data_1bmx_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 1bmx _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.4 mmp_? . . . . . 0 CA--C 1.575 1.907 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -85.87 -7.55 58.63 Favored 'General case' 0 CA--C 1.582 2.183 0 O-C-N 119.513 -1.992 . . . . 0.0 114.698 145.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -79.86 -56.91 3.93 Favored 'General case' 0 CA--C 1.559 1.326 0 O-C-N 120.474 -1.391 . . . . 0.0 109.17 160.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 2.8 p -46.94 -42.06 5.88 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.448 0 N-CA-C 118.037 2.606 . . . . 0.0 118.037 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -74.42 -44.05 53.57 Favored 'General case' 0 CA--C 1.587 2.392 0 CA-C-O 124.542 2.115 . . . . 0.0 112.037 -166.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.295 21.1 ttp180 -55.18 -46.8 75.82 Favored 'General case' 0 CA--C 1.559 1.325 0 C-N-CA 129.584 3.154 . . . . 0.0 117.5 157.614 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -57.36 -41.61 80.47 Favored 'General case' 0 CA--C 1.574 1.868 0 N-CA-C 114.201 1.186 . . . . 0.0 114.201 163.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 27.3 t80 -72.49 -36.16 68.34 Favored 'General case' 0 CA--C 1.557 1.235 0 N-CA-C 115.201 1.556 . . . . 0.0 115.201 177.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 38.7 tptt -78.64 -19.77 51.85 Favored 'General case' 0 CA--C 1.568 1.672 0 CA-C-N 121.978 2.172 . . . . 0.0 115.097 163.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 53.0 m -64.72 -50.16 68.02 Favored 'General case' 0 N--CA 1.496 1.845 0 CA-C-N 121.196 1.817 . . . . 0.0 112.398 161.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.2 tt -63.25 -36.35 83.36 Favored 'General case' 0 CA--C 1.568 1.648 0 CA-C-N 120.124 1.329 . . . . 0.0 114.127 165.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 16.8 mmt85 -83.55 31.52 0.47 Allowed 'General case' 0 CA--C 1.577 1.984 0 CA-C-N 121.911 2.141 . . . . 0.0 114.627 160.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -119.42 -23.86 6.52 Favored 'General case' 0 CA--C 1.569 1.704 0 C-N-CA 125.742 1.617 . . . . 0.0 114.803 138.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -59.57 -43.74 93.52 Favored 'General case' 0 CA--C 1.571 1.781 0 CA-C-N 122.332 2.333 . . . . 0.0 112.911 163.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 . . . . . 0 CA--C 1.571 1.783 0 C-N-CA 123.664 0.786 . . . . 0.0 112.835 170.42 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.575 1.932 0 N-CA-C 115.784 1.772 . . . . 0.0 115.784 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -84.15 -7.76 59.27 Favored 'General case' 0 CA--C 1.576 1.981 0 CA-C-N 121.709 2.05 . . . . 0.0 115.628 150.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -83.26 -54.55 4.92 Favored 'General case' 0 CA--C 1.559 1.32 0 CA-C-O 117.398 -1.287 . . . . 0.0 108.816 162.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 2.9 p -50.85 -43.92 25.79 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.254 0 N-CA-C 117.731 2.493 . . . . 0.0 117.731 -179.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -75.59 -35.6 60.53 Favored 'General case' 0 CA--C 1.59 2.493 0 CA-C-O 123.541 1.639 . . . . 0.0 112.22 -170.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.293 9.9 ttp180 -64.63 -41.06 96.42 Favored 'General case' 0 CA--C 1.566 1.582 0 C-N-CA 129.095 2.958 . . . . 0.0 116.751 161.683 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -58.67 -42.26 88.06 Favored 'General case' 0 CA--C 1.574 1.892 0 C-N-CA 124.691 1.196 . . . . 0.0 114.131 160.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 43.2 t80 -70.98 -34.32 71.28 Favored 'General case' 0 CA--C 1.563 1.451 0 N-CA-C 115.752 1.76 . . . . 0.0 115.752 175.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.0 tppt? -78.76 -21.12 48.42 Favored 'General case' 0 CA--C 1.567 1.599 0 CA-C-N 121.315 1.87 . . . . 0.0 114.914 162.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 56.3 m -63.62 -51.72 64.02 Favored 'General case' 0 N--CA 1.497 1.912 0 CA-C-N 121.373 1.897 . . . . 0.0 112.063 159.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 42.7 tp -62.64 -38.45 90.32 Favored 'General case' 0 CA--C 1.556 1.181 0 CA-C-O 116.097 -1.906 . . . . 0.0 114.664 168.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 92.4 mtt180 -92.57 36.2 1.01 Allowed 'General case' 0 CA--C 1.571 1.758 0 CA-C-N 123.407 2.821 . . . . 0.0 114.258 164.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -109.83 -28.61 8.69 Favored 'General case' 0 CA--C 1.57 1.726 0 C-N-CA 125.246 1.418 . . . . 0.0 114.518 133.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -62.98 -44.86 94.87 Favored 'General case' 0 CA--C 1.574 1.892 0 CA-C-N 122.879 2.582 . . . . 0.0 112.814 165.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 . . . . . 0 CA--C 1.571 1.757 0 CA-C-O 117.631 -1.176 . . . . 0.0 114.171 169.524 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.583 2.235 0 N-CA-C 114.626 1.343 . . . . 0.0 114.626 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -85.9 -6.47 59.07 Favored 'General case' 0 CA--C 1.581 2.154 0 O-C-N 119.335 -2.103 . . . . 0.0 115.614 150.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -83.39 -50.94 7.83 Favored 'General case' 0 CA--C 1.561 1.385 0 CA-C-O 118.188 -0.91 . . . . 0.0 109.461 159.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 3.3 p -53.44 -47.57 58.67 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.296 0 N-CA-C 116.21 1.93 . . . . 0.0 116.21 -177.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -75.12 -27.89 60.0 Favored 'General case' 0 CA--C 1.589 2.444 0 CA-C-O 122.766 1.269 . . . . 0.0 112.723 -172.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.283 51.2 ttm-85 -70.21 -46.9 63.57 Favored 'General case' 0 CA--C 1.562 1.422 0 C-N-CA 129.084 2.954 . . . . 0.0 115.545 165.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 43.0 t80 -57.06 -46.22 82.62 Favored 'General case' 0 CA--C 1.567 1.606 0 N-CA-C 114.595 1.332 . . . . 0.0 114.595 163.112 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -74.2 -31.55 62.69 Favored 'General case' 0 CA--C 1.562 1.411 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 177.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.7 tptp -75.12 -26.12 58.98 Favored 'General case' 0 CA--C 1.568 1.664 0 CA-C-N 121.131 1.787 . . . . 0.0 115.18 162.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 79.1 m -64.11 -48.97 74.07 Favored 'General case' 0 N--CA 1.494 1.748 0 CA-C-N 120.207 1.367 . . . . 0.0 112.969 161.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 57.2 tp -56.62 -41.55 77.27 Favored 'General case' 0 CA--C 1.557 1.247 0 CA-C-O 116.829 -1.558 . . . . 0.0 114.156 163.101 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 71.1 mtt-85 -82.71 21.93 0.95 Allowed 'General case' 0 CA--C 1.574 1.886 0 CA-C-N 122.371 2.351 . . . . 0.0 115.316 168.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -108.1 -26.28 10.71 Favored 'General case' 0 CA--C 1.569 1.676 0 N-CA-C 115.276 1.584 . . . . 0.0 115.276 143.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -64.64 -47.11 79.73 Favored 'General case' 0 CA--C 1.574 1.886 0 CA-C-N 122.754 2.524 . . . . 0.0 112.267 164.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 . . . . . 0 CA--C 1.576 1.955 0 N-CA-C 115.833 1.79 . . . . 0.0 115.833 163.214 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.401 ' HA ' ' CG1' ' A' ' 18' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.578 2.022 0 N-CA-C 115.957 1.836 . . . . 0.0 115.957 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -84.93 -11.26 55.95 Favored 'General case' 0 CA--C 1.575 1.922 0 CA-C-N 121.498 1.954 . . . . 0.0 115.652 147.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -79.47 -55.1 5.29 Favored 'General case' 0 CA--C 1.558 1.279 0 CA-C-O 117.456 -1.259 . . . . 0.0 108.433 163.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . 0.401 ' CG1' ' HA ' ' A' ' 15' ' ' ARG . 3.8 p -48.51 -48.13 14.51 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.225 0 N-CA-C 117.382 2.364 . . . . 0.0 117.382 -179.287 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -75.4 -30.79 60.23 Favored 'General case' 0 CA--C 1.587 2.383 0 CA-C-O 123.213 1.482 . . . . 0.0 112.778 -171.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.274 18.4 ttp85 -73.65 -40.6 63.61 Favored 'General case' 0 CA--C 1.563 1.444 0 C-N-CA 129.084 2.954 . . . . 0.0 115.762 168.352 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -60.03 -45.1 93.93 Favored 'General case' 0 CA--C 1.563 1.474 0 C-N-CA 125.046 1.338 . . . . 0.0 114.122 161.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -66.74 -39.77 88.08 Favored 'General case' 0 CA--C 1.558 1.287 0 N-CA-C 115.099 1.518 . . . . 0.0 115.099 172.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.2 tppt? -73.67 -24.57 59.98 Favored 'General case' 0 CA--C 1.562 1.438 0 CA-C-N 121.989 2.177 . . . . 0.0 114.836 165.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 56.2 m -62.18 -52.04 65.41 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-N 121.241 1.837 . . . . 0.0 111.867 161.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.45 -46.73 83.29 Favored 'General case' 0 CA--C 1.564 1.507 0 CA-C-N 120.759 1.618 . . . . 0.0 113.465 167.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 -83.2 33.98 0.46 Allowed 'General case' 0 CA--C 1.583 2.227 0 CA-C-N 122.104 2.229 . . . . 0.0 115.031 169.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -132.54 -33.74 1.23 Allowed 'General case' 0 CA--C 1.571 1.772 0 C-N-CA 127.168 2.187 . . . . 0.0 112.882 155.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -55.81 -44.08 77.51 Favored 'General case' 0 CA--C 1.566 1.593 0 CA-C-N 121.69 2.041 . . . . 0.0 113.3 160.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 . . . . . 0 CA--C 1.57 1.75 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 165.233 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.577 2.015 0 N-CA-C 114.948 1.462 . . . . 0.0 114.948 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -80.09 -5.75 56.47 Favored 'General case' 0 CA--C 1.58 2.101 0 O-C-N 119.14 -2.225 . . . . 0.0 115.187 141.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -75.01 -61.46 1.88 Allowed 'General case' 0 CA--C 1.557 1.228 0 O-C-N 121.027 -1.046 . . . . 0.0 108.448 157.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 3.7 p -50.27 -44.66 23.59 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.358 0 N-CA-C 117.634 2.457 . . . . 0.0 117.634 -173.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -72.76 -39.14 67.06 Favored 'General case' 0 CA--C 1.586 2.357 0 CA-C-O 124.355 2.026 . . . . 0.0 113.01 -171.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.302 51.4 ttt180 -68.13 -42.96 79.41 Favored 'General case' 0 CA--C 1.56 1.347 0 C-N-CA 130.424 3.489 . . . . 0.0 115.703 168.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 45.2 t80 -56.61 -46.31 80.97 Favored 'General case' 0 CA--C 1.562 1.421 0 C-N-CA 124.918 1.287 . . . . 0.0 114.35 159.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 35.1 t80 -71.81 -34.04 69.02 Favored 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 115.756 1.762 . . . . 0.0 115.756 178.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.7 tptp -76.34 -26.46 55.75 Favored 'General case' 0 CA--C 1.567 1.613 0 CA-C-N 120.848 1.658 . . . . 0.0 115.176 164.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 62.4 m -62.56 -49.69 74.27 Favored 'General case' 0 N--CA 1.496 1.829 0 CA-C-N 120.456 1.48 . . . . 0.0 112.786 160.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -55.99 -42.76 76.84 Favored 'General case' 0 CA--C 1.562 1.406 0 CA-C-O 116.983 -1.484 . . . . 0.0 113.557 165.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 93.6 mtt-85 -82.02 16.9 1.74 Allowed 'General case' 0 CA--C 1.577 1.988 0 CA-C-N 122.056 2.207 . . . . 0.0 116.614 168.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -106.64 -36.62 6.68 Favored 'General case' 0 CA--C 1.569 1.704 0 C-N-CA 125.681 1.592 . . . . 0.0 114.189 152.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -59.28 -44.58 92.45 Favored 'General case' 0 CA--C 1.57 1.747 0 CA-C-N 120.81 1.641 . . . . 0.0 113.12 165.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 . . . . . 0 CA--C 1.573 1.858 0 N-CA-C 114.863 1.431 . . . . 0.0 114.863 161.822 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? . . . . . 0 CA--C 1.579 2.072 0 N-CA-C 114.973 1.472 . . . . 0.0 114.973 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -82.54 -10.71 58.87 Favored 'General case' 0 CA--C 1.578 2.044 0 O-C-N 119.323 -2.11 . . . . 0.0 115.431 144.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -80.63 -52.67 7.31 Favored 'General case' 0 CA--C 1.562 1.429 0 CA-C-O 117.305 -1.331 . . . . 0.0 109.578 162.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 3.0 p -48.27 -44.96 13.14 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.468 0 N-CA-C 117.097 2.258 . . . . 0.0 117.097 177.284 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -74.1 -36.88 64.27 Favored 'General case' 0 CA--C 1.582 2.191 0 CA-C-O 123.881 1.801 . . . . 0.0 112.98 -170.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.284 76.5 ttt-85 -66.37 -43.94 84.55 Favored 'General case' 0 CA--C 1.561 1.398 0 C-N-CA 129.742 3.217 . . . . 0.0 116.384 165.353 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -60.23 -43.93 95.64 Favored 'General case' 0 CA--C 1.565 1.53 0 C-N-CA 124.781 1.232 . . . . 0.0 114.083 162.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 42.1 t80 -72.25 -32.59 66.82 Favored 'General case' 0 CA--C 1.562 1.432 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 174.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.45 -25.37 54.31 Favored 'General case' 0 CA--C 1.569 1.678 0 CA-C-N 121.789 2.086 . . . . 0.0 114.299 164.392 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 61.6 m -62.35 -51.1 68.95 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-N 120.763 1.62 . . . . 0.0 112.422 161.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -54.59 -46.03 73.71 Favored 'General case' 0 CA--C 1.561 1.374 0 CA-C-O 117.059 -1.448 . . . . 0.0 113.873 164.148 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 37.6 mmt180 -82.01 21.11 0.91 Allowed 'General case' 0 CA--C 1.576 1.977 0 CA-C-N 122.35 2.341 . . . . 0.0 116.007 171.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -115.9 -31.62 5.7 Favored 'General case' 0 CA--C 1.569 1.687 0 C-N-CA 125.936 1.694 . . . . 0.0 114.834 152.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -60.25 -43.0 96.5 Favored 'General case' 0 CA--C 1.571 1.754 0 CA-C-N 121.258 1.844 . . . . 0.0 113.113 162.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 21.4 mm-40 . . . . . 0 CA--C 1.569 1.696 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 165.935 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.404 ' HA ' ' CG1' ' A' ' 18' ' ' VAL . 1.9 mmp_? . . . . . 0 CA--C 1.576 1.973 0 N-CA-C 116.383 1.994 . . . . 0.0 116.383 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -78.48 -22.57 47.31 Favored 'General case' 0 CA--C 1.568 1.66 0 O-C-N 119.336 -2.103 . . . . 0.0 114.767 141.289 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -73.37 -52.24 14.52 Favored 'General case' 0 CA--C 1.561 1.371 0 CA-C-O 117.019 -1.467 . . . . 0.0 109.765 170.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . 0.404 ' CG1' ' HA ' ' A' ' 15' ' ' ARG . 3.9 p -44.92 -47.32 2.86 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.478 0 N-CA-C 117.654 2.464 . . . . 0.0 117.654 173.362 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -72.13 -39.3 68.91 Favored 'General case' 0 CA--C 1.588 2.415 0 CA-C-O 124.629 2.156 . . . . 0.0 113.226 -170.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.317 73.4 ttt180 -67.15 -40.91 86.75 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 130.866 3.666 . . . . 0.0 116.433 167.181 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -60.93 -41.96 97.22 Favored 'General case' 0 CA--C 1.562 1.429 0 C-N-CA 124.652 1.181 . . . . 0.0 113.887 160.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -68.54 -35.78 77.91 Favored 'General case' 0 CA--C 1.565 1.541 0 N-CA-C 115.752 1.76 . . . . 0.0 115.752 173.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.9 tptp -77.28 -24.07 51.06 Favored 'General case' 0 CA--C 1.568 1.639 0 CA-C-N 120.831 1.65 . . . . 0.0 115.338 165.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 38.3 m -65.82 -47.75 73.99 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-N 120.253 1.388 . . . . 0.0 112.373 161.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 58.4 tp -56.63 -42.72 79.34 Favored 'General case' 0 CA--C 1.558 1.255 0 CA-C-O 116.847 -1.549 . . . . 0.0 114.306 162.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 92.6 mtt-85 -84.8 27.68 0.73 Allowed 'General case' 0 CA--C 1.578 2.02 0 CA-C-N 122.182 2.265 . . . . 0.0 114.746 166.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -111.76 -26.24 9.07 Favored 'General case' 0 CA--C 1.571 1.764 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 140.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -64.18 -46.23 84.87 Favored 'General case' 0 CA--C 1.572 1.801 0 CA-C-N 122.869 2.577 . . . . 0.0 112.424 165.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 82.5 mt-30 . . . . . 0 CA--C 1.574 1.867 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 161.787 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.576 1.955 0 N-CA-C 115.077 1.51 . . . . 0.0 115.077 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.4 m-20 -80.76 -1.13 41.57 Favored 'General case' 0 CA--C 1.576 1.952 0 CA-C-N 121.817 2.099 . . . . 0.0 116.21 152.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -90.36 -53.37 4.48 Favored 'General case' 0 CA--C 1.561 1.371 0 CA-C-O 117.331 -1.318 . . . . 0.0 108.148 159.153 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 2.5 p -52.8 -48.61 49.72 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.152 0 N-CA-C 116.849 2.166 . . . . 0.0 116.849 -177.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -74.16 -32.33 63.07 Favored 'General case' 0 CA--C 1.587 2.399 0 CA-C-O 123.015 1.388 . . . . 0.0 112.41 -171.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.271 76.1 ttt180 -66.48 -46.23 77.02 Favored 'General case' 0 CA--C 1.559 1.309 0 C-N-CA 128.732 2.813 . . . . 0.0 115.9 165.743 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -59.0 -44.93 91.73 Favored 'General case' 0 CA--C 1.564 1.51 0 C-N-CA 124.738 1.215 . . . . 0.0 114.149 164.097 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -68.15 -36.39 79.58 Favored 'General case' 0 CA--C 1.56 1.363 0 N-CA-C 115.671 1.73 . . . . 0.0 115.671 175.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.45 -22.08 41.47 Favored 'General case' 0 CA--C 1.571 1.766 0 CA-C-N 121.445 1.93 . . . . 0.0 114.896 167.223 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 60.1 m -64.42 -49.96 69.48 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-N 120.722 1.601 . . . . 0.0 112.834 160.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.3 tt -67.97 -30.45 69.74 Favored 'General case' 0 CA--C 1.561 1.397 0 CA-C-O 116.646 -1.645 . . . . 0.0 114.387 168.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 65.7 mtt180 -90.5 27.63 1.67 Allowed 'General case' 0 CA--C 1.572 1.792 0 CA-C-N 123.615 2.916 . . . . 0.0 114.401 161.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -103.6 -29.7 10.94 Favored 'General case' 0 CA--C 1.568 1.637 0 CA-C-O 115.994 -1.955 . . . . 0.0 114.288 137.44 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -73.98 -35.24 64.45 Favored 'General case' 0 CA--C 1.584 2.263 0 CA-C-N 123.953 3.07 . . . . 0.0 112.361 171.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 . . . . . 0 CA--C 1.576 1.952 0 N-CA-C 115.492 1.664 . . . . 0.0 115.492 157.939 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 38.7 t . . . . . 0 CA--C 1.564 1.514 0 CA-C-O 119.465 -0.302 . . . . 0.0 110.208 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.9 p -148.84 -79.14 0.14 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.249 -0.907 . . . . 0.0 109.466 -172.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 10.3 tp -72.64 -41.88 62.78 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.249 0 CA-C-N 119.395 0.998 . . . . 0.0 111.907 162.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -78.03 74.55 4.58 Favored 'General case' 0 CA--C 1.574 1.888 0 CA-C-O 122.808 1.289 . . . . 