174.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 14.6 mp0 -102.67 161.4 13.76 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.156 -0.683 . . . . 1.5600000000000001 109.156 177.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -75.95 63.32 1.72 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.949 0.88 . . . . 1.54 111.361 -173.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 147.48 -35.76 1.21 Allowed Glycine 0 N--CA 1.444 -0.832 0 CA-C-N 115.206 -0.906 . . . . 0.57999999999999996 111.436 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 25.0 m -102.31 122.29 43.96 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 120.814 0.34 . . . . 0.46999999999999997 110.211 178.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 33.2 m -108.21 128.07 63.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 109.918 -0.401 . . . . 0.31 109.918 176.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 14.3 ttt180 -103.94 114.29 28.44 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 120.494 -0.482 . . . . 2.9199999999999999 110.43 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.435 ' HB ' HD13 ' A' ' 27' ' ' LEU . 49.1 mt -103.56 131.43 52.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 115.888 -0.596 . . . . 0.23000000000000001 109.772 178.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.493 ' HA ' ' O ' ' A' ' 28' ' ' SER . 38.6 mt-10 -96.75 125.95 41.57 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.36 0.6 . . . . 1.3300000000000001 110.591 -179.028 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 57.8 t -98.76 111.43 28.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 115.435 -0.802 . . . . 0.27000000000000002 110.215 -178.246 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 30.9 tp -94.63 89.02 5.61 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.076 -0.713 . . . . 0.35999999999999999 109.076 178.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 57.6 mt-10 -67.22 -15.67 63.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.508 -0.769 . . . . 0.48999999999999999 111.725 -174.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.964 0 CA-C-O 118.929 -0.928 . . . . 1.3899999999999999 111.764 178.904 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 mmt . . . . . 0 N--CA 1.482 1.168 0 CA-C-O 120.631 0.253 . . . . 15.85 110.809 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -79.43 -66.58 0.85 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.429 -0.35 . . . . 12.76 111.078 -178.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 60.2 m170 -65.22 -61.65 2.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.959 0.409 . . . . 13.359999999999999 110.202 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 31.3 m170 -83.22 90.72 7.14 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.283 -0.636 . . . . 10.710000000000001 109.283 173.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 61.2 t60 -106.23 -44.26 4.59 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.671 -0.695 . . . . 9.0399999999999991 109.936 -179.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 64.0 m80 -74.19 108.59 7.09 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.814 -0.63 . . . . 9.7899999999999991 110.281 177.179 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 53.4 m80 -65.58 117.27 7.81 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.775 -0.648 . . . . 7.4100000000000001 109.981 179.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 33.3 p-80 -126.84 47.44 2.32 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.569 0.7 . . . . 6.4400000000000004 110.189 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.425 HG11 ' HG2' ' A' ' 48' ' ' GLN . 58.1 t -112.92 132.11 62.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.366 -0.834 . . . . 1.97 109.573 177.378 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -111.4 129.26 56.07 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.073 0.464 . . . . 4.2000000000000002 111.074 -176.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -90.53 -26.35 19.79 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.496 -0.928 . . . . 4.3300000000000001 108.496 172.291 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 19.1 t70 48.89 79.14 0.08 Allowed 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 114.606 -1.179 . . . . 4.3700000000000001 112.194 171.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 38.5 t70 64.56 102.67 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.675 -0.693 . . . . 5.3600000000000003 110.801 -178.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.543 ' HD2' ' O ' ' A' ' 14' ' ' LYS . 0.0 OUTLIER -53.9 115.3 1.94 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.753 -0.658 . . . . 3.4199999999999999 111.608 -179.394 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 27.8 ttt -119.75 126.87 52.11 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.849 -0.614 . . . . 4.4299999999999997 109.43 177.093 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 94.3 31.34 8.04 Favored Glycine 0 N--CA 1.447 -0.63 0 N-CA-C 110.659 -0.976 . . . . 