0.0 110.663 162.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -139.43 -65.63 0.47 Allowed 'General case' 0 N--CA 1.492 1.649 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.496 -179.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 65.5 mt -87.9 79.77 1.73 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.892 0 CA-C-O 124.21 1.957 . . . . 0.0 107.755 -172.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.1 tpm_? -83.68 -32.84 25.37 Favored 'General case' 0 CA--C 1.573 1.828 0 CA-C-N 112.73 -2.032 . . . . 0.0 114.108 -174.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 52.3 mt-30 63.53 87.11 0.11 Allowed 'General case' 0 N--CA 1.502 2.16 0 C-N-CA 125.462 1.505 . . . . 0.0 112.389 176.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -171.02 83.39 0.08 OUTLIER Glycine 0 CA--C 1.553 2.425 0 CA-C-O 116.72 -2.156 . . . . 0.0 113.238 174.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -69.35 148.49 67.84 Favored 'Trans proline' 0 CA--C 1.565 2.037 0 CA-C-N 122.22 3.01 . . . . 0.0 115.477 -174.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 49.4 mttp -134.89 -71.89 0.48 Allowed 'General case' 0 N--CA 1.498 1.943 0 CA-C-O 118.4 -0.81 . . . . 0.0 110.316 -167.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -63.46 -47.25 83.9 Favored Pre-proline 0 CA--C 1.578 2.053 0 CA-C-O 115.072 -2.394 . . . . 0.0 114.446 176.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -47.95 -40.25 32.84 Favored 'Trans proline' 0 C--N 1.375 1.93 0 CA-C-N 126.933 3.512 . . . . 0.0 117.575 162.072 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -93.36 -27.67 16.63 Favored 'General case' 0 CA--C 1.559 1.327 0 N-CA-C 114.951 1.463 . . . . 0.0 114.951 -164.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.4 mmp_? -103.37 -6.21 22.17 Favored 'General case' 0 CA--C 1.575 1.907 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 171.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -85.87 -7.55 58.63 Favored 'General case' 0 CA--C 1.582 2.183 0 O-C-N 119.513 -1.992 . . . . 0.0 114.698 145.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -79.86 -56.91 3.93 Favored 'General case' 0 CA--C 1.559 1.326 0 O-C-N 120.474 -1.391 . . . . 0.0 109.17 160.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 2.8 p -46.94 -42.06 5.88 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.448 0 N-CA-C 118.037 2.606 . . . . 0.0 118.037 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -74.42 -44.05 53.57 Favored 'General case' 0 CA--C 1.587 2.392 0 CA-C-O 124.542 2.115 . . . . 0.0 112.037 -166.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.295 21.1 ttp180 -55.18 -46.8 75.82 Favored 'General case' 0 CA--C 1.559 1.325 0 C-N-CA 129.584 3.154 . . . . 0.0 117.5 157.614 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -57.36 -41.61 80.47 Favored 'General case' 0 CA--C 1.574 1.868 0 N-CA-C 114.201 1.186 . . . . 0.0 114.201 163.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 27.3 t80 -72.49 -36.16 68.34 Favored 'General case' 0 CA--C 1.557 1.235 0 N-CA-C 115.201 1.556 . . . . 0.0 115.201 177.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 38.7 tptt -78.64 -19.77 51.85 Favored 'General case' 0 CA--C 1.568 1.672 0 CA-C-N 121.978 2.172 . . . . 0.0 115.097 163.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 53.0 m -64.72 -50.16 68.02 Favored 'General case' 0 N--CA 1.496 1.845 0 CA-C-N 121.196 1.817 . . . . 0.0 112.398 161.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.2 tt -63.25 -36.35 83.36 Favored 'General case' 0 CA--C 1.568 1.648 0 CA-C-N 120.124 1.329 . . . . 0.0 114.127 165.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 16.8 mmt85 -83.55 31.52 0.47 Allowed 'General case' 0 CA--C 1.577 1.984 0 CA-C-N 121.911 2.141 . . . . 0.0 114.627 160.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -119.42 -23.86 6.52 Favored 'General case' 0 CA--C 1.569 1.704 0 C-N-CA 125.742 1.617 . . . . 0.0 114.803 138.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -59.57 -43.74 93.52 Favored 'General case' 0 CA--C 1.571 1.781 0 CA-C-N 122.332 2.333 . . . . 0.0 112.911 163.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -72.16 -52.99 14.06 Favored 'General case' 0 CA--C 1.571 1.783 0 C-N-CA 123.664 0.786 . . . . 0.0 112.835 170.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -168.64 115.43 0.65 Allowed 'General case' 0 CA--C 1.562 1.405 0 CA-C-N 119.59 1.086 . . . . 0.0 110.249 -178.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 99.6 p . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 123.122 1.439 . . . . 0.0 114.057 -173.537 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 72.6 m . . . . . 0 CA--C 1.566 1.587 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.7 m -157.62 -67.27 0.09 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 120.779 -1.201 . . . . 0.0 110.525 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 11.3 tp -66.59 -37.53 79.75 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.326 0 N-CA-C 114.725 1.38 . . . . 0.0 114.725 -175.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.4 pp -95.8 41.24 1.1 Allowed 'General case' 0 CA--C 1.575 1.915 0 N-CA-C 114.218 1.192 . . . . 0.0 114.218 167.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -153.85 -67.21 0.14 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.74 -1.225 . . . . 0.0 110.613 -171.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 48.3 mt -85.29 81.19 1.8 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.966 0 CA-C-O 124.832 2.253 . . . . 0.0 107.362 -177.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 55.3 ttp180 -170.13 -31.67 0.02 OUTLIER 'General case' 0 CA--C 1.575 1.939 0 CA-C-N 111.377 -2.647 . . . . 0.0 111.657 -160.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -130.86 97.99 4.49 Favored 'General case' 0 CA--C 1.563 1.48 0 C-N-CA 124.858 1.263 . . . . 0.0 109.202 -168.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -119.05 96.69 0.67 Allowed Glycine 0 CA--C 1.552 2.36 0 CA-C-O 116.739 -2.145 . . . . 0.0 114.317 -173.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_exo -55.37 159.17 10.98 Favored 'Trans proline' 0 CA--C 1.565 2.06 0 CA-C-N 122.321 3.061 . . . . 0.0 117.15 -178.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.98 105.32 8.53 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 -172.766 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 104.3 -55.46 0.0 OUTLIER Pre-proline 0 N--CA 1.509 2.488 0 CA-C-O 114.266 -2.778 . . . . 0.0 110.261 -175.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_exo -58.77 -47.56 18.05 Favored 'Trans proline' 0 C--N 1.378 2.109 0 CA-C-N 127.77 3.811 . . . . 0.0 117.525 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -70.53 -13.8 62.25 Favored 'General case' 0 CA--C 1.57 1.736 0 N-CA-C 117.317 2.34 . . . . 0.0 117.317 -159.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.87 -10.8 19.54 Favored 'General case' 0 CA--C 1.575 1.932 0 N-CA-C 115.784 1.772 . . . . 0.0 115.784 168.453 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -84.15 -7.76 59.27 Favored 'General case' 0 CA--C 1.576 1.981 0 CA-C-N 121.709 2.05 . . . . 0.0 115.628 150.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -83.26 -54.55 4.92 Favored 'General case' 0 CA--C 1.559 1.32 0 CA-C-O 117.398 -1.287 . . . . 0.0 108.816 162.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 2.9 p -50.85 -43.92 25.79 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.254 0 N-CA-C 117.731 2.493 . . . . 0.0 117.731 -179.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -75.59 -35.6 60.53 Favored 'General case' 0 CA--C 1.59 2.493 0 CA-C-O 123.541 1.639 . . . . 0.0 112.22 -170.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.293 9.9 ttp180 -64.63 -41.06 96.42 Favored 'General case' 0 CA--C 1.566 1.582 0 C-N-CA 129.095 2.958 . . . . 0.0 116.751 161.683 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -58.67 -42.26 88.06 Favored 'General case' 0 CA--C 1.574 1.892 0 C-N-CA 124.691 1.196 . . . . 0.0 114.131 160.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 43.2 t80 -70.98 -34.32 71.28 Favored 'General case' 0 CA--C 1.563 1.451 0 N-CA-C 115.752 1.76 . . . . 0.0 115.752 175.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.0 tppt? -78.76 -21.12 48.42 Favored 'General case' 0 CA--C 1.567 1.599 0 CA-C-N 121.315 1.87 . . . . 0.0 114.914 162.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 56.3 m -63.62 -51.72 64.02 Favored 'General case' 0 N--CA 1.497 1.912 0 CA-C-N 121.373 1.897 . . . . 0.0 112.063 159.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 42.7 tp -62.64 -38.45 90.32 Favored 'General case' 0 CA--C 1.556 1.181 0 CA-C-O 116.097 -1.906 . . . . 0.0 114.664 168.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 92.4 mtt180 -92.57 36.2 1.01 Allowed 'General case' 0 CA--C 1.571 1.758 0 CA-C-N 123.407 2.821 . . . . 0.0 114.258 164.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -109.83 -28.61 8.69 Favored 'General case' 0 CA--C 1.57 1.726 0 C-N-CA 125.246 1.418 . . . . 0.0 114.518 133.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -62.98 -44.86 94.87 Favored 'General case' 0 CA--C 1.574 1.892 0 CA-C-N 122.879 2.582 . . . . 0.0 112.814 165.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -72.92 -36.03 67.16 Favored 'General case' 0 CA--C 1.571 1.757 0 CA-C-O 117.631 -1.176 . . . . 0.0 114.171 169.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -140.44 68.33 1.35 Allowed 'General case' 0 CA--C 1.566 1.581 0 CA-C-N 120.971 1.714 . . . . 0.0 114.057 -173.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 84.1 p . . . . . 0 N--CA 1.506 2.351 0 C-N-CA 126.233 1.813 . . . . 0.0 115.675 172.778 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 42.2 t . . . . . 0 CA--C 1.561 1.394 0 N-CA-C 110.283 -0.265 . . . . 0.0 110.283 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 96.5 p -143.38 156.05 44.58 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.64 0.733 . . . . 0.0 111.365 -176.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -63.96 -42.54 96.08 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.254 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 -179.283 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.3 pp -73.95 1.92 9.75 Favored 'General case' 0 N--CA 1.504 2.229 0 N-CA-C 117.97 2.582 . . . . 0.0 117.97 170.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -100.35 -66.16 0.92 Allowed 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 124.212 1.005 . . . . 0.0 109.572 166.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 18.4 mt -91.26 82.28 1.88 Allowed 'Isoleucine or valine' 0 CA--C 1.57 1.734 0 CA-C-O 123.546 1.641 . . . . 0.0 107.174 174.219 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 14.9 ptp180 -97.94 -14.25 20.73 Favored 'General case' 0 CA--C 1.575 1.932 0 CA-C-N 113.282 -1.781 . . . . 0.0 115.435 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -79.24 91.58 5.01 Favored 'General case' 0 CA--C 1.568 1.651 0 CA-C-N 120.636 1.562 . . . . 0.0 113.295 -165.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -98.99 103.72 2.78 Favored Glycine 0 CA--C 1.553 2.423 0 CA-C-O 116.635 -2.203 . . . . 0.0 112.394 172.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -72.8 127.18 12.03 Favored 'Trans proline' 0 CA--C 1.561 1.853 0 CA-C-N 123.028 3.414 . . . . 0.0 115.062 -169.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -173.67 -44.14 0.01 OUTLIER 'General case' 0 CA--C 1.572 1.795 0 CA-C-N 112.479 -2.146 . . . . 0.0 110.923 -175.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -120.91 -44.13 0.04 OUTLIER Pre-proline 0 CA--C 1.58 2.105 0 CA-C-O 115.043 -2.408 . . . . 0.0 111.697 179.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_exo -62.47 -13.15 31.43 Favored 'Trans proline' 0 C--N 1.38 2.188 0 CA-C-N 126.614 3.398 . . . . 0.0 120.034 176.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 15.5 p90 -78.49 25.96 0.24 Allowed 'General case' 0 CA--C 1.574 1.903 0 N-CA-C 117.717 2.488 . . . . 0.0 117.717 -152.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.24 -6.46 50.45 Favored 'General case' 0 CA--C 1.583 2.235 0 O-C-N 120.058 -1.651 . . . . 0.0 114.626 148.102 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -85.9 -6.47 59.07 Favored 'General case' 0 CA--C 1.581 2.154 0 O-C-N 119.335 -2.103 . . . . 0.0 115.614 150.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -83.39 -50.94 7.83 Favored 'General case' 0 CA--C 1.561 1.385 0 CA-C-O 118.188 -0.91 . . . . 0.0 109.461 159.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 3.3 p -53.44 -47.57 58.67 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.296 0 N-CA-C 116.21 1.93 . . . . 0.0 116.21 -177.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -75.12 -27.89 60.0 Favored 'General case' 0 CA--C 1.589 2.444 0 CA-C-O 122.766 1.269 . . . . 0.0 112.723 -172.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.283 51.2 ttm-85 -70.21 -46.9 63.57 Favored 'General case' 0 CA--C 1.562 1.422 0 C-N-CA 129.084 2.954 . . . . 0.0 115.545 165.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 43.0 t80 -57.06 -46.22 82.62 Favored 'General case' 0 CA--C 1.567 1.606 0 N-CA-C 114.595 1.332 . . . . 0.0 114.595 163.112 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -74.2 -31.55 62.69 Favored 'General case' 0 CA--C 1.562 1.411 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 177.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.7 tptp -75.12 -26.12 58.98 Favored 'General case' 0 CA--C 1.568 1.664 0 CA-C-N 121.131 1.787 . . . . 0.0 115.18 162.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 79.1 m -64.11 -48.97 74.07 Favored 'General case' 0 N--CA 1.494 1.748 0 CA-C-N 120.207 1.367 . . . . 0.0 112.969 161.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 57.2 tp -56.62 -41.55 77.27 Favored 'General case' 0 CA--C 1.557 1.247 0 CA-C-O 116.829 -1.558 . . . . 0.0 114.156 163.101 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 71.1 mtt-85 -82.71 21.93 0.95 Allowed 'General case' 0 CA--C 1.574 1.886 0 CA-C-N 122.371 2.351 . . . . 0.0 115.316 168.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -108.1 -26.28 10.71 Favored 'General case' 0 CA--C 1.569 1.676 0 N-CA-C 115.276 1.584 . . . . 0.0 115.276 143.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -64.64 -47.11 79.73 Favored 'General case' 0 CA--C 1.574 1.886 0 CA-C-N 122.754 2.524 . . . . 0.0 112.267 164.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -65.63 -37.87 87.8 Favored 'General case' 0 CA--C 1.576 1.955 0 N-CA-C 115.833 1.79 . . . . 0.0 115.833 163.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 72.7 84.16 0.12 Allowed 'General case' 0 N--CA 1.499 2.003 0 C-N-CA 126.682 1.993 . . . . 0.0 110.748 -170.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 31.4 t . . . . . 0 N--CA 1.488 1.429 0 CA-C-O 125.587 2.613 . . . . 0.0 110.49 -178.441 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 38.1 t . . . . . 0 CA--C 1.574 1.891 0 CA-C-O 120.696 0.284 . . . . 0.0 111.555 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 74.4 m -103.39 -65.84 0.98 Allowed 'General case' 0 N--CA 1.497 1.878 0 O-C-N 120.635 -1.29 . . . . 0.0 111.506 176.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 10.1 tp -76.2 -56.21 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.11 0 CA-C-N 119.042 0.837 . . . . 0.0 112.678 -171.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 94.3 mt -87.24 72.49 9.87 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-N 120.341 1.428 . . . . 0.0 109.768 174.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -154.48 -40.42 0.09 Allowed 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 114.524 1.305 . . . . 0.0 114.524 -172.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 40.2 mt -92.33 79.1 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.851 0 CA-C-O 124.071 1.891 . . . . 0.0 108.309 -161.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.34 73.6 1.26 Allowed 'General case' 0 CA--C 1.569 1.702 0 CA-C-N 112.701 -2.045 . . . . 0.0 108.693 160.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -72.28 143.95 48.55 Favored 'General case' 0 CA--C 1.571 1.763 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 -170.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -114.45 87.03 0.43 Allowed Glycine 0 CA--C 1.553 2.46 0 CA-C-O 117.16 -1.911 . . . . 0.0 111.414 166.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -78.6 161.2 28.07 Favored 'Trans proline' 0 CA--C 1.567 2.155 0 CA-C-N 122.652 3.226 . . . . 0.0 116.445 -161.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -130.26 -72.09 0.58 Allowed 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 115.311 -0.859 . . . . 0.0 108.965 165.028 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.2 pm0 -68.51 -27.23 1.38 Allowed Pre-proline 0 CA--C 1.583 2.227 0 CA-C-O 114.401 -2.714 . . . . 0.0 116.525 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -56.94 -30.05 84.58 Favored 'Trans proline' 0 C--N 1.376 2.011 0 CA-C-N 127.618 3.756 . . . . 0.0 117.879 164.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -66.21 -18.58 65.44 Favored 'General case' 0 CA--C 1.568 1.672 0 N-CA-C 117.897 2.554 . . . . 0.0 117.897 -157.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.401 ' HA ' ' CG1' ' A' ' 18' ' ' VAL . 0.0 OUTLIER -102.99 -5.74 23.09 Favored 'General case' 0 CA--C 1.578 2.022 0 N-CA-C 115.957 1.836 . . . . 0.0 115.957 167.32 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -84.93 -11.26 55.95 Favored 'General case' 0 CA--C 1.575 1.922 0 CA-C-N 121.498 1.954 . . . . 0.0 115.652 147.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -79.47 -55.1 5.29 Favored 'General case' 0 CA--C 1.558 1.279 0 CA-C-O 117.456 -1.259 . . . . 0.0 108.433 163.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.401 ' CG1' ' HA ' ' A' ' 15' ' ' ARG . 3.8 p -48.51 -48.13 14.51 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.225 0 N-CA-C 117.382 2.364 . . . . 0.0 117.382 -179.287 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -75.4 -30.79 60.23 Favored 'General case' 0 CA--C 1.587 2.383 0 CA-C-O 123.213 1.482 . . . . 0.0 112.778 -171.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.274 18.4 ttp85 -73.65 -40.6 63.61 Favored 'General case' 0 CA--C 1.563 1.444 0 C-N-CA 129.084 2.954 . . . . 0.0 115.762 168.352 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -60.03 -45.1 93.93 Favored 'General case' 0 CA--C 1.563 1.474 0 C-N-CA 125.046 1.338 . . . . 0.0 114.122 161.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -66.74 -39.77 88.08 Favored 'General case' 0 CA--C 1.558 1.287 0 N-CA-C 115.099 1.518 . . . . 0.0 115.099 172.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.2 tppt? -73.67 -24.57 59.98 Favored 'General case' 0 CA--C 1.562 1.438 0 CA-C-N 121.989 2.177 . . . . 0.0 114.836 165.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 56.2 m -62.18 -52.04 65.41 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-N 121.241 1.837 . . . . 0.0 111.867 161.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.45 -46.73 83.29 Favored 'General case' 0 CA--C 1.564 1.507 0 CA-C-N 120.759 1.618 . . . . 0.0 113.465 167.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 -83.2 33.98 0.46 Allowed 'General case' 0 CA--C 1.583 2.227 0 CA-C-N 122.104 2.229 . . . . 0.0 115.031 169.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -132.54 -33.74 1.23 Allowed 'General case' 0 CA--C 1.571 1.772 0 C-N-CA 127.168 2.187 . . . . 0.0 112.882 155.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -55.81 -44.08 77.51 Favored 'General case' 0 CA--C 1.566 1.593 0 CA-C-N 121.69 2.041 . . . . 0.0 113.3 160.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 -66.34 -51.16 60.06 Favored 'General case' 0 CA--C 1.57 1.75 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 165.233 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -88.24 68.83 9.08 Favored 'General case' 0 CA--C 1.571 1.775 0 CA-C-N 119.538 1.063 . . . . 0.0 112.976 178.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.2 m . . . . . 0 N--CA 1.489 1.481 0 CA-C-O 124.835 2.255 . . . . 0.0 109.2 -179.918 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 75.1 m . . . . . 0 CA--C 1.561 1.384 0 CA-C-O 120.322 0.106 . . . . 0.0 111.149 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 80.9 p -84.67 175.38 9.25 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 122.578 1.18 . . . . 0.0 113.416 173.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 10.4 tp -73.85 -39.07 51.63 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.211 0 O-C-N 121.449 -0.782 . . . . 0.0 113.034 171.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 94.0 mt -83.06 66.06 8.47 Favored 'General case' 0 CA--C 1.574 1.875 0 CA-C-N 120.22 1.373 . . . . 0.0 111.108 169.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -131.09 -75.42 0.52 Allowed 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 -173.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 35.7 mt -89.77 85.51 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 CA-C-O 123.787 1.756 . . . . 0.0 107.247 179.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 56.9 mtm180 -92.33 39.34 1.02 Allowed 'General case' 0 CA--C 1.58 2.101 0 CA-C-N 113.224 -1.807 . . . . 0.0 113.277 -178.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -82.15 90.21 6.55 Favored 'General case' 0 CA--C 1.568 1.642 0 CA-C-O 123.084 1.421 . . . . 0.0 111.967 -170.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -156.05 155.14 26.07 Favored Glycine 0 CA--C 1.556 2.624 0 CA-C-O 118.192 -1.338 . . . . 0.0 113.428 178.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -73.3 150.88 47.82 Favored 'Trans proline' 0 CA--C 1.567 2.131 0 CA-C-N 121.74 2.77 . . . . 0.0 115.164 -178.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.6 mptt -138.26 -61.99 0.59 Allowed 'General case' 0 N--CA 1.496 1.839 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.573 174.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -77.33 -47.59 2.53 Favored Pre-proline 0 CA--C 1.578 2.035 0 CA-C-O 115.062 -2.399 . . . . 0.0 114.389 178.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -86.87 -155.91 0.06 OUTLIER 'Trans proline' 0 CA--C 1.57 2.283 0 CA-C-N 126.548 3.374 . . . . 0.0 112.836 -177.281 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -154.59 57.01 0.69 Allowed 'General case' 0 CA--C 1.567 1.599 0 CA-C-N 113.612 -1.631 . . . . 0.0 112.395 161.485 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.88 -22.1 1.43 Allowed 'General case' 0 CA--C 1.577 2.015 0 N-CA-C 114.948 1.462 . . . . 0.0 114.948 -175.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -80.09 -5.75 56.47 Favored 'General case' 0 CA--C 1.58 2.101 0 O-C-N 119.14 -2.225 . . . . 0.0 115.187 141.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -75.01 -61.46 1.88 Allowed 'General case' 0 CA--C 1.557 1.228 0 O-C-N 121.027 -1.046 . . . . 0.0 108.448 157.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 3.7 p -50.27 -44.66 23.59 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.358 0 N-CA-C 117.634 2.457 . . . . 0.0 117.634 -173.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -72.76 -39.14 67.06 Favored 'General case' 0 CA--C 1.586 2.357 0 CA-C-O 124.355 2.026 . . . . 0.0 113.01 -171.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.302 51.4 ttt180 -68.13 -42.96 79.41 Favored 'General case' 0 CA--C 1.56 1.347 0 C-N-CA 130.424 3.489 . . . . 0.0 115.703 168.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 45.2 t80 -56.61 -46.31 80.97 Favored 'General case' 0 CA--C 1.562 1.421 0 C-N-CA 124.918 1.287 . . . . 0.0 114.35 159.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 35.1 t80 -71.81 -34.04 69.02 Favored 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 115.756 1.762 . . . . 0.0 115.756 178.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.7 tptp -76.34 -26.46 55.75 Favored 'General case' 0 CA--C 1.567 1.613 0 CA-C-N 120.848 1.658 . . . . 0.0 115.176 164.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 62.4 m -62.56 -49.69 74.27 Favored 'General case' 0 N--CA 1.496 1.829 0 CA-C-N 120.456 1.48 . . . . 0.0 112.786 160.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -55.99 -42.76 76.84 Favored 'General case' 0 CA--C 1.562 1.406 0 CA-C-O 116.983 -1.484 . . . . 0.0 113.557 165.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 93.6 mtt-85 -82.02 16.9 1.74 Allowed 'General case' 0 CA--C 1.577 1.988 0 CA-C-N 122.056 2.207 . . . . 0.0 116.614 168.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -106.64 -36.62 6.68 Favored 'General case' 0 CA--C 1.569 1.704 0 C-N-CA 125.681 1.592 . . . . 0.0 114.189 152.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -59.28 -44.58 92.45 Favored 'General case' 0 CA--C 1.57 1.747 0 CA-C-N 120.81 1.641 . . . . 0.0 113.12 165.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -67.6 -38.1 83.5 Favored 'General case' 0 CA--C 1.573 1.858 0 N-CA-C 114.863 1.431 . . . . 0.0 114.863 161.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 55.95 75.76 0.32 Allowed 'General case' 0 N--CA 1.496 1.866 0 C-N-CA 125.572 1.549 . . . . 0.0 111.925 -163.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 52.9 m . . . . . 0 N--CA 1.493 1.676 0 CA-C-O 124.949 2.309 . . . . 0.0 109.577 -174.499 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 92.2 m . . . . . 0 CA--C 1.573 1.862 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 85.6 p -117.14 -77.5 0.57 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.716 -1.24 . . . . 0.0 111.628 -176.047 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 10.9 tp -72.69 -38.32 58.05 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.21 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 -168.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.9 pp -90.45 21.57 3.85 Favored 'General case' 0 N--CA 1.503 2.194 0 N-CA-C 116.286 1.958 . . . . 0.0 116.286 166.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -114.72 -64.21 1.35 Allowed 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 125.675 1.59 . . . . 0.0 109.338 177.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 14.3 mt -80.09 80.88 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.988 0 CA-C-O 123.713 1.72 . . . . 0.0 106.815 156.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 29.0 ttp180 -91.2 14.13 15.16 Favored 'General case' 0 CA--C 1.578 2.021 0 CA-C-N 113.535 -1.666 . . . . 0.0 114.874 -169.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 64.41 73.84 0.42 Allowed 'General case' 0 N--CA 1.502 2.155 0 C-N-CA 125.64 1.576 . . . . 0.0 113.241 160.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -105.47 -92.24 2.26 Favored Glycine 0 CA--C 1.55 2.223 0 CA-C-O 116.91 -2.05 . . . . 0.0 112.499 175.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -80.19 162.25 22.97 Favored 'Trans proline' 0 CA--C 1.563 1.962 0 CA-C-N 123.074 3.437 . . . . 0.0 115.587 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 59.5 pttt 64.24 -40.68 0.25 Allowed 'General case' 0 N--CA 1.512 2.626 0 C-N-CA 127.504 2.321 . . . . 0.0 116.704 167.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 58.1 tt0 -64.9 -35.08 11.79 Favored Pre-proline 0 CA--C 1.585 2.293 0 CA-C-O 114.75 -2.548 . . . . 0.0 115.516 168.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_exo -60.22 -52.95 3.43 Favored 'Trans proline' 0 C--N 1.377 2.035 0 CA-C-N 126.619 3.399 . . . . 0.0 118.557 -179.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 46.38 1.77 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.99 0 N-CA-C 119.377 3.103 . . . . 0.0 119.377 -153.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -113.65 -8.06 13.3 Favored 'General case' 0 CA--C 1.579 2.072 0 CA-C-N 121.028 1.74 . . . . 0.0 114.973 176.154 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -82.54 -10.71 58.87 Favored 'General case' 0 CA--C 1.578 2.044 0 O-C-N 119.323 -2.11 . . . . 0.0 115.431 144.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -80.63 -52.67 7.31 Favored 'General case' 0 CA--C 1.562 1.429 0 CA-C-O 117.305 -1.331 . . . . 0.0 109.578 162.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 3.0 p -48.27 -44.96 13.14 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.468 0 N-CA-C 117.097 2.258 . . . . 0.0 117.097 177.284 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -74.1 -36.88 64.27 Favored 'General case' 0 CA--C 1.582 2.191 0 CA-C-O 123.881 1.801 . . . . 0.0 112.98 -170.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.284 76.5 ttt-85 -66.37 -43.94 84.55 Favored 'General case' 0 CA--C 1.561 1.398 0 C-N-CA 129.742 3.217 . . . . 0.0 116.384 165.353 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -60.23 -43.93 95.64 Favored 'General case' 0 CA--C 1.565 1.53 0 C-N-CA 124.781 1.232 . . . . 0.0 114.083 162.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 42.1 t80 -72.25 -32.59 66.82 Favored 'General case' 0 CA--C 1.562 1.432 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 174.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.45 -25.37 54.31 Favored 'General case' 0 CA--C 1.569 1.678 0 CA-C-N 121.789 2.086 . . . . 0.0 114.299 164.392 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 61.6 m -62.35 -51.1 68.95 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-N 120.763 1.62 . . . . 0.0 112.422 161.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -54.59 -46.03 73.71 Favored 'General case' 0 CA--C 1.561 1.374 0 CA-C-O 117.059 -1.448 . . . . 0.0 113.873 164.148 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 37.6 mmt180 -82.01 21.11 0.91 Allowed 'General case' 0 CA--C 1.576 1.977 0 CA-C-N 122.35 2.341 . . . . 0.0 116.007 171.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -115.9 -31.62 5.7 Favored 'General case' 0 CA--C 1.569 1.687 0 C-N-CA 125.936 1.694 . . . . 0.0 114.834 152.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -60.25 -43.0 96.5 Favored 'General case' 0 CA--C 1.571 1.754 0 CA-C-N 121.258 1.844 . . . . 0.0 113.113 162.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 21.4 mm-40 -59.6 -43.18 93.8 Favored 'General case' 0 CA--C 1.569 1.696 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 165.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.15 -27.69 65.77 Favored 'General case' 0 CA--C 1.573 1.865 0 N-CA-C 116.271 1.952 . . . . 0.0 116.271 176.289 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 75.5 m . . . . . 0 N--CA 1.489 1.506 0 CA-C-O 124.645 2.164 . . . . 0.0 113.149 -170.088 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 42.4 t . . . . . 0 CA--C 1.563 1.449 0 CA-C-O 120.16 0.029 . . . . 0.0 110.98 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 54.0 p -109.36 -175.34 2.73 Favored 'General case' 0 CA--C 1.568 1.647 0 CA-C-O 122.658 1.218 . . . . 0.0 112.74 -179.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 11.0 tp -68.8 -34.47 64.8 Favored 'Isoleucine or valine' 0 CA--C 1.58 2.121 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 173.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 95.2 mt -84.92 39.55 0.76 Allowed 'General case' 0 N--CA 1.503 2.193 0 CA-C-N 120.913 1.688 . . . . 0.0 114.848 175.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -124.26 -18.47 5.82 Favored 'General case' 0 CA--C 1.574 1.868 0 C-N-CA 124.973 1.309 . . . . 0.0 114.187 179.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 69.2 mt -89.09 85.78 2.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 CA-C-N 121.244 1.838 . . . . 0.0 108.315 -164.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 79.5 mtt85 -104.34 43.6 1.09 Allowed 'General case' 0 CA--C 1.581 2.149 0 CA-C-N 113.263 -1.79 . . . . 0.0 112.539 178.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -94.42 63.73 3.03 Favored 'General case' 0 CA--C 1.571 1.774 0 O-C-N 120.794 -1.191 . . . . 0.0 113.646 -166.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -84.98 158.02 32.76 Favored Glycine 0 CA--C 1.562 2.991 0 CA-C-O 118.265 -1.297 . . . . 0.0 114.511 164.464 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -70.75 133.0 22.81 Favored 'Trans proline' 0 CA--C 1.563 1.945 0 CA-C-N 122.229 3.014 . . . . 0.0 114.554 -174.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 73.9 mttt -137.92 -65.89 0.51 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-N 113.915 -1.493 . . . . 0.0 109.611 -165.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -80.11 -43.25 1.44 Allowed Pre-proline 0 CA--C 1.586 2.334 0 CA-C-O 114.933 -2.46 . . . . 0.0 114.451 172.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -59.3 -29.45 90.3 Favored 'Trans proline' 0 C--N 1.376 1.997 0 CA-C-N 126.586 3.388 . . . . 0.0 119.613 -176.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.4 p90 -62.85 -10.68 14.1 Favored 'General case' 0 CA--C 1.574 1.872 0 N-CA-C 117.925 2.565 . . . . 0.0 117.925 -158.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.404 ' HA ' ' CG1' ' A' ' 18' ' ' VAL . 1.9 mmp_? -111.57 -4.29 14.83 Favored 'General case' 0 CA--C 1.576 1.973 0 N-CA-C 116.383 1.994 . . . . 0.0 116.383 172.091 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -78.48 -22.57 47.31 Favored 'General case' 0 CA--C 1.568 1.66 0 O-C-N 119.336 -2.103 . . . . 0.0 114.767 141.289 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -73.37 -52.24 14.52 Favored 'General case' 0 CA--C 1.561 1.371 0 CA-C-O 117.019 -1.467 . . . . 0.0 109.765 170.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.404 ' CG1' ' HA ' ' A' ' 15' ' ' ARG . 3.9 p -44.92 -47.32 2.86 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.478 0 N-CA-C 117.654 2.464 . . . . 0.0 117.654 173.362 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -72.13 -39.3 68.91 Favored 'General case' 0 CA--C 1.588 2.415 0 CA-C-O 124.629 2.156 . . . . 0.0 113.226 -170.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.317 73.4 ttt180 -67.15 -40.91 86.75 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 130.866 3.666 . . . . 0.0 116.433 167.181 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -60.93 -41.96 97.22 Favored 'General case' 0 CA--C 1.562 1.429 0 C-N-CA 124.652 1.181 . . . . 0.0 113.887 160.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -68.54 -35.78 77.91 Favored 'General case' 0 CA--C 1.565 1.541 0 N-CA-C 115.752 1.76 . . . . 0.0 115.752 173.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.9 tptp -77.28 -24.07 51.06 Favored 'General case' 0 CA--C 1.568 1.639 0 CA-C-N 120.831 1.65 . . . . 0.0 115.338 165.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 38.3 m -65.82 -47.75 73.99 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-N 120.253 1.388 . . . . 0.0 112.373 161.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 58.4 tp -56.63 -42.72 79.34 Favored 'General case' 0 CA--C 1.558 1.255 0 CA-C-O 116.847 -1.549 . . . . 0.0 114.306 162.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 92.6 mtt-85 -84.8 27.68 0.73 Allowed 'General case' 0 CA--C 1.578 2.02 0 CA-C-N 122.182 2.265 . . . . 0.0 114.746 166.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -111.76 -26.24 9.07 Favored 'General case' 0 CA--C 1.571 1.764 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 140.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -64.18 -46.23 84.87 Favored 'General case' 0 CA--C 1.572 1.801 0 CA-C-N 122.869 2.577 . . . . 0.0 112.424 165.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 82.5 mt-30 -62.78 -47.86 81.64 Favored 'General case' 0 CA--C 1.574 1.867 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 161.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 66.65 -63.78 0.25 Allowed 'General case' 0 N--CA 1.499 2.003 0 C-N-CA 126.504 1.922 . . . . 0.0 114.202 -178.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 52.9 m . . . . . 0 N--CA 1.492 1.675 0 CA-C-O 123.342 1.544 . . . . 0.0 109.373 174.481 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 42.7 t . . . . . 0 CA--C 1.567 1.626 0 CA-C-O 116.605 -1.664 . . . . 0.0 108.101 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 43.8 t -166.05 -104.49 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 CA-C-N 122.489 2.404 . . . . 0.0 107.66 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . 0.276 7.9 tp 34.98 36.8 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.512 2.653 0 N-CA-C 118.108 2.633 . . . . 0.0 118.108 -174.088 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 73.8 mt 38.91 43.24 0.73 Allowed 'General case' 0 N--CA 1.509 2.483 0 C-N-CA 126.126 1.771 . . . . 0.0 115.534 -167.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -162.72 -58.21 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.248 0 O-C-N 121.479 -0.763 . . . . 0.0 111.465 -165.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 53.3 mt -90.84 79.75 1.62 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.877 0 CA-C-O 124.215 1.96 . . . . 0.0 107.835 -164.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.65 -28.25 26.56 Favored 'General case' 0 CA--C 1.57 1.743 0 CA-C-N 112.696 -2.047 . . . . 0.0 114.202 -174.434 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 59.42 80.57 0.19 Allowed 'General case' 0 N--CA 1.502 2.159 0 C-N-CA 125.812 1.645 . . . . 0.0 111.233 -179.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 121.99 -174.91 16.23 Favored Glycine 0 CA--C 1.562 3.012 0 CA-C-N 115.294 -0.866 . . . . 0.0 114.477 -168.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -66.38 140.0 56.42 Favored 'Trans proline' 0 CA--C 1.565 2.052 0 CA-C-N 121.304 2.552 . . . . 0.0 115.424 -175.162 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -134.29 -54.54 0.85 Allowed 'General case' 0 N--CA 1.494 1.768 0 CA-C-N 115.32 -0.855 . . . . 0.0 111.494 178.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -88.96 -45.87 0.43 Allowed Pre-proline 0 CA--C 1.575 1.937 0 CA-C-O 115.058 -2.401 . . . . 0.0 113.982 -178.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -56.89 -47.85 21.28 Favored 'Trans proline' 0 C--N 1.377 2.063 0 CA-C-N 126.492 3.354 . . . . 0.0 117.035 179.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -75.26 -7.07 52.91 Favored 'General case' 0 CA--C 1.573 1.832 0 N-CA-C 116.059 1.874 . . . . 0.0 116.059 -164.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.64 -19.47 17.53 Favored 'General case' 0 CA--C 1.576 1.955 0 N-CA-C 115.077 1.51 . . . . 0.0 115.077 165.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.4 m-20 -80.76 -1.13 41.57 Favored 'General case' 0 CA--C 1.576 1.952 0 CA-C-N 121.817 2.099 . . . . 0.0 116.21 152.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -90.36 -53.37 4.48 Favored 'General case' 0 CA--C 1.561 1.371 0 CA-C-O 117.331 -1.318 . . . . 0.0 108.148 159.153 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 2.5 p -52.8 -48.61 49.72 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.152 0 N-CA-C 116.849 2.166 . . . . 0.0 116.849 -177.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -74.16 -32.33 63.07 Favored 'General case' 0 CA--C 1.587 2.399 0 CA-C-O 123.015 1.388 . . . . 0.0 112.41 -171.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.271 76.1 ttt180 -66.48 -46.23 77.02 Favored 'General case' 0 CA--C 1.559 1.309 0 C-N-CA 128.732 2.813 . . . . 0.0 115.9 165.743 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -59.0 -44.93 91.73 Favored 'General case' 0 CA--C 1.564 1.51 0 C-N-CA 124.738 1.215 . . . . 0.0 114.149 164.097 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -68.15 -36.39 79.58 Favored 'General case' 0 CA--C 1.56 1.363 0 N-CA-C 115.671 1.73 . . . . 0.0 115.671 175.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.45 -22.08 41.47 Favored 'General case' 0 CA--C 1.571 1.766 0 CA-C-N 121.445 1.93 . . . . 0.0 114.896 167.223 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 60.1 m -64.42 -49.96 69.48 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-N 120.722 1.601 . . . . 0.0 112.834 160.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.3 tt -67.97 -30.45 69.74 Favored 'General case' 0 CA--C 1.561 1.397 0 CA-C-O 116.646 -1.645 . . . . 0.0 114.387 168.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 65.7 mtt180 -90.5 27.63 1.67 Allowed 'General case' 0 CA--C 1.572 1.792 0 CA-C-N 123.615 2.916 . . . . 0.0 114.401 161.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -103.6 -29.7 10.94 Favored 'General case' 0 CA--C 1.568 1.637 0 CA-C-O 115.994 -1.955 . . . . 0.0 114.288 137.44 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -73.98 -35.24 64.45 Favored 'General case' 0 CA--C 1.584 2.263 0 CA-C-N 123.953 3.07 . . . . 0.0 112.361 171.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -72.95 -33.41 65.88 Favored 'General case' 0 CA--C 1.576 1.952 0 N-CA-C 115.492 1.664 . . . . 0.0 115.492 157.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 65.9 -67.84 0.14 Allowed 'General case' 0 N--CA 1.502 2.153 0 C-N-CA 125.737 1.615 . . . . 0.0 112.224 -155.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 28.7 t . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 124.85 2.262 . . . . 0.0 110.622 169.967 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.645 ' HA ' HG12 ' A' ' 18' ' ' VAL . 2.4 mmp_? . . . . . 0 CA--C 1.575 1.907 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -85.87 -7.55 58.63 Favored 'General case' 0 CA--C 1.582 2.183 0 O-C-N 119.513 -1.992 . . . . 