3.4100000000000001 110.659 -174.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 99.39 163.57 29.47 Favored Glycine 0 N--CA 1.444 -0.823 0 N-CA-C 111.226 -0.75 . . . . 2.0899999999999999 111.226 -176.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -58.64 132.35 47.65 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.571 2.181 . . . . 1.1599999999999999 111.713 177.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 11.4 p -81.94 140.02 34.28 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.344 0.592 . . . . 0.72999999999999998 111.218 -176.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 21.8 t -118.19 125.0 73.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-N 115.587 -0.733 . . . . 0.52000000000000002 109.846 179.206 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -71.72 126.76 30.55 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.028 -0.73 . . . . 0.91000000000000003 109.028 175.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.487 HG12 ' HB3' ' A' ' 46' ' ' PRO . 63.9 t -108.36 116.89 52.69 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 CA-C-N 115.909 -0.587 . . . . 0.31 110.498 -176.138 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 84.6 mttt -97.85 -26.17 14.78 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.335 -0.848 . . . . 1.1599999999999999 109.382 178.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 4.3 ptp180 -168.05 161.9 12.89 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.839 -0.619 . . . . 2.1600000000000001 110.685 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.577 ' CE2' ' HG ' ' A' ' 42' ' ' LEU . 26.7 m-85 -110.91 137.14 48.92 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.696 -0.684 . . . . 0.34999999999999998 109.731 178.033 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.409 ' O ' ' HA ' ' A' ' 89' ' ' ARG . 7.2 tp-100 -114.72 129.18 56.65 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 109.544 -0.539 . . . . 1.3700000000000001 109.544 177.282 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.441 ' HG ' HD23 ' A' ' 38' ' ' LEU . 3.9 mm? -103.7 127.29 51.18 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.007 0.432 . . . . 0.25 110.098 -178.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.0 t -115.08 119.47 36.56 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.938 -0.574 . . . . 0.94999999999999996 110.164 -178.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 99.27 0.63 56.97 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.756 -0.735 . . . . 0.20999999999999999 112.758 178.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 20.0 p-10 -81.23 124.29 29.17 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.361 0.6 . . . . 0.44 111.259 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' ' 31' ' ' ARG . 15.3 mmm180 -128.22 -34.03 2.12 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.782 -0.645 . . . . 2.48 110.575 177.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -69.35 -32.68 71.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.108 -0.497 . . . . 1.9099999999999999 110.543 179.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 -136.94 141.68 42.66 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.406 -0.59 . . . . 0.25 109.406 175.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -81.06 169.7 17.13 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.433 -0.349 . . . . 0.62 110.721 -178.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.507 ' O ' HD13 ' A' ' 39' ' ' LEU . 1.0 OUTLIER -55.4 -54.99 36.79 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-N 116.455 -0.339 . . . . 0.58999999999999997 111.344 -176.048 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.512 ' HA ' HD22 ' A' ' 39' ' ' LEU . 62.8 ttt180 -58.69 -32.79 69.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.764 0.316 . . . . 3.6600000000000001 110.853 -175.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 20.2 tpt180 -64.59 -42.94 95.26 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.212 -0.449 . . . . 2.2999999999999998 110.575 176.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.505 ' HA ' HD12 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -78.79 -26.14 44.36 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.91 0.386 . . . . 0.19 110.916 179.651 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.512 HD22 ' HA ' ' A' ' 36' ' ' ARG . 1.4 mp -60.3 -31.47 70.29 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.145 -0.48 . . . . 1.77 111.116 177.668 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.73 -24.06 65.41 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.903 -0.59 . . . . 0.29999999999999999 111.403 176.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.512 HD13 HG12 ' A' ' 62' ' ' ILE . 3.8 mt -74.69 -24.49 58.78 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.123 0.487 . . . . 0.20000000000000001 110.513 176.366 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.671 HD21 HD11 ' A' ' 62' ' ' ILE . 0.4 OUTLIER -107.67 14.27 25.79 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.989 -0.551 . . . . 