0.0 114.698 145.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -79.86 -56.91 3.93 Favored 'General case' 0 CA--C 1.559 1.326 0 O-C-N 120.474 -1.391 . . . . 0.0 109.17 160.417 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.645 HG12 ' HA ' ' A' ' 15' ' ' ARG . 2.8 p -46.94 -42.06 5.88 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.448 0 N-CA-C 118.037 2.606 . . . . 0.0 118.037 179.512 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -74.42 -44.05 53.57 Favored 'General case' 0 CA--C 1.587 2.392 0 CA-C-O 124.542 2.115 . . . . 0.0 112.037 -166.511 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.295 21.1 ttp180 -55.18 -46.8 75.82 Favored 'General case' 0 CA--C 1.559 1.325 0 C-N-CA 129.584 3.154 . . . . 0.0 117.5 157.614 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -57.36 -41.61 80.47 Favored 'General case' 0 CA--C 1.574 1.868 0 N-CA-C 114.201 1.186 . . . . 0.0 114.201 163.643 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 27.3 t80 -72.49 -36.16 68.34 Favored 'General case' 0 CA--C 1.557 1.235 0 N-CA-C 115.201 1.556 . . . . 0.0 115.201 177.683 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.419 ' HA ' ' HB2' ' A' ' 26' ' ' ARG . 38.7 tptt -78.64 -19.77 51.85 Favored 'General case' 0 CA--C 1.568 1.672 0 CA-C-N 121.978 2.172 . . . . 0.0 115.097 163.351 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 53.0 m -64.72 -50.16 68.02 Favored 'General case' 0 N--CA 1.496 1.845 0 CA-C-N 121.196 1.817 . . . . 0.0 112.398 161.728 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.2 tt -63.25 -36.35 83.36 Favored 'General case' 0 CA--C 1.568 1.648 0 CA-C-N 120.124 1.329 . . . . 0.0 114.127 165.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.419 ' HB2' ' HA ' ' A' ' 23' ' ' LYS . 16.8 mmt85 -83.55 31.52 0.47 Allowed 'General case' 0 CA--C 1.577 1.984 0 CA-C-N 121.911 2.141 . . . . 0.0 114.627 160.84 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -119.42 -23.86 6.52 Favored 'General case' 0 CA--C 1.569 1.704 0 C-N-CA 125.742 1.617 . . . . 0.0 114.803 138.429 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -59.57 -43.74 93.52 Favored 'General case' 0 CA--C 1.571 1.781 0 CA-C-N 122.332 2.333 . . . . 0.0 112.911 163.347 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 . . . . . 0 CA--C 1.571 1.783 0 C-N-CA 123.664 0.786 . . . . 0.0 112.835 170.42 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.706 ' HA ' HG12 ' A' ' 18' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.575 1.932 0 N-CA-C 115.784 1.772 . . . . 0.0 115.784 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -84.15 -7.76 59.27 Favored 'General case' 0 CA--C 1.576 1.981 0 CA-C-N 121.709 2.05 . . . . 0.0 115.628 150.117 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -83.26 -54.55 4.92 Favored 'General case' 0 CA--C 1.559 1.32 0 CA-C-O 117.398 -1.287 . . . . 0.0 108.816 162.284 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.706 HG12 ' HA ' ' A' ' 15' ' ' ARG . 2.9 p -50.85 -43.92 25.79 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.254 0 N-CA-C 117.731 2.493 . . . . 0.0 117.731 -179.386 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -75.59 -35.6 60.53 Favored 'General case' 0 CA--C 1.59 2.493 0 CA-C-O 123.541 1.639 . . . . 0.0 112.22 -170.254 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.293 9.9 ttp180 -64.63 -41.06 96.42 Favored 'General case' 0 CA--C 1.566 1.582 0 C-N-CA 129.095 2.958 . . . . 0.0 116.751 161.683 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -58.67 -42.26 88.06 Favored 'General case' 0 CA--C 1.574 1.892 0 C-N-CA 124.691 1.196 . . . . 0.0 114.131 160.478 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 43.2 t80 -70.98 -34.32 71.28 Favored 'General case' 0 CA--C 1.563 1.451 0 N-CA-C 115.752 1.76 . . . . 0.0 115.752 175.136 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.0 tppt? -78.76 -21.12 48.42 Favored 'General case' 0 CA--C 1.567 1.599 0 CA-C-N 121.315 1.87 . . . . 0.0 114.914 162.68 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 56.3 m -63.62 -51.72 64.02 Favored 'General case' 0 N--CA 1.497 1.912 0 CA-C-N 121.373 1.897 . . . . 0.0 112.063 159.458 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 42.7 tp -62.64 -38.45 90.32 Favored 'General case' 0 CA--C 1.556 1.181 0 CA-C-O 116.097 -1.906 . . . . 0.0 114.664 168.397 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 92.4 mtt180 -92.57 36.2 1.01 Allowed 'General case' 0 CA--C 1.571 1.758 0 CA-C-N 123.407 2.821 . . . . 0.0 114.258 164.59 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -109.83 -28.61 8.69 Favored 'General case' 0 CA--C 1.57 1.726 0 C-N-CA 125.246 1.418 . . . . 0.0 114.518 133.157 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -62.98 -44.86 94.87 Favored 'General case' 0 CA--C 1.574 1.892 0 CA-C-N 122.879 2.582 . . . . 0.0 112.814 165.641 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 . . . . . 0 CA--C 1.571 1.757 0 CA-C-O 117.631 -1.176 . . . . 0.0 114.171 169.524 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.686 ' HA ' HG12 ' A' ' 18' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.583 2.235 0 N-CA-C 114.626 1.343 . . . . 0.0 114.626 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -85.9 -6.47 59.07 Favored 'General case' 0 CA--C 1.581 2.154 0 O-C-N 119.335 -2.103 . . . . 0.0 115.614 150.392 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -83.39 -50.94 7.83 Favored 'General case' 0 CA--C 1.561 1.385 0 CA-C-O 118.188 -0.91 . . . . 0.0 109.461 159.154 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.686 HG12 ' HA ' ' A' ' 15' ' ' ARG . 3.3 p -53.44 -47.57 58.67 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.296 0 N-CA-C 116.21 1.93 . . . . 0.0 116.21 -177.755 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -75.12 -27.89 60.0 Favored 'General case' 0 CA--C 1.589 2.444 0 CA-C-O 122.766 1.269 . . . . 0.0 112.723 -172.619 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.283 51.2 ttm-85 -70.21 -46.9 63.57 Favored 'General case' 0 CA--C 1.562 1.422 0 C-N-CA 129.084 2.954 . . . . 0.0 115.545 165.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 43.0 t80 -57.06 -46.22 82.62 Favored 'General case' 0 CA--C 1.567 1.606 0 N-CA-C 114.595 1.332 . . . . 0.0 114.595 163.112 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -74.2 -31.55 62.69 Favored 'General case' 0 CA--C 1.562 1.411 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 177.162 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.7 tptp -75.12 -26.12 58.98 Favored 'General case' 0 CA--C 1.568 1.664 0 CA-C-N 121.131 1.787 . . . . 0.0 115.18 162.363 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 79.1 m -64.11 -48.97 74.07 Favored 'General case' 0 N--CA 1.494 1.748 0 CA-C-N 120.207 1.367 . . . . 0.0 112.969 161.702 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 57.2 tp -56.62 -41.55 77.27 Favored 'General case' 0 CA--C 1.557 1.247 0 CA-C-O 116.829 -1.558 . . . . 0.0 114.156 163.101 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 71.1 mtt-85 -82.71 21.93 0.95 Allowed 'General case' 0 CA--C 1.574 1.886 0 CA-C-N 122.371 2.351 . . . . 0.0 115.316 168.317 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -108.1 -26.28 10.71 Favored 'General case' 0 CA--C 1.569 1.676 0 N-CA-C 115.276 1.584 . . . . 0.0 115.276 143.289 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -64.64 -47.11 79.73 Favored 'General case' 0 CA--C 1.574 1.886 0 CA-C-N 122.754 2.524 . . . . 0.0 112.267 164.788 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 . . . . . 0 CA--C 1.576 1.955 0 N-CA-C 115.833 1.79 . . . . 0.0 115.833 163.214 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.685 ' HA ' HG12 ' A' ' 18' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.578 2.022 0 N-CA-C 115.957 1.836 . . . . 0.0 115.957 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -84.93 -11.26 55.95 Favored 'General case' 0 CA--C 1.575 1.922 0 CA-C-N 121.498 1.954 . . . . 0.0 115.652 147.846 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -79.47 -55.1 5.29 Favored 'General case' 0 CA--C 1.558 1.279 0 CA-C-O 117.456 -1.259 . . . . 0.0 108.433 163.906 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.685 HG12 ' HA ' ' A' ' 15' ' ' ARG . 3.8 p -48.51 -48.13 14.51 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.225 0 N-CA-C 117.382 2.364 . . . . 0.0 117.382 -179.287 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -75.4 -30.79 60.23 Favored 'General case' 0 CA--C 1.587 2.383 0 CA-C-O 123.213 1.482 . . . . 0.0 112.778 -171.523 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.274 18.4 ttp85 -73.65 -40.6 63.61 Favored 'General case' 0 CA--C 1.563 1.444 0 C-N-CA 129.084 2.954 . . . . 0.0 115.762 168.352 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -60.03 -45.1 93.93 Favored 'General case' 0 CA--C 1.563 1.474 0 C-N-CA 125.046 1.338 . . . . 0.0 114.122 161.625 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -66.74 -39.77 88.08 Favored 'General case' 0 CA--C 1.558 1.287 0 N-CA-C 115.099 1.518 . . . . 0.0 115.099 172.674 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.2 tppt? -73.67 -24.57 59.98 Favored 'General case' 0 CA--C 1.562 1.438 0 CA-C-N 121.989 2.177 . . . . 0.0 114.836 165.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 56.2 m -62.18 -52.04 65.41 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-N 121.241 1.837 . . . . 0.0 111.867 161.485 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.45 -46.73 83.29 Favored 'General case' 0 CA--C 1.564 1.507 0 CA-C-N 120.759 1.618 . . . . 0.0 113.465 167.062 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 -83.2 33.98 0.46 Allowed 'General case' 0 CA--C 1.583 2.227 0 CA-C-N 122.104 2.229 . . . . 0.0 115.031 169.043 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -132.54 -33.74 1.23 Allowed 'General case' 0 CA--C 1.571 1.772 0 C-N-CA 127.168 2.187 . . . . 0.0 112.882 155.201 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -55.81 -44.08 77.51 Favored 'General case' 0 CA--C 1.566 1.593 0 CA-C-N 121.69 2.041 . . . . 0.0 113.3 160.697 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 . . . . . 0 CA--C 1.57 1.75 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 165.233 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.674 ' HA ' HG12 ' A' ' 18' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.577 2.015 0 N-CA-C 114.948 1.462 . . . . 0.0 114.948 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -80.09 -5.75 56.47 Favored 'General case' 0 CA--C 1.58 2.101 0 O-C-N 119.14 -2.225 . . . . 0.0 115.187 141.44 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -75.01 -61.46 1.88 Allowed 'General case' 0 CA--C 1.557 1.228 0 O-C-N 121.027 -1.046 . . . . 0.0 108.448 157.781 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.674 HG12 ' HA ' ' A' ' 15' ' ' ARG . 3.7 p -50.27 -44.66 23.59 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.358 0 N-CA-C 117.634 2.457 . . . . 0.0 117.634 -173.868 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -72.76 -39.14 67.06 Favored 'General case' 0 CA--C 1.586 2.357 0 CA-C-O 124.355 2.026 . . . . 0.0 113.01 -171.364 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.302 51.4 ttt180 -68.13 -42.96 79.41 Favored 'General case' 0 CA--C 1.56 1.347 0 C-N-CA 130.424 3.489 . . . . 0.0 115.703 168.657 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 45.2 t80 -56.61 -46.31 80.97 Favored 'General case' 0 CA--C 1.562 1.421 0 C-N-CA 124.918 1.287 . . . . 0.0 114.35 159.333 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 35.1 t80 -71.81 -34.04 69.02 Favored 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 115.756 1.762 . . . . 0.0 115.756 178.519 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.7 tptp -76.34 -26.46 55.75 Favored 'General case' 0 CA--C 1.567 1.613 0 CA-C-N 120.848 1.658 . . . . 0.0 115.176 164.25 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 62.4 m -62.56 -49.69 74.27 Favored 'General case' 0 N--CA 1.496 1.829 0 CA-C-N 120.456 1.48 . . . . 0.0 112.786 160.62 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -55.99 -42.76 76.84 Favored 'General case' 0 CA--C 1.562 1.406 0 CA-C-O 116.983 -1.484 . . . . 0.0 113.557 165.738 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 93.6 mtt-85 -82.02 16.9 1.74 Allowed 'General case' 0 CA--C 1.577 1.988 0 CA-C-N 122.056 2.207 . . . . 0.0 116.614 168.283 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -106.64 -36.62 6.68 Favored 'General case' 0 CA--C 1.569 1.704 0 C-N-CA 125.681 1.592 . . . . 0.0 114.189 152.455 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -59.28 -44.58 92.45 Favored 'General case' 0 CA--C 1.57 1.747 0 CA-C-N 120.81 1.641 . . . . 0.0 113.12 165.148 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 . . . . . 0 CA--C 1.573 1.858 0 N-CA-C 114.863 1.431 . . . . 0.0 114.863 161.822 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.628 ' HA ' HG12 ' A' ' 18' ' ' VAL . 2.3 mmp_? . . . . . 0 CA--C 1.579 2.072 0 N-CA-C 114.973 1.472 . . . . 0.0 114.973 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -82.54 -10.71 58.87 Favored 'General case' 0 CA--C 1.578 2.044 0 O-C-N 119.323 -2.11 . . . . 0.0 115.431 144.448 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -80.63 -52.67 7.31 Favored 'General case' 0 CA--C 1.562 1.429 0 CA-C-O 117.305 -1.331 . . . . 0.0 109.578 162.777 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.628 HG12 ' HA ' ' A' ' 15' ' ' ARG . 3.0 p -48.27 -44.96 13.14 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.468 0 N-CA-C 117.097 2.258 . . . . 0.0 117.097 177.284 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -74.1 -36.88 64.27 Favored 'General case' 0 CA--C 1.582 2.191 0 CA-C-O 123.881 1.801 . . . . 0.0 112.98 -170.796 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.284 76.5 ttt-85 -66.37 -43.94 84.55 Favored 'General case' 0 CA--C 1.561 1.398 0 C-N-CA 129.742 3.217 . . . . 0.0 116.384 165.353 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -60.23 -43.93 95.64 Favored 'General case' 0 CA--C 1.565 1.53 0 C-N-CA 124.781 1.232 . . . . 0.0 114.083 162.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 42.1 t80 -72.25 -32.59 66.82 Favored 'General case' 0 CA--C 1.562 1.432 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 174.649 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.45 -25.37 54.31 Favored 'General case' 0 CA--C 1.569 1.678 0 CA-C-N 121.789 2.086 . . . . 0.0 114.299 164.392 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 61.6 m -62.35 -51.1 68.95 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-N 120.763 1.62 . . . . 0.0 112.422 161.033 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -54.59 -46.03 73.71 Favored 'General case' 0 CA--C 1.561 1.374 0 CA-C-O 117.059 -1.448 . . . . 0.0 113.873 164.148 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 37.6 mmt180 -82.01 21.11 0.91 Allowed 'General case' 0 CA--C 1.576 1.977 0 CA-C-N 122.35 2.341 . . . . 0.0 116.007 171.348 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -115.9 -31.62 5.7 Favored 'General case' 0 CA--C 1.569 1.687 0 C-N-CA 125.936 1.694 . . . . 0.0 114.834 152.507 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -60.25 -43.0 96.5 Favored 'General case' 0 CA--C 1.571 1.754 0 CA-C-N 121.258 1.844 . . . . 0.0 113.113 162.124 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 21.4 mm-40 . . . . . 0 CA--C 1.569 1.696 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 165.935 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.642 ' HA ' HG12 ' A' ' 18' ' ' VAL . 1.9 mmp_? . . . . . 0 CA--C 1.576 1.973 0 N-CA-C 116.383 1.994 . . . . 0.0 116.383 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -78.48 -22.57 47.31 Favored 'General case' 0 CA--C 1.568 1.66 0 O-C-N 119.336 -2.103 . . . . 0.0 114.767 141.289 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -73.37 -52.24 14.52 Favored 'General case' 0 CA--C 1.561 1.371 0 CA-C-O 117.019 -1.467 . . . . 0.0 109.765 170.704 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.642 HG12 ' HA ' ' A' ' 15' ' ' ARG . 3.9 p -44.92 -47.32 2.86 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.478 0 N-CA-C 117.654 2.464 . . . . 0.0 117.654 173.362 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -72.13 -39.3 68.91 Favored 'General case' 0 CA--C 1.588 2.415 0 CA-C-O 124.629 2.156 . . . . 0.0 113.226 -170.244 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.317 73.4 ttt180 -67.15 -40.91 86.75 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 130.866 3.666 . . . . 0.0 116.433 167.181 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -60.93 -41.96 97.22 Favored 'General case' 0 CA--C 1.562 1.429 0 C-N-CA 124.652 1.181 . . . . 0.0 113.887 160.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -68.54 -35.78 77.91 Favored 'General case' 0 CA--C 1.565 1.541 0 N-CA-C 115.752 1.76 . . . . 0.0 115.752 173.149 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.9 tptp -77.28 -24.07 51.06 Favored 'General case' 0 CA--C 1.568 1.639 0 CA-C-N 120.831 1.65 . . . . 0.0 115.338 165.0 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 38.3 m -65.82 -47.75 73.99 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-N 120.253 1.388 . . . . 0.0 112.373 161.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 58.4 tp -56.63 -42.72 79.34 Favored 'General case' 0 CA--C 1.558 1.255 0 CA-C-O 116.847 -1.549 . . . . 0.0 114.306 162.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 92.6 mtt-85 -84.8 27.68 0.73 Allowed 'General case' 0 CA--C 1.578 2.02 0 CA-C-N 122.182 2.265 . . . . 0.0 114.746 166.701 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -111.76 -26.24 9.07 Favored 'General case' 0 CA--C 1.571 1.764 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 140.136 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -64.18 -46.23 84.87 Favored 'General case' 0 CA--C 1.572 1.801 0 CA-C-N 122.869 2.577 . . . . 0.0 112.424 165.611 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 82.5 mt-30 . . . . . 0 CA--C 1.574 1.867 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 161.787 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.717 ' HA ' HG12 ' A' ' 18' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.576 1.955 0 N-CA-C 115.077 1.51 . . . . 0.0 115.077 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.4 m-20 -80.76 -1.13 41.57 Favored 'General case' 0 CA--C 1.576 1.952 0 CA-C-N 121.817 2.099 . . . . 0.0 116.21 152.975 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -90.36 -53.37 4.48 Favored 'General case' 0 CA--C 1.561 1.371 0 CA-C-O 117.331 -1.318 . . . . 0.0 108.148 159.153 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.717 HG12 ' HA ' ' A' ' 15' ' ' ARG . 2.5 p -52.8 -48.61 49.72 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.152 0 N-CA-C 116.849 2.166 . . . . 0.0 116.849 -177.89 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -74.16 -32.33 63.07 Favored 'General case' 0 CA--C 1.587 2.399 0 CA-C-O 123.015 1.388 . . . . 0.0 112.41 -171.553 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.271 76.1 ttt180 -66.48 -46.23 77.02 Favored 'General case' 0 CA--C 1.559 1.309 0 C-N-CA 128.732 2.813 . . . . 0.0 115.9 165.743 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -59.0 -44.93 91.73 Favored 'General case' 0 CA--C 1.564 1.51 0 C-N-CA 124.738 1.215 . . . . 0.0 114.149 164.097 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -68.15 -36.39 79.58 Favored 'General case' 0 CA--C 1.56 1.363 0 N-CA-C 115.671 1.73 . . . . 0.0 115.671 175.258 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.45 -22.08 41.47 Favored 'General case' 0 CA--C 1.571 1.766 0 CA-C-N 121.445 1.93 . . . . 0.0 114.896 167.223 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 60.1 m -64.42 -49.96 69.48 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-N 120.722 1.601 . . . . 0.0 112.834 160.342 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.3 tt -67.97 -30.45 69.74 Favored 'General case' 0 CA--C 1.561 1.397 0 CA-C-O 116.646 -1.645 . . . . 0.0 114.387 168.782 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 65.7 mtt180 -90.5 27.63 1.67 Allowed 'General case' 0 CA--C 1.572 1.792 0 CA-C-N 123.615 2.916 . . . . 0.0 114.401 161.176 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -103.6 -29.7 10.94 Favored 'General case' 0 CA--C 1.568 1.637 0 CA-C-O 115.994 -1.955 . . . . 0.0 114.288 137.44 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -73.98 -35.24 64.45 Favored 'General case' 0 CA--C 1.584 2.263 0 CA-C-N 123.953 3.07 . . . . 0.0 112.361 171.173 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 . . . . . 0 CA--C 1.576 1.952 0 N-CA-C 115.492 1.664 . . . . 0.0 115.492 157.939 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 38.7 t . . . . . 0 CA--C 1.564 1.514 0 CA-C-O 119.465 -0.302 . . . . 0.0 110.208 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.9 p -148.84 -79.14 0.14 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.249 -0.907 . . . . 0.0 109.466 -172.198 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 10.3 tp -72.64 -41.88 62.78 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.249 0 CA-C-N 119.395 0.998 . . . . 0.0 111.907 162.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.467 ' H ' HD23 ' A' ' 4' ' ' LEU . 0.8 OUTLIER -78.03 74.55 4.58 Favored 'General case' 0 CA--C 1.574 1.888 0 CA-C-O 122.808 1.289 . . . . 0.0 110.663 162.81 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -139.43 -65.63 0.47 Allowed 'General case' 0 N--CA 1.492 1.649 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.496 -179.362 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 65.5 mt -87.9 79.77 1.73 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.892 0 CA-C-O 124.21 1.957 . . . . 0.0 107.755 -172.146 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.1 tpm_? -83.68 -32.84 25.37 Favored 'General case' 0 CA--C 1.573 1.828 0 CA-C-N 112.73 -2.032 . . . . 0.0 114.108 -174.202 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 52.3 mt-30 63.53 87.11 0.11 Allowed 'General case' 0 N--CA 1.502 2.16 0 C-N-CA 125.462 1.505 . . . . 0.0 112.389 176.513 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -171.02 83.39 0.08 OUTLIER Glycine 0 CA--C 1.553 2.425 0 CA-C-O 116.72 -2.156 . . . . 0.0 113.238 174.678 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -69.35 148.49 67.84 Favored 'Trans proline' 0 CA--C 1.565 2.037 0 CA-C-N 122.22 3.01 . . . . 0.0 115.477 -174.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 49.4 mttp -134.89 -71.89 0.48 Allowed 'General case' 0 N--CA 1.498 1.943 0 CA-C-O 118.4 -0.81 . . . . 0.0 110.316 -167.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -63.46 -47.25 83.9 Favored Pre-proline 0 CA--C 1.578 2.053 0 CA-C-O 115.072 -2.394 . . . . 0.0 114.446 176.707 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -47.95 -40.25 32.84 Favored 'Trans proline' 0 C--N 1.375 1.93 0 CA-C-N 126.933 3.512 . . . . 0.0 117.575 162.072 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -93.36 -27.67 16.63 Favored 'General case' 0 CA--C 1.559 1.327 0 N-CA-C 114.951 1.463 . . . . 0.0 114.951 -164.128 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.645 ' HA ' HG12 ' A' ' 18' ' ' VAL . 2.4 mmp_? -103.37 -6.21 22.17 Favored 'General case' 0 CA--C 1.575 1.907 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 171.159 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -85.87 -7.55 58.63 Favored 'General case' 0 CA--C 1.582 2.183 0 O-C-N 119.513 -1.992 . . . . 0.0 114.698 145.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -79.86 -56.91 3.93 Favored 'General case' 0 CA--C 1.559 1.326 0 O-C-N 120.474 -1.391 . . . . 0.0 109.17 160.417 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.645 HG12 ' HA ' ' A' ' 15' ' ' ARG . 2.8 p -46.94 -42.06 5.88 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.448 0 N-CA-C 118.037 2.606 . . . . 0.0 118.037 179.512 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -74.42 -44.05 53.57 Favored 'General case' 0 CA--C 1.587 2.392 0 CA-C-O 124.542 2.115 . . . . 0.0 112.037 -166.511 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.295 21.1 ttp180 -55.18 -46.8 75.82 Favored 'General case' 0 CA--C 1.559 1.325 0 C-N-CA 129.584 3.154 . . . . 0.0 117.5 157.614 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -57.36 -41.61 80.47 Favored 'General case' 0 CA--C 1.574 1.868 0 N-CA-C 114.201 1.186 . . . . 0.0 114.201 163.643 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 27.3 t80 -72.49 -36.16 68.34 Favored 'General case' 0 CA--C 1.557 1.235 0 N-CA-C 115.201 1.556 . . . . 0.0 115.201 177.683 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.419 ' HA ' ' HB2' ' A' ' 26' ' ' ARG . 38.7 tptt -78.64 -19.77 51.85 Favored 'General case' 0 CA--C 1.568 1.672 0 CA-C-N 121.978 2.172 . . . . 0.0 115.097 163.351 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 53.0 m -64.72 -50.16 68.02 Favored 'General case' 0 N--CA 1.496 1.845 0 CA-C-N 121.196 1.817 . . . . 0.0 112.398 161.728 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.2 tt -63.25 -36.35 83.36 Favored 'General case' 0 CA--C 1.568 1.648 0 CA-C-N 120.124 1.329 . . . . 0.0 114.127 165.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.419 ' HB2' ' HA ' ' A' ' 23' ' ' LYS . 16.8 mmt85 -83.55 31.52 0.47 Allowed 'General case' 0 CA--C 1.577 1.984 0 CA-C-N 121.911 2.141 . . . . 0.0 114.627 160.84 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -119.42 -23.86 6.52 Favored 'General case' 0 CA--C 1.569 1.704 0 C-N-CA 125.742 1.617 . . . . 0.0 114.803 138.429 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -59.57 -43.74 93.52 Favored 'General case' 0 CA--C 1.571 1.781 0 CA-C-N 122.332 2.333 . . . . 0.0 112.911 163.347 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -72.16 -52.99 14.06 Favored 'General case' 0 CA--C 1.571 1.783 0 C-N-CA 123.664 0.786 . . . . 0.0 112.835 170.42 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -168.64 115.43 0.65 Allowed 'General case' 0 CA--C 1.562 1.405 0 CA-C-N 119.59 1.086 . . . . 0.0 110.249 -178.084 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 99.6 p . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 123.122 1.439 . . . . 0.0 114.057 -173.537 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 72.6 m . . . . . 0 CA--C 1.566 1.587 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.7 m -157.62 -67.27 0.09 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 120.779 -1.201 . . . . 0.0 110.525 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 11.3 tp -66.59 -37.53 79.75 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.326 0 N-CA-C 114.725 1.38 . . . . 0.0 114.725 -175.142 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.4 pp -95.8 41.24 1.1 Allowed 'General case' 0 CA--C 1.575 1.915 0 N-CA-C 114.218 1.192 . . . . 0.0 114.218 167.53 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -153.85 -67.21 0.14 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.74 -1.225 . . . . 0.0 110.613 -171.432 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 48.3 mt -85.29 81.19 1.8 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.966 0 CA-C-O 124.832 2.253 . . . . 0.0 107.362 -177.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 55.3 ttp180 -170.13 -31.67 0.02 OUTLIER 'General case' 0 CA--C 1.575 1.939 0 CA-C-N 111.377 -2.647 . . . . 0.0 111.657 -160.51 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -130.86 97.99 4.49 Favored 'General case' 0 CA--C 1.563 1.48 0 C-N-CA 124.858 1.263 . . . . 0.0 109.202 -168.686 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -119.05 96.69 0.67 Allowed Glycine 0 CA--C 1.552 2.36 0 CA-C-O 116.739 -2.145 . . . . 0.0 114.317 -173.763 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_exo -55.37 159.17 10.98 Favored 'Trans proline' 0 CA--C 1.565 2.06 0 CA-C-N 122.321 3.061 . . . . 0.0 117.15 -178.692 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.98 105.32 8.53 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 -172.766 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 104.3 -55.46 0.0 OUTLIER Pre-proline 0 N--CA 1.509 2.488 0 CA-C-O 114.266 -2.778 . . . . 0.0 110.261 -175.395 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_exo -58.77 -47.56 18.05 Favored 'Trans proline' 0 C--N 1.378 2.109 0 CA-C-N 127.77 3.811 . . . . 0.0 117.525 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -70.53 -13.8 62.25 Favored 'General case' 0 CA--C 1.57 1.736 0 N-CA-C 117.317 2.34 . . . . 0.0 117.317 -159.951 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.706 ' HA ' HG12 ' A' ' 18' ' ' VAL . 0.0 OUTLIER -101.87 -10.8 19.54 Favored 'General case' 0 CA--C 1.575 1.932 0 N-CA-C 115.784 1.772 . . . . 0.0 115.784 168.453 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -84.15 -7.76 59.27 Favored 'General case' 0 CA--C 1.576 1.981 0 CA-C-N 121.709 2.05 . . . . 0.0 115.628 150.117 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -83.26 -54.55 4.92 Favored 'General case' 0 CA--C 1.559 1.32 0 CA-C-O 117.398 -1.287 . . . . 0.0 108.816 162.284 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.706 HG12 ' HA ' ' A' ' 15' ' ' ARG . 2.9 p -50.85 -43.92 25.79 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.254 0 N-CA-C 117.731 2.493 . . . . 0.0 117.731 -179.386 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -75.59 -35.6 60.53 Favored 'General case' 0 CA--C 1.59 2.493 0 CA-C-O 123.541 1.639 . . . . 0.0 112.22 -170.254 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.293 9.9 ttp180 -64.63 -41.06 96.42 Favored 'General case' 0 CA--C 1.566 1.582 0 C-N-CA 129.095 2.958 . . . . 0.0 116.751 161.683 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -58.67 -42.26 88.06 Favored 'General case' 0 CA--C 1.574 1.892 0 C-N-CA 124.691 1.196 . . . . 0.0 114.131 160.478 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 43.2 t80 -70.98 -34.32 71.28 Favored 'General case' 0 CA--C 1.563 1.451 0 N-CA-C 115.752 1.76 . . . . 0.0 115.752 175.136 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.0 tppt? -78.76 -21.12 48.42 Favored 'General case' 0 CA--C 1.567 1.599 0 CA-C-N 121.315 1.87 . . . . 0.0 114.914 162.68 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 56.3 m -63.62 -51.72 64.02 Favored 'General case' 0 N--CA 1.497 1.912 0 CA-C-N 121.373 1.897 . . . . 0.0 112.063 159.458 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 42.7 tp -62.64 -38.45 90.32 Favored 'General case' 0 CA--C 1.556 1.181 0 CA-C-O 116.097 -1.906 . . . . 0.0 114.664 168.397 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 92.4 mtt180 -92.57 36.2 1.01 Allowed 'General case' 0 CA--C 1.571 1.758 0 CA-C-N 123.407 2.821 . . . . 0.0 114.258 164.59 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -109.83 -28.61 8.69 Favored 'General case' 0 CA--C 1.57 1.726 0 C-N-CA 125.246 1.418 . . . . 0.0 114.518 133.157 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -62.98 -44.86 94.87 Favored 'General case' 0 CA--C 1.574 1.892 0 CA-C-N 122.879 2.582 . . . . 0.0 112.814 165.641 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -72.92 -36.03 67.16 Favored 'General case' 0 CA--C 1.571 1.757 0 CA-C-O 117.631 -1.176 . . . . 0.0 114.171 169.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -140.44 68.33 1.35 Allowed 'General case' 0 CA--C 1.566 1.581 0 CA-C-N 120.971 1.714 . . . . 0.0 114.057 -173.589 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 84.1 p . . . . . 0 N--CA 1.506 2.351 0 C-N-CA 126.233 1.813 . . . . 0.0 115.675 172.778 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 42.2 t . . . . . 0 CA--C 1.561 1.394 0 N-CA-C 110.283 -0.265 . . . . 0.0 110.283 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 96.5 p -143.38 156.05 44.58 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.64 0.733 . . . . 0.0 111.365 -176.802 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -63.96 -42.54 96.08 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.254 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 -179.283 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.3 pp -73.95 1.92 9.75 Favored 'General case' 0 N--CA 1.504 2.229 0 N-CA-C 117.97 2.582 . . . . 0.0 117.97 170.052 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -100.35 -66.16 0.92 Allowed 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 124.212 1.005 . . . . 0.0 109.572 166.555 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 18.4 mt -91.26 82.28 1.88 Allowed 'Isoleucine or valine' 0 CA--C 1.57 1.734 0 CA-C-O 123.546 1.641 . . . . 0.0 107.174 174.219 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 14.9 ptp180 -97.94 -14.25 20.73 Favored 'General case' 0 CA--C 1.575 1.932 0 CA-C-N 113.282 -1.781 . . . . 0.0 115.435 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -79.24 91.58 5.01 Favored 'General case' 0 CA--C 1.568 1.651 0 CA-C-N 120.636 1.562 . . . . 0.0 113.295 -165.547 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -98.99 103.72 2.78 Favored Glycine 0 CA--C 1.553 2.423 0 CA-C-O 116.635 -2.203 . . . . 0.0 112.394 172.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -72.8 127.18 12.03 Favored 'Trans proline' 0 CA--C 1.561 1.853 0 CA-C-N 123.028 3.414 . . . . 0.0 115.062 -169.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -173.67 -44.14 0.01 OUTLIER 'General case' 0 CA--C 1.572 1.795 0 CA-C-N 112.479 -2.146 . . . . 0.0 110.923 -175.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -120.91 -44.13 0.04 OUTLIER Pre-proline 0 CA--C 1.58 2.105 0 CA-C-O 115.043 -2.408 . . . . 0.0 111.697 179.499 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_exo -62.47 -13.15 31.43 Favored 'Trans proline' 0 C--N 1.38 2.188 0 CA-C-N 126.614 3.398 . . . . 0.0 120.034 176.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 15.5 p90 -78.49 25.96 0.24 Allowed 'General case' 0 CA--C 1.574 1.903 0 N-CA-C 117.717 2.488 . . . . 0.0 117.717 -152.418 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.686 ' HA ' HG12 ' A' ' 18' ' ' VAL . 0.0 OUTLIER -92.24 -6.46 50.45 Favored 'General case' 0 CA--C 1.583 2.235 0 O-C-N 120.058 -1.651 . . . . 0.0 114.626 148.102 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -85.9 -6.47 59.07 Favored 'General case' 0 CA--C 1.581 2.154 0 O-C-N 119.335 -2.103 . . . . 0.0 115.614 150.392 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -83.39 -50.94 7.83 Favored 'General case' 0 CA--C 1.561 1.385 0 CA-C-O 118.188 -0.91 . . . . 0.0 109.461 159.154 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.686 HG12 ' HA ' ' A' ' 15' ' ' ARG . 3.3 p -53.44 -47.57 58.67 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.296 0 N-CA-C 116.21 1.93 . . . . 0.0 116.21 -177.755 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -75.12 -27.89 60.0 Favored 'General case' 0 CA--C 1.589 2.444 0 CA-C-O 122.766 1.269 . . . . 0.0 112.723 -172.619 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.283 51.2 ttm-85 -70.21 -46.9 63.57 Favored 'General case' 0 CA--C 1.562 1.422 0 C-N-CA 129.084 2.954 . . . . 0.0 115.545 165.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 43.0 t80 -57.06 -46.22 82.62 Favored 'General case' 0 CA--C 1.567 1.606 0 N-CA-C 114.595 1.332 . . . . 0.0 114.595 163.112 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -74.2 -31.55 62.69 Favored 'General case' 0 CA--C 1.562 1.411 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 177.162 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.7 tptp -75.12 -26.12 58.98 Favored 'General case' 0 CA--C 1.568 1.664 0 CA-C-N 121.131 1.787 . . . . 0.0 115.18 162.363 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 79.1 m -64.11 -48.97 74.07 Favored 'General case' 0 N--CA 1.494 1.748 0 CA-C-N 120.207 1.367 . . . . 0.0 112.969 161.702 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 57.2 tp -56.62 -41.55 77.27 Favored 'General case' 0 CA--C 1.557 1.247 0 CA-C-O 116.829 -1.558 . . . . 0.0 114.156 163.101 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 71.1 mtt-85 -82.71 21.93 0.95 Allowed 'General case' 0 CA--C 1.574 1.886 0 CA-C-N 122.371 2.351 . . . . 0.0 115.316 168.317 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -108.1 -26.28 10.71 Favored 'General case' 0 CA--C 1.569 1.676 0 N-CA-C 115.276 1.584 . . . . 0.0 115.276 143.289 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -64.64 -47.11 79.73 Favored 'General case' 0 CA--C 1.574 1.886 0 CA-C-N 122.754 2.524 . . . . 0.0 112.267 164.788 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -65.63 -37.87 87.8 Favored 'General case' 0 CA--C 1.576 1.955 0 N-CA-C 115.833 1.79 . . . . 0.0 115.833 163.214 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 72.7 84.16 0.12 Allowed 'General case' 0 N--CA 1.499 2.003 0 C-N-CA 126.682 1.993 . . . . 0.0 110.748 -170.118 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 31.4 t . . . . . 0 N--CA 1.488 1.429 0 CA-C-O 125.587 2.613 . . . . 0.0 110.49 -178.441 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 38.1 t . . . . . 0 CA--C 1.574 1.891 0 CA-C-O 120.696 0.284 . . . . 0.0 111.555 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 74.4 m -103.39 -65.84 0.98 Allowed 'General case' 0 N--CA 1.497 1.878 0 O-C-N 120.635 -1.29 . . . . 0.0 111.506 176.382 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 10.1 tp -76.2 -56.21 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.11 0 CA-C-N 119.042 0.837 . . . . 0.0 112.678 -171.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 94.3 mt -87.24 72.49 9.87 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-N 120.341 1.428 . . . . 0.0 109.768 174.578 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -154.48 -40.42 0.09 Allowed 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 114.524 1.305 . . . . 0.0 114.524 -172.457 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 40.2 mt -92.33 79.1 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.851 0 CA-C-O 124.071 1.891 . . . . 0.0 108.309 -161.651 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.34 73.6 1.26 Allowed 'General case' 0 CA--C 1.569 1.702 0 CA-C-N 112.701 -2.045 . . . . 0.0 108.693 160.902 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -72.28 143.95 48.55 Favored 'General case' 0 CA--C 1.571 1.763 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 -170.677 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -114.45 87.03 0.43 Allowed Glycine 0 CA--C 1.553 2.46 0 CA-C-O 117.16 -1.911 . . . . 0.0 111.414 166.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -78.6 161.2 28.07 Favored 'Trans proline' 0 CA--C 1.567 2.155 0 CA-C-N 122.652 3.226 . . . . 0.0 116.445 -161.704 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -130.26 -72.09 0.58 Allowed 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 115.311 -0.859 . . . . 0.0 108.965 165.028 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.2 pm0 -68.51 -27.23 1.38 Allowed Pre-proline 0 CA--C 1.583 2.227 0 CA-C-O 114.401 -2.714 . . . . 0.0 116.525 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -56.94 -30.05 84.58 Favored 'Trans proline' 0 C--N 1.376 2.011 0 CA-C-N 127.618 3.756 . . . . 0.0 117.879 164.505 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -66.21 -18.58 65.44 Favored 'General case' 0 CA--C 1.568 1.672 0 N-CA-C 117.897 2.554 . . . . 0.0 117.897 -157.242 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.685 ' HA ' HG12 ' A' ' 18' ' ' VAL . 0.0 OUTLIER -102.99 -5.74 23.09 Favored 'General case' 0 CA--C 1.578 2.022 0 N-CA-C 115.957 1.836 . . . . 0.0 115.957 167.32 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -84.93 -11.26 55.95 Favored 'General case' 0 CA--C 1.575 1.922 0 CA-C-N 121.498 1.954 . . . . 0.0 115.652 147.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -79.47 -55.1 5.29 Favored 'General case' 0 CA--C 1.558 1.279 0 CA-C-O 117.456 -1.259 . . . . 0.0 108.433 163.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.685 HG12 ' HA ' ' A' ' 15' ' ' ARG . 3.8 p -48.51 -48.13 14.51 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.225 0 N-CA-C 117.382 2.364 . . . . 0.0 117.382 -179.287 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -75.4 -30.79 60.23 Favored 'General case' 0 CA--C 1.587 2.383 0 CA-C-O 123.213 1.482 . . . . 0.0 112.778 -171.523 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.274 18.4 ttp85 -73.65 -40.6 63.61 Favored 'General case' 0 CA--C 1.563 1.444 0 C-N-CA 129.084 2.954 . . . . 0.0 115.762 168.352 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -60.03 -45.1 93.93 Favored 'General case' 0 CA--C 1.563 1.474 0 C-N-CA 125.046 1.338 . . . . 0.0 114.122 161.625 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -66.74 -39.77 88.08 Favored 'General case' 0 CA--C 1.558 1.287 0 N-CA-C 115.099 1.518 . . . . 0.0 115.099 172.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.2 tppt? -73.67 -24.57 59.98 Favored 'General case' 0 CA--C 1.562 1.438 0 CA-C-N 121.989 2.177 . . . . 0.0 114.836 165.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 56.2 m -62.18 -52.04 65.41 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-N 121.241 1.837 . . . . 0.0 111.867 161.485 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.45 -46.73 83.29 Favored 'General case' 0 CA--C 1.564 1.507 0 CA-C-N 120.759 1.618 . . . . 