0.22 110.12 -179.041 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 8.1 p80 -53.9 -19.94 5.29 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 113.161 0.8 . . . . 0.55000000000000004 113.161 -171.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -110.65 11.0 22.85 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.082 0.401 . . . . 0.59999999999999998 112.082 -175.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 84.8 mt -100.31 -54.72 0.16 Allowed Pre-proline 0 CA--C 1.539 0.519 0 N-CA-C 113.823 1.046 . . . . 0.82999999999999996 113.823 -174.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.487 ' HB3' HG12 ' A' ' 22' ' ' VAL . 41.3 Cg_endo -69.92 165.82 29.88 Favored 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 121.345 1.363 . . . . 0.33000000000000002 112.788 -170.384 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.26 -24.26 29.75 Favored Glycine 0 N--CA 1.447 -0.567 0 N-CA-C 110.711 -0.955 . . . . 0.31 110.711 -171.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.425 ' HG2' HG11 ' A' ' 9' ' ' VAL . 79.8 mt-30 -109.08 169.79 8.46 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.284 -0.458 . . . . 1.46 110.165 175.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -97.93 110.74 23.25 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.705 -0.68 . . . . 1.1200000000000001 109.894 177.189 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.411 HD23 ' CG2' ' A' ' 22' ' ' VAL . 2.9 mm? -96.85 140.74 30.96 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.293 -0.867 . . . . 0.38 110.402 -174.13 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.67 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 36.1 p30 -85.44 171.34 11.88 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.938 -0.394 . . . . 1.3899999999999999 109.938 177.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.475 ' HA ' HD12 ' A' ' 55' ' ' LEU . 3.8 mm? -50.69 -45.01 58.08 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.515 0.197 . . . . 0.92000000000000004 111.521 -178.506 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.463 ' HA ' ' NE2' ' A' ' 56' ' ' HIS . 22.5 m -55.42 -51.1 67.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.327 -0.397 . . . . 0.68999999999999995 111.069 179.3 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -67.28 -30.83 70.8 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.111 -0.495 . . . . 1.74 111.185 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.67 ' HG ' ' O ' ' A' ' 51' ' ' ASN . 84.3 mt -60.78 -55.03 38.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.404 -0.362 . . . . 1.1499999999999999 111.027 178.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.463 ' NE2' ' HA ' ' A' ' 53' ' ' SER . 34.8 p80 -75.88 -22.91 55.66 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.493 -0.483 . . . . 2.8300000000000001 111.183 -178.125 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.32 -33.31 72.21 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.132 0.492 . . . . 0.31 110.403 174.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.86 -39.7 90.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.676 -0.693 . . . . 0.20999999999999999 110.662 176.345 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.48 -34.99 78.3 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.802 -0.635 . . . . 0.14000000000000001 110.729 179.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.06 -39.19 94.0 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.873 -0.603 . . . . 0.17000000000000001 110.962 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 80.6 mtt180 -55.45 -42.59 74.46 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.266 0.555 . . . . 0.35999999999999999 110.334 176.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.671 HD11 HD21 ' A' ' 42' ' ' LEU . 72.6 mt -78.34 -37.52 21.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.533 -0.758 . . . . 0.16 110.699 -176.238 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.657 ' O ' ' HG3' ' A' ' 67' ' ' GLN . . . -59.1 -45.36 95.41 Favored Glycine 0 N--CA 1.442 -0.929 0 C-N-CA 120.67 -0.776 . . . . 0.22 111.645 176.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -68.25 -33.41 74.34 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.818 0.342 . . . . 2.1699999999999999 110.52 178.2 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.458 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 90.4 t80 -57.27 -51.32 69.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.889 -0.596 . . . . 0.20999999999999999 110.628 178.231 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -59.61 -41.42 90.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.97 -0.559 . . . . 0.20999999999999999 111.157 178.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . 0.657 ' HG3' ' O ' ' A' ' 63' ' ' GLY . 21.2 mt-30 -58.73 -44.8 90.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.034 -0.53 . . . . 1.21 111.087 -178.146 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -70.44 -17.27 62.99 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.84 0.352 . . . . 