0.0 113.465 167.062 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 -83.2 33.98 0.46 Allowed 'General case' 0 CA--C 1.583 2.227 0 CA-C-N 122.104 2.229 . . . . 0.0 115.031 169.043 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -132.54 -33.74 1.23 Allowed 'General case' 0 CA--C 1.571 1.772 0 C-N-CA 127.168 2.187 . . . . 0.0 112.882 155.201 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -55.81 -44.08 77.51 Favored 'General case' 0 CA--C 1.566 1.593 0 CA-C-N 121.69 2.041 . . . . 0.0 113.3 160.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 -66.34 -51.16 60.06 Favored 'General case' 0 CA--C 1.57 1.75 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 165.233 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -88.24 68.83 9.08 Favored 'General case' 0 CA--C 1.571 1.775 0 CA-C-N 119.538 1.063 . . . . 0.0 112.976 178.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.2 m . . . . . 0 N--CA 1.489 1.481 0 CA-C-O 124.835 2.255 . . . . 0.0 109.2 -179.918 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 75.1 m . . . . . 0 CA--C 1.561 1.384 0 CA-C-O 120.322 0.106 . . . . 0.0 111.149 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 80.9 p -84.67 175.38 9.25 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 122.578 1.18 . . . . 0.0 113.416 173.819 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 10.4 tp -73.85 -39.07 51.63 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.211 0 O-C-N 121.449 -0.782 . . . . 0.0 113.034 171.083 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 94.0 mt -83.06 66.06 8.47 Favored 'General case' 0 CA--C 1.574 1.875 0 CA-C-N 120.22 1.373 . . . . 0.0 111.108 169.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -131.09 -75.42 0.52 Allowed 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 -173.64 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 35.7 mt -89.77 85.51 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 CA-C-O 123.787 1.756 . . . . 0.0 107.247 179.263 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 56.9 mtm180 -92.33 39.34 1.02 Allowed 'General case' 0 CA--C 1.58 2.101 0 CA-C-N 113.224 -1.807 . . . . 0.0 113.277 -178.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -82.15 90.21 6.55 Favored 'General case' 0 CA--C 1.568 1.642 0 CA-C-O 123.084 1.421 . . . . 0.0 111.967 -170.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -156.05 155.14 26.07 Favored Glycine 0 CA--C 1.556 2.624 0 CA-C-O 118.192 -1.338 . . . . 0.0 113.428 178.651 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -73.3 150.88 47.82 Favored 'Trans proline' 0 CA--C 1.567 2.131 0 CA-C-N 121.74 2.77 . . . . 0.0 115.164 -178.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.6 mptt -138.26 -61.99 0.59 Allowed 'General case' 0 N--CA 1.496 1.839 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.573 174.516 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -77.33 -47.59 2.53 Favored Pre-proline 0 CA--C 1.578 2.035 0 CA-C-O 115.062 -2.399 . . . . 0.0 114.389 178.528 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -86.87 -155.91 0.06 OUTLIER 'Trans proline' 0 CA--C 1.57 2.283 0 CA-C-N 126.548 3.374 . . . . 0.0 112.836 -177.281 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -154.59 57.01 0.69 Allowed 'General case' 0 CA--C 1.567 1.599 0 CA-C-N 113.612 -1.631 . . . . 0.0 112.395 161.485 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.674 ' HA ' HG12 ' A' ' 18' ' ' VAL . 0.0 OUTLIER -135.88 -22.1 1.43 Allowed 'General case' 0 CA--C 1.577 2.015 0 N-CA-C 114.948 1.462 . . . . 0.0 114.948 -175.965 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -80.09 -5.75 56.47 Favored 'General case' 0 CA--C 1.58 2.101 0 O-C-N 119.14 -2.225 . . . . 0.0 115.187 141.44 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -75.01 -61.46 1.88 Allowed 'General case' 0 CA--C 1.557 1.228 0 O-C-N 121.027 -1.046 . . . . 0.0 108.448 157.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.674 HG12 ' HA ' ' A' ' 15' ' ' ARG . 3.7 p -50.27 -44.66 23.59 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.358 0 N-CA-C 117.634 2.457 . . . . 0.0 117.634 -173.868 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -72.76 -39.14 67.06 Favored 'General case' 0 CA--C 1.586 2.357 0 CA-C-O 124.355 2.026 . . . . 0.0 113.01 -171.364 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.302 51.4 ttt180 -68.13 -42.96 79.41 Favored 'General case' 0 CA--C 1.56 1.347 0 C-N-CA 130.424 3.489 . . . . 0.0 115.703 168.657 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 45.2 t80 -56.61 -46.31 80.97 Favored 'General case' 0 CA--C 1.562 1.421 0 C-N-CA 124.918 1.287 . . . . 0.0 114.35 159.333 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 35.1 t80 -71.81 -34.04 69.02 Favored 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 115.756 1.762 . . . . 0.0 115.756 178.519 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.7 tptp -76.34 -26.46 55.75 Favored 'General case' 0 CA--C 1.567 1.613 0 CA-C-N 120.848 1.658 . . . . 0.0 115.176 164.25 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 62.4 m -62.56 -49.69 74.27 Favored 'General case' 0 N--CA 1.496 1.829 0 CA-C-N 120.456 1.48 . . . . 0.0 112.786 160.62 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -55.99 -42.76 76.84 Favored 'General case' 0 CA--C 1.562 1.406 0 CA-C-O 116.983 -1.484 . . . . 0.0 113.557 165.738 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 93.6 mtt-85 -82.02 16.9 1.74 Allowed 'General case' 0 CA--C 1.577 1.988 0 CA-C-N 122.056 2.207 . . . . 0.0 116.614 168.283 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -106.64 -36.62 6.68 Favored 'General case' 0 CA--C 1.569 1.704 0 C-N-CA 125.681 1.592 . . . . 0.0 114.189 152.455 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -59.28 -44.58 92.45 Favored 'General case' 0 CA--C 1.57 1.747 0 CA-C-N 120.81 1.641 . . . . 0.0 113.12 165.148 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -67.6 -38.1 83.5 Favored 'General case' 0 CA--C 1.573 1.858 0 N-CA-C 114.863 1.431 . . . . 0.0 114.863 161.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 55.95 75.76 0.32 Allowed 'General case' 0 N--CA 1.496 1.866 0 C-N-CA 125.572 1.549 . . . . 0.0 111.925 -163.7 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 52.9 m . . . . . 0 N--CA 1.493 1.676 0 CA-C-O 124.949 2.309 . . . . 0.0 109.577 -174.499 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 92.2 m . . . . . 0 CA--C 1.573 1.862 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 85.6 p -117.14 -77.5 0.57 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.716 -1.24 . . . . 0.0 111.628 -176.047 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 10.9 tp -72.69 -38.32 58.05 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.21 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 -168.147 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.9 pp -90.45 21.57 3.85 Favored 'General case' 0 N--CA 1.503 2.194 0 N-CA-C 116.286 1.958 . . . . 0.0 116.286 166.091 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -114.72 -64.21 1.35 Allowed 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 125.675 1.59 . . . . 0.0 109.338 177.457 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 14.3 mt -80.09 80.88 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.988 0 CA-C-O 123.713 1.72 . . . . 0.0 106.815 156.463 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 29.0 ttp180 -91.2 14.13 15.16 Favored 'General case' 0 CA--C 1.578 2.021 0 CA-C-N 113.535 -1.666 . . . . 0.0 114.874 -169.597 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 64.41 73.84 0.42 Allowed 'General case' 0 N--CA 1.502 2.155 0 C-N-CA 125.64 1.576 . . . . 0.0 113.241 160.182 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -105.47 -92.24 2.26 Favored Glycine 0 CA--C 1.55 2.223 0 CA-C-O 116.91 -2.05 . . . . 0.0 112.499 175.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -80.19 162.25 22.97 Favored 'Trans proline' 0 CA--C 1.563 1.962 0 CA-C-N 123.074 3.437 . . . . 0.0 115.587 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 59.5 pttt 64.24 -40.68 0.25 Allowed 'General case' 0 N--CA 1.512 2.626 0 C-N-CA 127.504 2.321 . . . . 0.0 116.704 167.453 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 58.1 tt0 -64.9 -35.08 11.79 Favored Pre-proline 0 CA--C 1.585 2.293 0 CA-C-O 114.75 -2.548 . . . . 0.0 115.516 168.399 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_exo -60.22 -52.95 3.43 Favored 'Trans proline' 0 C--N 1.377 2.035 0 CA-C-N 126.619 3.399 . . . . 0.0 118.557 -179.475 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 46.38 1.77 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.99 0 N-CA-C 119.377 3.103 . . . . 0.0 119.377 -153.688 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.628 ' HA ' HG12 ' A' ' 18' ' ' VAL . 2.3 mmp_? -113.65 -8.06 13.3 Favored 'General case' 0 CA--C 1.579 2.072 0 CA-C-N 121.028 1.74 . . . . 0.0 114.973 176.154 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -82.54 -10.71 58.87 Favored 'General case' 0 CA--C 1.578 2.044 0 O-C-N 119.323 -2.11 . . . . 0.0 115.431 144.448 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -80.63 -52.67 7.31 Favored 'General case' 0 CA--C 1.562 1.429 0 CA-C-O 117.305 -1.331 . . . . 0.0 109.578 162.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.628 HG12 ' HA ' ' A' ' 15' ' ' ARG . 3.0 p -48.27 -44.96 13.14 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.468 0 N-CA-C 117.097 2.258 . . . . 0.0 117.097 177.284 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -74.1 -36.88 64.27 Favored 'General case' 0 CA--C 1.582 2.191 0 CA-C-O 123.881 1.801 . . . . 0.0 112.98 -170.796 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.284 76.5 ttt-85 -66.37 -43.94 84.55 Favored 'General case' 0 CA--C 1.561 1.398 0 C-N-CA 129.742 3.217 . . . . 0.0 116.384 165.353 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -60.23 -43.93 95.64 Favored 'General case' 0 CA--C 1.565 1.53 0 C-N-CA 124.781 1.232 . . . . 0.0 114.083 162.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 42.1 t80 -72.25 -32.59 66.82 Favored 'General case' 0 CA--C 1.562 1.432 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 174.649 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.45 -25.37 54.31 Favored 'General case' 0 CA--C 1.569 1.678 0 CA-C-N 121.789 2.086 . . . . 0.0 114.299 164.392 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 61.6 m -62.35 -51.1 68.95 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-N 120.763 1.62 . . . . 0.0 112.422 161.033 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -54.59 -46.03 73.71 Favored 'General case' 0 CA--C 1.561 1.374 0 CA-C-O 117.059 -1.448 . . . . 0.0 113.873 164.148 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 37.6 mmt180 -82.01 21.11 0.91 Allowed 'General case' 0 CA--C 1.576 1.977 0 CA-C-N 122.35 2.341 . . . . 0.0 116.007 171.348 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -115.9 -31.62 5.7 Favored 'General case' 0 CA--C 1.569 1.687 0 C-N-CA 125.936 1.694 . . . . 0.0 114.834 152.507 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -60.25 -43.0 96.5 Favored 'General case' 0 CA--C 1.571 1.754 0 CA-C-N 121.258 1.844 . . . . 0.0 113.113 162.124 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 21.4 mm-40 -59.6 -43.18 93.8 Favored 'General case' 0 CA--C 1.569 1.696 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 165.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.15 -27.69 65.77 Favored 'General case' 0 CA--C 1.573 1.865 0 N-CA-C 116.271 1.952 . . . . 0.0 116.271 176.289 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 75.5 m . . . . . 0 N--CA 1.489 1.506 0 CA-C-O 124.645 2.164 . . . . 0.0 113.149 -170.088 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 42.4 t . . . . . 0 CA--C 1.563 1.449 0 CA-C-O 120.16 0.029 . . . . 0.0 110.98 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 54.0 p -109.36 -175.34 2.73 Favored 'General case' 0 CA--C 1.568 1.647 0 CA-C-O 122.658 1.218 . . . . 0.0 112.74 -179.18 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 11.0 tp -68.8 -34.47 64.8 Favored 'Isoleucine or valine' 0 CA--C 1.58 2.121 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 173.495 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 95.2 mt -84.92 39.55 0.76 Allowed 'General case' 0 N--CA 1.503 2.193 0 CA-C-N 120.913 1.688 . . . . 0.0 114.848 175.647 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -124.26 -18.47 5.82 Favored 'General case' 0 CA--C 1.574 1.868 0 C-N-CA 124.973 1.309 . . . . 0.0 114.187 179.038 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 69.2 mt -89.09 85.78 2.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 CA-C-N 121.244 1.838 . . . . 0.0 108.315 -164.127 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 79.5 mtt85 -104.34 43.6 1.09 Allowed 'General case' 0 CA--C 1.581 2.149 0 CA-C-N 113.263 -1.79 . . . . 0.0 112.539 178.38 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -94.42 63.73 3.03 Favored 'General case' 0 CA--C 1.571 1.774 0 O-C-N 120.794 -1.191 . . . . 0.0 113.646 -166.675 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -84.98 158.02 32.76 Favored Glycine 0 CA--C 1.562 2.991 0 CA-C-O 118.265 -1.297 . . . . 0.0 114.511 164.464 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -70.75 133.0 22.81 Favored 'Trans proline' 0 CA--C 1.563 1.945 0 CA-C-N 122.229 3.014 . . . . 0.0 114.554 -174.758 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 73.9 mttt -137.92 -65.89 0.51 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-N 113.915 -1.493 . . . . 0.0 109.611 -165.398 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -80.11 -43.25 1.44 Allowed Pre-proline 0 CA--C 1.586 2.334 0 CA-C-O 114.933 -2.46 . . . . 0.0 114.451 172.16 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -59.3 -29.45 90.3 Favored 'Trans proline' 0 C--N 1.376 1.997 0 CA-C-N 126.586 3.388 . . . . 0.0 119.613 -176.249 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.4 p90 -62.85 -10.68 14.1 Favored 'General case' 0 CA--C 1.574 1.872 0 N-CA-C 117.925 2.565 . . . . 0.0 117.925 -158.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.642 ' HA ' HG12 ' A' ' 18' ' ' VAL . 1.9 mmp_? -111.57 -4.29 14.83 Favored 'General case' 0 CA--C 1.576 1.973 0 N-CA-C 116.383 1.994 . . . . 0.0 116.383 172.091 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -78.48 -22.57 47.31 Favored 'General case' 0 CA--C 1.568 1.66 0 O-C-N 119.336 -2.103 . . . . 0.0 114.767 141.289 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -73.37 -52.24 14.52 Favored 'General case' 0 CA--C 1.561 1.371 0 CA-C-O 117.019 -1.467 . . . . 0.0 109.765 170.704 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.642 HG12 ' HA ' ' A' ' 15' ' ' ARG . 3.9 p -44.92 -47.32 2.86 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.478 0 N-CA-C 117.654 2.464 . . . . 0.0 117.654 173.362 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -72.13 -39.3 68.91 Favored 'General case' 0 CA--C 1.588 2.415 0 CA-C-O 124.629 2.156 . . . . 0.0 113.226 -170.244 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.317 73.4 ttt180 -67.15 -40.91 86.75 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 130.866 3.666 . . . . 0.0 116.433 167.181 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -60.93 -41.96 97.22 Favored 'General case' 0 CA--C 1.562 1.429 0 C-N-CA 124.652 1.181 . . . . 0.0 113.887 160.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -68.54 -35.78 77.91 Favored 'General case' 0 CA--C 1.565 1.541 0 N-CA-C 115.752 1.76 . . . . 0.0 115.752 173.149 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.9 tptp -77.28 -24.07 51.06 Favored 'General case' 0 CA--C 1.568 1.639 0 CA-C-N 120.831 1.65 . . . . 0.0 115.338 165.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 38.3 m -65.82 -47.75 73.99 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-N 120.253 1.388 . . . . 0.0 112.373 161.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 58.4 tp -56.63 -42.72 79.34 Favored 'General case' 0 CA--C 1.558 1.255 0 CA-C-O 116.847 -1.549 . . . . 0.0 114.306 162.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 92.6 mtt-85 -84.8 27.68 0.73 Allowed 'General case' 0 CA--C 1.578 2.02 0 CA-C-N 122.182 2.265 . . . . 0.0 114.746 166.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -111.76 -26.24 9.07 Favored 'General case' 0 CA--C 1.571 1.764 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 140.136 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -64.18 -46.23 84.87 Favored 'General case' 0 CA--C 1.572 1.801 0 CA-C-N 122.869 2.577 . . . . 0.0 112.424 165.611 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 82.5 mt-30 -62.78 -47.86 81.64 Favored 'General case' 0 CA--C 1.574 1.867 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 161.787 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 66.65 -63.78 0.25 Allowed 'General case' 0 N--CA 1.499 2.003 0 C-N-CA 126.504 1.922 . . . . 0.0 114.202 -178.472 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 52.9 m . . . . . 0 N--CA 1.492 1.675 0 CA-C-O 123.342 1.544 . . . . 0.0 109.373 174.481 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 42.7 t . . . . . 0 CA--C 1.567 1.626 0 CA-C-O 116.605 -1.664 . . . . 0.0 108.101 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 43.8 t -166.05 -104.49 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 CA-C-N 122.489 2.404 . . . . 0.0 107.66 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . 0.276 7.9 tp 34.98 36.8 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.512 2.653 0 N-CA-C 118.108 2.633 . . . . 0.0 118.108 -174.088 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 73.8 mt 38.91 43.24 0.73 Allowed 'General case' 0 N--CA 1.509 2.483 0 C-N-CA 126.126 1.771 . . . . 0.0 115.534 -167.363 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -162.72 -58.21 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.248 0 O-C-N 121.479 -0.763 . . . . 0.0 111.465 -165.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 53.3 mt -90.84 79.75 1.62 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.877 0 CA-C-O 124.215 1.96 . . . . 0.0 107.835 -164.615 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.65 -28.25 26.56 Favored 'General case' 0 CA--C 1.57 1.743 0 CA-C-N 112.696 -2.047 . . . . 0.0 114.202 -174.434 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 59.42 80.57 0.19 Allowed 'General case' 0 N--CA 1.502 2.159 0 C-N-CA 125.812 1.645 . . . . 0.0 111.233 -179.378 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 121.99 -174.91 16.23 Favored Glycine 0 CA--C 1.562 3.012 0 CA-C-N 115.294 -0.866 . . . . 0.0 114.477 -168.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -66.38 140.0 56.42 Favored 'Trans proline' 0 CA--C 1.565 2.052 0 CA-C-N 121.304 2.552 . . . . 0.0 115.424 -175.162 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -134.29 -54.54 0.85 Allowed 'General case' 0 N--CA 1.494 1.768 0 CA-C-N 115.32 -0.855 . . . . 0.0 111.494 178.435 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -88.96 -45.87 0.43 Allowed Pre-proline 0 CA--C 1.575 1.937 0 CA-C-O 115.058 -2.401 . . . . 0.0 113.982 -178.11 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -56.89 -47.85 21.28 Favored 'Trans proline' 0 C--N 1.377 2.063 0 CA-C-N 126.492 3.354 . . . . 0.0 117.035 179.111 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -75.26 -7.07 52.91 Favored 'General case' 0 CA--C 1.573 1.832 0 N-CA-C 116.059 1.874 . . . . 0.0 116.059 -164.575 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.717 ' HA ' HG12 ' A' ' 18' ' ' VAL . 0.0 OUTLIER -98.64 -19.47 17.53 Favored 'General case' 0 CA--C 1.576 1.955 0 N-CA-C 115.077 1.51 . . . . 0.0 115.077 165.642 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.4 m-20 -80.76 -1.13 41.57 Favored 'General case' 0 CA--C 1.576 1.952 0 CA-C-N 121.817 2.099 . . . . 0.0 116.21 152.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -90.36 -53.37 4.48 Favored 'General case' 0 CA--C 1.561 1.371 0 CA-C-O 117.331 -1.318 . . . . 0.0 108.148 159.153 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.717 HG12 ' HA ' ' A' ' 15' ' ' ARG . 2.5 p -52.8 -48.61 49.72 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.152 0 N-CA-C 116.849 2.166 . . . . 0.0 116.849 -177.89 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -74.16 -32.33 63.07 Favored 'General case' 0 CA--C 1.587 2.399 0 CA-C-O 123.015 1.388 . . . . 0.0 112.41 -171.553 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.271 76.1 ttt180 -66.48 -46.23 77.02 Favored 'General case' 0 CA--C 1.559 1.309 0 C-N-CA 128.732 2.813 . . . . 0.0 115.9 165.743 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -59.0 -44.93 91.73 Favored 'General case' 0 CA--C 1.564 1.51 0 C-N-CA 124.738 1.215 . . . . 