1.6799999999999999 111.339 -179.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.458 ' HG2' ' O ' ' A' ' 65' ' ' PHE . 75.5 mmtt -91.2 4.89 51.1 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.802 0.334 . . . . 0.56999999999999995 110.642 179.704 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 102.61 -11.54 56.47 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.769 -0.729 . . . . 0.31 112.489 176.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -89.72 74.24 7.53 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.426 0.631 . . . . 0.39000000000000001 109.387 -179.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 28.7 t -74.34 -25.77 19.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.434 -0.803 . . . . 0.40999999999999998 111.091 -174.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 60.8 tp -78.19 -16.77 57.56 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.134 0.492 . . . . 1.76 110.029 176.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.512 ' HA ' ' O ' ' A' ' 93' ' ' LEU . . . -82.7 137.3 34.48 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.957 -0.565 . . . . 0.37 111.504 -178.286 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 21.5 tpt180 -152.12 132.6 13.81 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.7 -0.682 . . . . 1.8 109.602 176.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -95.81 135.13 37.94 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 110.288 -0.264 . . . . 0.17999999999999999 110.288 178.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 51.0 p90 -135.36 149.39 49.68 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.86 0.362 . . . . 0.38 110.27 179.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.5 tt -104.21 118.4 56.99 Favored Pre-proline 0 C--N 1.318 -0.791 0 N-CA-C 108.997 -0.742 . . . . 0.39000000000000001 108.997 178.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -69.14 80.89 0.68 Allowed 'Trans proline' 0 C--O 1.234 0.292 0 C-N-CA 122.654 2.236 . . . . 1.1200000000000001 112.095 179.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.58 119.63 13.33 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.005 -0.543 . . . . 2.0 110.853 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.505 ' OE1' ' HA ' ' A' ' 81' ' ' GLN . 6.3 tp60 -171.13 -51.79 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.035 -0.529 . . . . 3.7200000000000002 110.252 -179.508 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -132.17 -64.04 0.79 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.606 -0.725 . . . . 3.7599999999999998 109.592 178.497 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 65.3 mt 67.17 136.4 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-N 115.574 -0.739 . . . . 1.23 111.724 -178.38 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.415 ' NE2' ' H ' ' A' ' 84' ' ' GLN . 0.7 OUTLIER -72.19 114.57 10.45 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.085 -0.709 . . . . 1.5600000000000001 109.085 176.772 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -62.29 107.25 0.87 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.756 0.788 . . . . 1.54 110.044 -178.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 124.03 -40.72 1.88 Allowed Glycine 0 N--CA 1.445 -0.703 0 CA-C-N 115.423 -0.808 . . . . 0.57999999999999996 111.599 -175.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 87.0 m -128.86 119.76 25.03 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.904 0.383 . . . . 0.46999999999999997 110.397 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 32.6 m -95.91 132.97 38.74 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 N-CA-C 109.676 -0.49 . . . . 0.31 109.676 178.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.409 ' HA ' ' O ' ' A' ' 26' ' ' GLN . 34.4 ttp180 -111.34 117.32 32.8 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.287 0.565 . . . . 2.9199999999999999 110.707 -177.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.415 ' HB ' HD13 ' A' ' 27' ' ' LEU . 71.9 mt -100.98 131.47 48.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 115.223 -0.899 . . . . 0.23000000000000001 109.669 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -94.21 117.95 30.86 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.371 0.605 . . . . 1.3300000000000001 110.068 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 55.4 t -92.85 109.57 21.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 115.426 -0.806 . . . . 0.27000000000000002 110.263 -177.349 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.512 ' O ' ' HA ' ' A' ' 74' ' ' ALA . 57.5 tp -89.9 90.72 8.3 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.47 -0.567 . . . . 0.35999999999999999 109.47 176.589 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -77.79 -12.32 59.96 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.203 0.525 . . . . 0.48999999999999999 110.465 -178.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.232 0 CA-C-O 118.279 -1.289 . . . . 1.3899999999999999 111.22 178.277 . . . . . . . . 0 0 . 1 stop_ save_