0.0 114.149 164.097 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -68.15 -36.39 79.58 Favored 'General case' 0 CA--C 1.56 1.363 0 N-CA-C 115.671 1.73 . . . . 0.0 115.671 175.258 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.45 -22.08 41.47 Favored 'General case' 0 CA--C 1.571 1.766 0 CA-C-N 121.445 1.93 . . . . 0.0 114.896 167.223 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 60.1 m -64.42 -49.96 69.48 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-N 120.722 1.601 . . . . 0.0 112.834 160.342 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.3 tt -67.97 -30.45 69.74 Favored 'General case' 0 CA--C 1.561 1.397 0 CA-C-O 116.646 -1.645 . . . . 0.0 114.387 168.782 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 65.7 mtt180 -90.5 27.63 1.67 Allowed 'General case' 0 CA--C 1.572 1.792 0 CA-C-N 123.615 2.916 . . . . 0.0 114.401 161.176 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -103.6 -29.7 10.94 Favored 'General case' 0 CA--C 1.568 1.637 0 CA-C-O 115.994 -1.955 . . . . 0.0 114.288 137.44 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -73.98 -35.24 64.45 Favored 'General case' 0 CA--C 1.584 2.263 0 CA-C-N 123.953 3.07 . . . . 0.0 112.361 171.173 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -72.95 -33.41 65.88 Favored 'General case' 0 CA--C 1.576 1.952 0 N-CA-C 115.492 1.664 . . . . 0.0 115.492 157.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 65.9 -67.84 0.14 Allowed 'General case' 0 N--CA 1.502 2.153 0 C-N-CA 125.737 1.615 . . . . 0.0 112.224 -155.611 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 28.7 t . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 124.85 2.262 . . . . 0.0 110.622 169.967 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.645 ' HA ' HG12 ' A' ' 18' ' ' VAL . 2.4 mmp_? . . . . . 0 CA--C 1.575 1.907 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -85.87 -7.55 58.63 Favored 'General case' 0 CA--C 1.582 2.183 0 O-C-N 119.513 -1.992 . . . . 0.0 114.698 145.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -79.86 -56.91 3.93 Favored 'General case' 0 CA--C 1.559 1.326 0 O-C-N 120.474 -1.391 . . . . 0.0 109.17 160.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.645 HG12 ' HA ' ' A' ' 15' ' ' ARG . 2.8 p -46.94 -42.06 5.88 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.448 0 N-CA-C 118.037 2.606 . . . . 0.0 118.037 179.512 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -74.42 -44.05 53.57 Favored 'General case' 0 CA--C 1.587 2.392 0 CA-C-O 124.542 2.115 . . . . 0.0 112.037 -166.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.295 21.1 ttp180 -55.18 -46.8 75.82 Favored 'General case' 0 CA--C 1.559 1.325 0 C-N-CA 129.584 3.154 . . . . 0.0 117.5 157.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -57.36 -41.61 80.47 Favored 'General case' 0 CA--C 1.574 1.868 0 N-CA-C 114.201 1.186 . . . . 0.0 114.201 163.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 27.3 t80 -72.49 -36.16 68.34 Favored 'General case' 0 CA--C 1.557 1.235 0 N-CA-C 115.201 1.556 . . . . 0.0 115.201 177.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.419 ' HA ' ' HB2' ' A' ' 26' ' ' ARG . 38.7 tptt -78.64 -19.77 51.85 Favored 'General case' 0 CA--C 1.568 1.672 0 CA-C-N 121.978 2.172 . . . . 0.0 115.097 163.351 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 53.0 m -64.72 -50.16 68.02 Favored 'General case' 0 N--CA 1.496 1.845 0 CA-C-N 121.196 1.817 . . . . 0.0 112.398 161.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.2 tt -63.25 -36.35 83.36 Favored 'General case' 0 CA--C 1.568 1.648 0 CA-C-N 120.124 1.329 . . . . 0.0 114.127 165.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.419 ' HB2' ' HA ' ' A' ' 23' ' ' LYS . 16.8 mmt85 -83.55 31.52 0.47 Allowed 'General case' 0 CA--C 1.577 1.984 0 CA-C-N 121.911 2.141 . . . . 0.0 114.627 160.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -119.42 -23.86 6.52 Favored 'General case' 0 CA--C 1.569 1.704 0 C-N-CA 125.742 1.617 . . . . 0.0 114.803 138.429 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -59.57 -43.74 93.52 Favored 'General case' 0 CA--C 1.571 1.781 0 CA-C-N 122.332 2.333 . . . . 0.0 112.911 163.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 . . . . . 0 CA--C 1.571 1.783 0 C-N-CA 123.664 0.786 . . . . 0.0 112.835 170.42 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.706 ' HA ' HG12 ' A' ' 18' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.575 1.932 0 N-CA-C 115.784 1.772 . . . . 0.0 115.784 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -84.15 -7.76 59.27 Favored 'General case' 0 CA--C 1.576 1.981 0 CA-C-N 121.709 2.05 . . . . 0.0 115.628 150.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -83.26 -54.55 4.92 Favored 'General case' 0 CA--C 1.559 1.32 0 CA-C-O 117.398 -1.287 . . . . 0.0 108.816 162.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.706 HG12 ' HA ' ' A' ' 15' ' ' ARG . 2.9 p -50.85 -43.92 25.79 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.254 0 N-CA-C 117.731 2.493 . . . . 0.0 117.731 -179.386 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -75.59 -35.6 60.53 Favored 'General case' 0 CA--C 1.59 2.493 0 CA-C-O 123.541 1.639 . . . . 0.0 112.22 -170.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.293 9.9 ttp180 -64.63 -41.06 96.42 Favored 'General case' 0 CA--C 1.566 1.582 0 C-N-CA 129.095 2.958 . . . . 0.0 116.751 161.683 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -58.67 -42.26 88.06 Favored 'General case' 0 CA--C 1.574 1.892 0 C-N-CA 124.691 1.196 . . . . 0.0 114.131 160.478 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 43.2 t80 -70.98 -34.32 71.28 Favored 'General case' 0 CA--C 1.563 1.451 0 N-CA-C 115.752 1.76 . . . . 0.0 115.752 175.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.0 tppt? -78.76 -21.12 48.42 Favored 'General case' 0 CA--C 1.567 1.599 0 CA-C-N 121.315 1.87 . . . . 0.0 114.914 162.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 56.3 m -63.62 -51.72 64.02 Favored 'General case' 0 N--CA 1.497 1.912 0 CA-C-N 121.373 1.897 . . . . 0.0 112.063 159.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 42.7 tp -62.64 -38.45 90.32 Favored 'General case' 0 CA--C 1.556 1.181 0 CA-C-O 116.097 -1.906 . . . . 0.0 114.664 168.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 92.4 mtt180 -92.57 36.2 1.01 Allowed 'General case' 0 CA--C 1.571 1.758 0 CA-C-N 123.407 2.821 . . . . 0.0 114.258 164.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -109.83 -28.61 8.69 Favored 'General case' 0 CA--C 1.57 1.726 0 C-N-CA 125.246 1.418 . . . . 0.0 114.518 133.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -62.98 -44.86 94.87 Favored 'General case' 0 CA--C 1.574 1.892 0 CA-C-N 122.879 2.582 . . . . 0.0 112.814 165.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 . . . . . 0 CA--C 1.571 1.757 0 CA-C-O 117.631 -1.176 . . . . 0.0 114.171 169.524 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.686 ' HA ' HG12 ' A' ' 18' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.583 2.235 0 N-CA-C 114.626 1.343 . . . . 0.0 114.626 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -85.9 -6.47 59.07 Favored 'General case' 0 CA--C 1.581 2.154 0 O-C-N 119.335 -2.103 . . . . 0.0 115.614 150.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -83.39 -50.94 7.83 Favored 'General case' 0 CA--C 1.561 1.385 0 CA-C-O 118.188 -0.91 . . . . 0.0 109.461 159.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.686 HG12 ' HA ' ' A' ' 15' ' ' ARG . 3.3 p -53.44 -47.57 58.67 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.296 0 N-CA-C 116.21 1.93 . . . . 0.0 116.21 -177.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -75.12 -27.89 60.0 Favored 'General case' 0 CA--C 1.589 2.444 0 CA-C-O 122.766 1.269 . . . . 0.0 112.723 -172.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.283 51.2 ttm-85 -70.21 -46.9 63.57 Favored 'General case' 0 CA--C 1.562 1.422 0 C-N-CA 129.084 2.954 . . . . 0.0 115.545 165.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 43.0 t80 -57.06 -46.22 82.62 Favored 'General case' 0 CA--C 1.567 1.606 0 N-CA-C 114.595 1.332 . . . . 0.0 114.595 163.112 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -74.2 -31.55 62.69 Favored 'General case' 0 CA--C 1.562 1.411 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 177.162 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.7 tptp -75.12 -26.12 58.98 Favored 'General case' 0 CA--C 1.568 1.664 0 CA-C-N 121.131 1.787 . . . . 0.0 115.18 162.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 79.1 m -64.11 -48.97 74.07 Favored 'General case' 0 N--CA 1.494 1.748 0 CA-C-N 120.207 1.367 . . . . 0.0 112.969 161.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 57.2 tp -56.62 -41.55 77.27 Favored 'General case' 0 CA--C 1.557 1.247 0 CA-C-O 116.829 -1.558 . . . . 0.0 114.156 163.101 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 71.1 mtt-85 -82.71 21.93 0.95 Allowed 'General case' 0 CA--C 1.574 1.886 0 CA-C-N 122.371 2.351 . . . . 0.0 115.316 168.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -108.1 -26.28 10.71 Favored 'General case' 0 CA--C 1.569 1.676 0 N-CA-C 115.276 1.584 . . . . 0.0 115.276 143.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -64.64 -47.11 79.73 Favored 'General case' 0 CA--C 1.574 1.886 0 CA-C-N 122.754 2.524 . . . . 0.0 112.267 164.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 . . . . . 0 CA--C 1.576 1.955 0 N-CA-C 115.833 1.79 . . . . 0.0 115.833 163.214 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.685 ' HA ' HG12 ' A' ' 18' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.578 2.022 0 N-CA-C 115.957 1.836 . . . . 0.0 115.957 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -84.93 -11.26 55.95 Favored 'General case' 0 CA--C 1.575 1.922 0 CA-C-N 121.498 1.954 . . . . 0.0 115.652 147.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -79.47 -55.1 5.29 Favored 'General case' 0 CA--C 1.558 1.279 0 CA-C-O 117.456 -1.259 . . . . 0.0 108.433 163.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.685 HG12 ' HA ' ' A' ' 15' ' ' ARG . 3.8 p -48.51 -48.13 14.51 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.225 0 N-CA-C 117.382 2.364 . . . . 0.0 117.382 -179.287 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -75.4 -30.79 60.23 Favored 'General case' 0 CA--C 1.587 2.383 0 CA-C-O 123.213 1.482 . . . . 0.0 112.778 -171.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.274 18.4 ttp85 -73.65 -40.6 63.61 Favored 'General case' 0 CA--C 1.563 1.444 0 C-N-CA 129.084 2.954 . . . . 0.0 115.762 168.352 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -60.03 -45.1 93.93 Favored 'General case' 0 CA--C 1.563 1.474 0 C-N-CA 125.046 1.338 . . . . 0.0 114.122 161.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -66.74 -39.77 88.08 Favored 'General case' 0 CA--C 1.558 1.287 0 N-CA-C 115.099 1.518 . . . . 0.0 115.099 172.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.2 tppt? -73.67 -24.57 59.98 Favored 'General case' 0 CA--C 1.562 1.438 0 CA-C-N 121.989 2.177 . . . . 0.0 114.836 165.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 56.2 m -62.18 -52.04 65.41 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-N 121.241 1.837 . . . . 0.0 111.867 161.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.45 -46.73 83.29 Favored 'General case' 0 CA--C 1.564 1.507 0 CA-C-N 120.759 1.618 . . . . 0.0 113.465 167.062 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 -83.2 33.98 0.46 Allowed 'General case' 0 CA--C 1.583 2.227 0 CA-C-N 122.104 2.229 . . . . 0.0 115.031 169.043 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -132.54 -33.74 1.23 Allowed 'General case' 0 CA--C 1.571 1.772 0 C-N-CA 127.168 2.187 . . . . 0.0 112.882 155.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -55.81 -44.08 77.51 Favored 'General case' 0 CA--C 1.566 1.593 0 CA-C-N 121.69 2.041 . . . . 0.0 113.3 160.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 . . . . . 0 CA--C 1.57 1.75 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 165.233 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.674 ' HA ' HG12 ' A' ' 18' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.577 2.015 0 N-CA-C 114.948 1.462 . . . . 0.0 114.948 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -80.09 -5.75 56.47 Favored 'General case' 0 CA--C 1.58 2.101 0 O-C-N 119.14 -2.225 . . . . 0.0 115.187 141.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -75.01 -61.46 1.88 Allowed 'General case' 0 CA--C 1.557 1.228 0 O-C-N 121.027 -1.046 . . . . 0.0 108.448 157.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.674 HG12 ' HA ' ' A' ' 15' ' ' ARG . 3.7 p -50.27 -44.66 23.59 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.358 0 N-CA-C 117.634 2.457 . . . . 0.0 117.634 -173.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -72.76 -39.14 67.06 Favored 'General case' 0 CA--C 1.586 2.357 0 CA-C-O 124.355 2.026 . . . . 0.0 113.01 -171.364 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.302 51.4 ttt180 -68.13 -42.96 79.41 Favored 'General case' 0 CA--C 1.56 1.347 0 C-N-CA 130.424 3.489 . . . . 0.0 115.703 168.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 45.2 t80 -56.61 -46.31 80.97 Favored 'General case' 0 CA--C 1.562 1.421 0 C-N-CA 124.918 1.287 . . . . 0.0 114.35 159.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 35.1 t80 -71.81 -34.04 69.02 Favored 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 115.756 1.762 . . . . 0.0 115.756 178.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.7 tptp -76.34 -26.46 55.75 Favored 'General case' 0 CA--C 1.567 1.613 0 CA-C-N 120.848 1.658 . . . . 0.0 115.176 164.25 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 62.4 m -62.56 -49.69 74.27 Favored 'General case' 0 N--CA 1.496 1.829 0 CA-C-N 120.456 1.48 . . . . 0.0 112.786 160.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -55.99 -42.76 76.84 Favored 'General case' 0 CA--C 1.562 1.406 0 CA-C-O 116.983 -1.484 . . . . 0.0 113.557 165.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 93.6 mtt-85 -82.02 16.9 1.74 Allowed 'General case' 0 CA--C 1.577 1.988 0 CA-C-N 122.056 2.207 . . . . 0.0 116.614 168.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -106.64 -36.62 6.68 Favored 'General case' 0 CA--C 1.569 1.704 0 C-N-CA 125.681 1.592 . . . . 0.0 114.189 152.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -59.28 -44.58 92.45 Favored 'General case' 0 CA--C 1.57 1.747 0 CA-C-N 120.81 1.641 . . . . 0.0 113.12 165.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 . . . . . 0 CA--C 1.573 1.858 0 N-CA-C 114.863 1.431 . . . . 0.0 114.863 161.822 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.628 ' HA ' HG12 ' A' ' 18' ' ' VAL . 2.3 mmp_? . . . . . 0 CA--C 1.579 2.072 0 N-CA-C 114.973 1.472 . . . . 0.0 114.973 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -82.54 -10.71 58.87 Favored 'General case' 0 CA--C 1.578 2.044 0 O-C-N 119.323 -2.11 . . . . 0.0 115.431 144.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -80.63 -52.67 7.31 Favored 'General case' 0 CA--C 1.562 1.429 0 CA-C-O 117.305 -1.331 . . . . 0.0 109.578 162.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.628 HG12 ' HA ' ' A' ' 15' ' ' ARG . 3.0 p -48.27 -44.96 13.14 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.468 0 N-CA-C 117.097 2.258 . . . . 0.0 117.097 177.284 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -74.1 -36.88 64.27 Favored 'General case' 0 CA--C 1.582 2.191 0 CA-C-O 123.881 1.801 . . . . 0.0 112.98 -170.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.284 76.5 ttt-85 -66.37 -43.94 84.55 Favored 'General case' 0 CA--C 1.561 1.398 0 C-N-CA 129.742 3.217 . . . . 0.0 116.384 165.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -60.23 -43.93 95.64 Favored 'General case' 0 CA--C 1.565 1.53 0 C-N-CA 124.781 1.232 . . . . 0.0 114.083 162.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 42.1 t80 -72.25 -32.59 66.82 Favored 'General case' 0 CA--C 1.562 1.432 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 174.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.45 -25.37 54.31 Favored 'General case' 0 CA--C 1.569 1.678 0 CA-C-N 121.789 2.086 . . . . 0.0 114.299 164.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 61.6 m -62.35 -51.1 68.95 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-N 120.763 1.62 . . . . 0.0 112.422 161.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -54.59 -46.03 73.71 Favored 'General case' 0 CA--C 1.561 1.374 0 CA-C-O 117.059 -1.448 . . . . 0.0 113.873 164.148 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 37.6 mmt180 -82.01 21.11 0.91 Allowed 'General case' 0 CA--C 1.576 1.977 0 CA-C-N 122.35 2.341 . . . . 0.0 116.007 171.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -115.9 -31.62 5.7 Favored 'General case' 0 CA--C 1.569 1.687 0 C-N-CA 125.936 1.694 . . . . 0.0 114.834 152.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -60.25 -43.0 96.5 Favored 'General case' 0 CA--C 1.571 1.754 0 CA-C-N 121.258 1.844 . . . . 0.0 113.113 162.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 21.4 mm-40 . . . . . 0 CA--C 1.569 1.696 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 165.935 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.642 ' HA ' HG12 ' A' ' 18' ' ' VAL . 1.9 mmp_? . . . . . 0 CA--C 1.576 1.973 0 N-CA-C 116.383 1.994 . . . . 0.0 116.383 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -78.48 -22.57 47.31 Favored 'General case' 0 CA--C 1.568 1.66 0 O-C-N 119.336 -2.103 . . . . 0.0 114.767 141.289 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -73.37 -52.24 14.52 Favored 'General case' 0 CA--C 1.561 1.371 0 CA-C-O 117.019 -1.467 . . . . 0.0 109.765 170.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.642 HG12 ' HA ' ' A' ' 15' ' ' ARG . 3.9 p -44.92 -47.32 2.86 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.478 0 N-CA-C 117.654 2.464 . . . . 0.0 117.654 173.362 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -72.13 -39.3 68.91 Favored 'General case' 0 CA--C 1.588 2.415 0 CA-C-O 124.629 2.156 . . . . 0.0 113.226 -170.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.317 73.4 ttt180 -67.15 -40.91 86.75 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 130.866 3.666 . . . . 0.0 116.433 167.181 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -60.93 -41.96 97.22 Favored 'General case' 0 CA--C 1.562 1.429 0 C-N-CA 124.652 1.181 . . . . 0.0 113.887 160.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -68.54 -35.78 77.91 Favored 'General case' 0 CA--C 1.565 1.541 0 N-CA-C 115.752 1.76 . . . . 0.0 115.752 173.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.9 tptp -77.28 -24.07 51.06 Favored 'General case' 0 CA--C 1.568 1.639 0 CA-C-N 120.831 1.65 . . . . 0.0 115.338 165.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 38.3 m -65.82 -47.75 73.99 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-N 120.253 1.388 . . . . 0.0 112.373 161.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 58.4 tp -56.63 -42.72 79.34 Favored 'General case' 0 CA--C 1.558 1.255 0 CA-C-O 116.847 -1.549 . . . . 0.0 114.306 162.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 92.6 mtt-85 -84.8 27.68 0.73 Allowed 'General case' 0 CA--C 1.578 2.02 0 CA-C-N 122.182 2.265 . . . . 0.0 114.746 166.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -111.76 -26.24 9.07 Favored 'General case' 0 CA--C 1.571 1.764 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 140.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -64.18 -46.23 84.87 Favored 'General case' 0 CA--C 1.572 1.801 0 CA-C-N 122.869 2.577 . . . . 0.0 112.424 165.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 82.5 mt-30 . . . . . 0 CA--C 1.574 1.867 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 161.787 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.717 ' HA ' HG12 ' A' ' 18' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.576 1.955 0 N-CA-C 115.077 1.51 . . . . 0.0 115.077 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.4 m-20 -80.76 -1.13 41.57 Favored 'General case' 0 CA--C 1.576 1.952 0 CA-C-N 121.817 2.099 . . . . 0.0 116.21 152.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -90.36 -53.37 4.48 Favored 'General case' 0 CA--C 1.561 1.371 0 CA-C-O 117.331 -1.318 . . . . 0.0 108.148 159.153 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.717 HG12 ' HA ' ' A' ' 15' ' ' ARG . 2.5 p -52.8 -48.61 49.72 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.152 0 N-CA-C 116.849 2.166 . . . . 0.0 116.849 -177.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -74.16 -32.33 63.07 Favored 'General case' 0 CA--C 1.587 2.399 0 CA-C-O 123.015 1.388 . . . . 0.0 112.41 -171.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.271 76.1 ttt180 -66.48 -46.23 77.02 Favored 'General case' 0 CA--C 1.559 1.309 0 C-N-CA 128.732 2.813 . . . . 0.0 115.9 165.743 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -59.0 -44.93 91.73 Favored 'General case' 0 CA--C 1.564 1.51 0 C-N-CA 124.738 1.215 . . . . 0.0 114.149 164.097 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -68.15 -36.39 79.58 Favored 'General case' 0 CA--C 1.56 1.363 0 N-CA-C 115.671 1.73 . . . . 0.0 115.671 175.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.45 -22.08 41.47 Favored 'General case' 0 CA--C 1.571 1.766 0 CA-C-N 121.445 1.93 . . . . 0.0 114.896 167.223 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 60.1 m -64.42 -49.96 69.48 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-N 120.722 1.601 . . . . 0.0 112.834 160.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.3 tt -67.97 -30.45 69.74 Favored 'General case' 0 CA--C 1.561 1.397 0 CA-C-O 116.646 -1.645 . . . . 0.0 114.387 168.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 65.7 mtt180 -90.5 27.63 1.67 Allowed 'General case' 0 CA--C 1.572 1.792 0 CA-C-N 123.615 2.916 . . . . 0.0 114.401 161.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -103.6 -29.7 10.94 Favored 'General case' 0 CA--C 1.568 1.637 0 CA-C-O 115.994 -1.955 . . . . 0.0 114.288 137.44 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -73.98 -35.24 64.45 Favored 'General case' 0 CA--C 1.584 2.263 0 CA-C-N 123.953 3.07 . . . . 0.0 112.361 171.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 . . . . . 0 CA--C 1.576 1.952 0 N-CA-C 115.492 1.664 . . . . 0.0 115.492 157.939 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 38.7 t . . . . . 0 CA--C 1.564 1.514 0 CA-C-O 119.465 -0.302 . . . . 0.0 110.208 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.9 p -148.84 -79.14 0.14 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.249 -0.907 . . . . 0.0 109.466 -172.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 10.3 tp -72.64 -41.88 62.78 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.249 0 CA-C-N 119.395 0.998 . . . . 0.0 111.907 162.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.467 HD23 ' H ' ' A' ' 4' ' ' LEU . 0.8 OUTLIER -78.03 74.55 4.58 Favored 'General case' 0 CA--C 1.574 1.888 0 CA-C-O 122.808 1.289 . . . . 0.0 110.663 162.81 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -139.43 -65.63 0.47 Allowed 'General case' 0 N--CA 1.492 1.649 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.496 -179.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 65.5 mt -87.9 79.77 1.73 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.892 0 CA-C-O 124.21 1.957 . . . . 0.0 107.755 -172.146 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.1 tpm_? -83.68 -32.84 25.37 Favored 'General case' 0 CA--C 1.573 1.828 0 CA-C-N 112.73 -2.032 . . . . 0.0 114.108 -174.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 52.3 mt-30 63.53 87.11 0.11 Allowed 'General case' 0 N--CA 1.502 2.16 0 C-N-CA 125.462 1.505 . . . . 0.0 112.389 176.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -171.02 83.39 0.08 OUTLIER Glycine 0 CA--C 1.553 2.425 0 CA-C-O 116.72 -2.156 . . . . 0.0 113.238 174.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -69.35 148.49 67.84 Favored 'Trans proline' 0 CA--C 1.565 2.037 0 CA-C-N 122.22 3.01 . . . . 0.0 115.477 -174.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 49.4 mttp -134.89 -71.89 0.48 Allowed 'General case' 0 N--CA 1.498 1.943 0 CA-C-O 118.4 -0.81 . . . . 0.0 110.316 -167.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -63.46 -47.25 83.9 Favored Pre-proline 0 CA--C 1.578 2.053 0 CA-C-O 115.072 -2.394 . . . . 0.0 114.446 176.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -47.95 -40.25 32.84 Favored 'Trans proline' 0 C--N 1.375 1.93 0 CA-C-N 126.933 3.512 . . . . 0.0 117.575 162.072 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -93.36 -27.67 16.63 Favored 'General case' 0 CA--C 1.559 1.327 0 N-CA-C 114.951 1.463 . . . . 0.0 114.951 -164.128 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.645 ' HA ' HG12 ' A' ' 18' ' ' VAL . 2.4 mmp_? -103.37 -6.21 22.17 Favored 'General case' 0 CA--C 1.575 1.907 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 171.159 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -85.87 -7.55 58.63 Favored 'General case' 0 CA--C 1.582 2.183 0 O-C-N 119.513 -1.992 . . . . 0.0 114.698 145.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -79.86 -56.91 3.93 Favored 'General case' 0 CA--C 1.559 1.326 0 O-C-N 120.474 -1.391 . . . . 0.0 109.17 160.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.645 HG12 ' HA ' ' A' ' 15' ' ' ARG . 2.8 p -46.94 -42.06 5.88 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.448 0 N-CA-C 118.037 2.606 . . . . 0.0 118.037 179.512 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -74.42 -44.05 53.57 Favored 'General case' 0 CA--C 1.587 2.392 0 CA-C-O 124.542 2.115 . . . . 0.0 112.037 -166.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.295 21.1 ttp180 -55.18 -46.8 75.82 Favored 'General case' 0 CA--C 1.559 1.325 0 C-N-CA 129.584 3.154 . . . . 0.0 117.5 157.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -57.36 -41.61 80.47 Favored 'General case' 0 CA--C 1.574 1.868 0 N-CA-C 114.201 1.186 . . . . 0.0 114.201 163.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 27.3 t80 -72.49 -36.16 68.34 Favored 'General case' 0 CA--C 1.557 1.235 0 N-CA-C 115.201 1.556 . . . . 0.0 115.201 177.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.419 ' HA ' ' HB2' ' A' ' 26' ' ' ARG . 38.7 tptt -78.64 -19.77 51.85 Favored 'General case' 0 CA--C 1.568 1.672 0 CA-C-N 121.978 2.172 . . . . 0.0 115.097 163.351 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 53.0 m -64.72 -50.16 68.02 Favored 'General case' 0 N--CA 1.496 1.845 0 CA-C-N 121.196 1.817 . . . . 0.0 112.398 161.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.2 tt -63.25 -36.35 83.36 Favored 'General case' 0 CA--C 1.568 1.648 0 CA-C-N 120.124 1.329 . . . . 0.0 114.127 165.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.419 ' HB2' ' HA ' ' A' ' 23' ' ' LYS . 16.8 mmt85 -83.55 31.52 0.47 Allowed 'General case' 0 CA--C 1.577 1.984 0 CA-C-N 121.911 2.141 . . . . 0.0 114.627 160.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -119.42 -23.86 6.52 Favored 'General case' 0 CA--C 1.569 1.704 0 C-N-CA 125.742 1.617 . . . . 0.0 114.803 138.429 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -59.57 -43.74 93.52 Favored 'General case' 0 CA--C 1.571 1.781 0 CA-C-N 122.332 2.333 . . . . 0.0 112.911 163.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -72.16 -52.99 14.06 Favored 'General case' 0 CA--C 1.571 1.783 0 C-N-CA 123.664 0.786 . . . . 0.0 112.835 170.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -168.64 115.43 0.65 Allowed 'General case' 0 CA--C 1.562 1.405 0 CA-C-N 119.59 1.086 . . . . 0.0 110.249 -178.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 99.6 p . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 123.122 1.439 . . . . 0.0 114.057 -173.537 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 72.6 m . . . . . 0 CA--C 1.566 1.587 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.7 m -157.62 -67.27 0.09 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 120.779 -1.201 . . . . 0.0 110.525 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 11.3 tp -66.59 -37.53 79.75 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.326 0 N-CA-C 114.725 1.38 . . . . 0.0 114.725 -175.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.4 pp -95.8 41.24 1.1 Allowed 'General case' 0 CA--C 1.575 1.915 0 N-CA-C 114.218 1.192 . . . . 0.0 114.218 167.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -153.85 -67.21 0.14 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.74 -1.225 . . . . 0.0 110.613 -171.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 48.3 mt -85.29 81.19 1.8 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.966 0 CA-C-O 124.832 2.253 . . . . 0.0 107.362 -177.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 55.3 ttp180 -170.13 -31.67 0.02 OUTLIER 'General case' 0 CA--C 1.575 1.939 0 CA-C-N 111.377 -2.647 . . . . 0.0 111.657 -160.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -130.86 97.99 4.49 Favored 'General case' 0 CA--C 1.563 1.48 0 C-N-CA 124.858 1.263 . . . . 0.0 109.202 -168.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -119.05 96.69 0.67 Allowed Glycine 0 CA--C 1.552 2.36 0 CA-C-O 116.739 -2.145 . . . . 0.0 114.317 -173.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_exo -55.37 159.17 10.98 Favored 'Trans proline' 0 CA--C 1.565 2.06 0 CA-C-N 122.321 3.061 . . . . 0.0 117.15 -178.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.98 105.32 8.53 Favored 'General case' 0 N--CA 1.494 1.739 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 -172.766 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 104.3 -55.46 0.0 OUTLIER Pre-proline 0 N--CA 1.509 2.488 0 CA-C-O 114.266 -2.778 . . . . 0.0 110.261 -175.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_exo -58.77 -47.56 18.05 Favored 'Trans proline' 0 C--N 1.378 2.109 0 CA-C-N 127.77 3.811 . . . . 0.0 117.525 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -70.53 -13.8 62.25 Favored 'General case' 0 CA--C 1.57 1.736 0 N-CA-C 117.317 2.34 . . . . 0.0 117.317 -159.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.706 ' HA ' HG12 ' A' ' 18' ' ' VAL . 0.0 OUTLIER -101.87 -10.8 19.54 Favored 'General case' 0 CA--C 1.575 1.932 0 N-CA-C 115.784 1.772 . . . . 0.0 115.784 168.453 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -84.15 -7.76 59.27 Favored 'General case' 0 CA--C 1.576 1.981 0 CA-C-N 121.709 2.05 . . . . 0.0 115.628 150.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -83.26 -54.55 4.92 Favored 'General case' 0 CA--C 1.559 1.32 0 CA-C-O 117.398 -1.287 . . . . 0.0 108.816 162.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.706 HG12 ' HA ' ' A' ' 15' ' ' ARG . 2.9 p -50.85 -43.92 25.79 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.254 0 N-CA-C 117.731 2.493 . . . . 0.0 117.731 -179.386 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -75.59 -35.6 60.53 Favored 'General case' 0 CA--C 1.59 2.493 0 CA-C-O 123.541 1.639 . . . . 0.0 112.22 -170.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.293 9.9 ttp180 -64.63 -41.06 96.42 Favored 'General case' 0 CA--C 1.566 1.582 0 C-N-CA 129.095 2.958 . . . . 0.0 116.751 161.683 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -58.67 -42.26 88.06 Favored 'General case' 0 CA--C 1.574 1.892 0 C-N-CA 124.691 1.196 . . . . 0.0 114.131 160.478 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 43.2 t80 -70.98 -34.32 71.28 Favored 'General case' 0 CA--C 1.563 1.451 0 N-CA-C 115.752 1.76 . . . . 0.0 115.752 175.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.0 tppt? -78.76 -21.12 48.42 Favored 'General case' 0 CA--C 1.567 1.599 0 CA-C-N 121.315 1.87 . . . . 0.0 114.914 162.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 56.3 m -63.62 -51.72 64.02 Favored 'General case' 0 N--CA 1.497 1.912 0 CA-C-N 121.373 1.897 . . . . 0.0 112.063 159.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 42.7 tp -62.64 -38.45 90.32 Favored 'General case' 0 CA--C 1.556 1.181 0 CA-C-O 116.097 -1.906 . . . . 0.0 114.664 168.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 92.4 mtt180 -92.57 36.2 1.01 Allowed 'General case' 0 CA--C 1.571 1.758 0 CA-C-N 123.407 2.821 . . . . 0.0 114.258 164.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -109.83 -28.61 8.69 Favored 'General case' 0 CA--C 1.57 1.726 0 C-N-CA 125.246 1.418 . . . . 0.0 114.518 133.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -62.98 -44.86 94.87 Favored 'General case' 0 CA--C 1.574 1.892 0 CA-C-N 122.879 2.582 . . . . 0.0 112.814 165.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -72.92 -36.03 67.16 Favored 'General case' 0 CA--C 1.571 1.757 0 CA-C-O 117.631 -1.176 . . . . 0.0 114.171 169.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -140.44 68.33 1.35 Allowed 'General case' 0 CA--C 1.566 1.581 0 CA-C-N 120.971 1.714 . . . . 0.0 114.057 -173.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 84.1 p . . . . . 0 N--CA 1.506 2.351 0 C-N-CA 126.233 1.813 . . . . 0.0 115.675 172.778 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 42.2 t . . . . . 0 CA--C 1.561 1.394 0 N-CA-C 110.283 -0.265 . . . . 0.0 110.283 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 96.5 p -143.38 156.05 44.58 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.64 0.733 . . . . 0.0 111.365 -176.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -63.96 -42.54 96.08 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.254 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 -179.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.3 pp -73.95 1.92 9.75 Favored 'General case' 0 N--CA 1.504 2.229 0 N-CA-C 117.97 2.582 . . . . 0.0 117.97 170.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -100.35 -66.16 0.92 Allowed 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 124.212 1.005 . . . . 0.0 109.572 166.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 18.4 mt -91.26 82.28 1.88 Allowed 'Isoleucine or valine' 0 CA--C 1.57 1.734 0 CA-C-O 123.546 1.641 . . . . 0.0 107.174 174.219 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 14.9 ptp180 -97.94 -14.25 20.73 Favored 'General case' 0 CA--C 1.575 1.932 0 CA-C-N 113.282 -1.781 . . . . 0.0 115.435 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -79.24 91.58 5.01 Favored 'General case' 0 CA--C 1.568 1.651 0 CA-C-N 120.636 1.562 . . . . 0.0 113.295 -165.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -98.99 103.72 2.78 Favored Glycine 0 CA--C 1.553 2.423 0 CA-C-O 116.635 -2.203 . . . . 0.0 112.394 172.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -72.8 127.18 12.03 Favored 'Trans proline' 0 CA--C 1.561 1.853 0 CA-C-N 123.028 3.414 . . . . 0.0 115.062 -169.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -173.67 -44.14 0.01 OUTLIER 'General case' 0 CA--C 1.572 1.795 0 CA-C-N 112.479 -2.146 . . . . 0.0 110.923 -175.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -120.91 -44.13 0.04 OUTLIER Pre-proline 0 CA--C 1.58 2.105 0 CA-C-O 115.043 -2.408 . . . . 0.0 111.697 179.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_exo -62.47 -13.15 31.43 Favored 'Trans proline' 0 C--N 1.38 2.188 0 CA-C-N 126.614 3.398 . . . . 0.0 120.034 176.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 15.5 p90 -78.49 25.96 0.24 Allowed 'General case' 0 CA--C 1.574 1.903 0 N-CA-C 117.717 2.488 . . . . 0.0 117.717 -152.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.686 ' HA ' HG12 ' A' ' 18' ' ' VAL . 0.0 OUTLIER -92.24 -6.46 50.45 Favored 'General case' 0 CA--C 1.583 2.235 0 O-C-N 120.058 -1.651 . . . . 0.0 114.626 148.102 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -85.9 -6.47 59.07 Favored 'General case' 0 CA--C 1.581 2.154 0 O-C-N 119.335 -2.103 . . . . 0.0 115.614 150.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -83.39 -50.94 7.83 Favored 'General case' 0 CA--C 1.561 1.385 0 CA-C-O 118.188 -0.91 . . . . 0.0 109.461 159.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.686 HG12 ' HA ' ' A' ' 15' ' ' ARG . 3.3 p -53.44 -47.57 58.67 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.296 0 N-CA-C 116.21 1.93 . . . . 0.0 116.21 -177.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -75.12 -27.89 60.0 Favored 'General case' 0 CA--C 1.589 2.444 0 CA-C-O 122.766 1.269 . . . . 0.0 112.723 -172.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.283 51.2 ttm-85 -70.21 -46.9 63.57 Favored 'General case' 0 CA--C 1.562 1.422 0 C-N-CA 129.084 2.954 . . . . 0.0 115.545 165.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 43.0 t80 -57.06 -46.22 82.62 Favored 'General case' 0 CA--C 1.567 1.606 0 N-CA-C 114.595 1.332 . . . . 0.0 114.595 163.112 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -74.2 -31.55 62.69 Favored 'General case' 0 CA--C 1.562 1.411 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 177.162 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.7 tptp -75.12 -26.12 58.98 Favored 'General case' 0 CA--C 1.568 1.664 0 CA-C-N 121.131 1.787 . . . . 0.0 115.18 162.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 79.1 m -64.11 -48.97 74.07 Favored 'General case' 0 N--CA 1.494 1.748 0 CA-C-N 120.207 1.367 . . . . 0.0 112.969 161.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 57.2 tp -56.62 -41.55 77.27 Favored 'General case' 0 CA--C 1.557 1.247 0 CA-C-O 116.829 -1.558 . . . . 0.0 114.156 163.101 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 71.1 mtt-85 -82.71 21.93 0.95 Allowed 'General case' 0 CA--C 1.574 1.886 0 CA-C-N 122.371 2.351 . . . . 0.0 115.316 168.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -108.1 -26.28 10.71 Favored 'General case' 0 CA--C 1.569 1.676 0 N-CA-C 115.276 1.584 . . . . 0.0 115.276 143.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -64.64 -47.11 79.73 Favored 'General case' 0 CA--C 1.574 1.886 0 CA-C-N 122.754 2.524 . . . . 0.0 112.267 164.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -65.63 -37.87 87.8 Favored 'General case' 0 CA--C 1.576 1.955 0 N-CA-C 115.833 1.79 . . . . 0.0 115.833 163.214 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 72.7 84.16 0.12 Allowed 'General case' 0 N--CA 1.499 2.003 0 C-N-CA 126.682 1.993 . . . . 0.0 110.748 -170.118 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 31.4 t . . . . . 0 N--CA 1.488 1.429 0 CA-C-O 125.587 2.613 . . . . 0.0 110.49 -178.441 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 38.1 t . . . . . 0 CA--C 1.574 1.891 0 CA-C-O 120.696 0.284 . . . . 0.0 111.555 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 74.4 m -103.39 -65.84 0.98 Allowed 'General case' 0 N--CA 1.497 1.878 0 O-C-N 120.635 -1.29 . . . . 0.0 111.506 176.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 10.1 tp -76.2 -56.21 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.11 0 CA-C-N 119.042 0.837 . . . . 0.0 112.678 -171.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 94.3 mt -87.24 72.49 9.87 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-N 120.341 1.428 . . . . 0.0 109.768 174.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -154.48 -40.42 0.09 Allowed 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 114.524 1.305 . . . . 0.0 114.524 -172.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 40.2 mt -92.33 79.1 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.851 0 CA-C-O 124.071 1.891 . . . . 0.0 108.309 -161.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.34 73.6 1.26 Allowed 'General case' 0 CA--C 1.569 1.702 0 CA-C-N 112.701 -2.045 . . . . 0.0 108.693 160.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -72.28 143.95 48.55 Favored 'General case' 0 CA--C 1.571 1.763 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 -170.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -114.45 87.03 0.43 Allowed Glycine 0 CA--C 1.553 2.46 0 CA-C-O 117.16 -1.911 . . . . 0.0 111.414 166.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -78.6 161.2 28.07 Favored 'Trans proline' 0 CA--C 1.567 2.155 0 CA-C-N 122.652 3.226 . . . . 0.0 116.445 -161.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -130.26 -72.09 0.58 Allowed 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 115.311 -0.859 . . . . 0.0 108.965 165.028 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.2 pm0 -68.51 -27.23 1.38 Allowed Pre-proline 0 CA--C 1.583 2.227 0 CA-C-O 114.401 -2.714 . . . . 0.0 116.525 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -56.94 -30.05 84.58 Favored 'Trans proline' 0 C--N 1.376 2.011 0 CA-C-N 127.618 3.756 . . . . 0.0 117.879 164.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -66.21 -18.58 65.44 Favored 'General case' 0 CA--C 1.568 1.672 0 N-CA-C 117.897 2.554 . . . . 0.0 117.897 -157.242 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.685 ' HA ' HG12 ' A' ' 18' ' ' VAL . 0.0 OUTLIER -102.99 -5.74 23.09 Favored 'General case' 0 CA--C 1.578 2.022 0 N-CA-C 115.957 1.836 . . . . 0.0 115.957 167.32 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -84.93 -11.26 55.95 Favored 'General case' 0 CA--C 1.575 1.922 0 CA-C-N 121.498 1.954 . . . . 0.0 115.652 147.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -79.47 -55.1 5.29 Favored 'General case' 0 CA--C 1.558 1.279 0 CA-C-O 117.456 -1.259 . . . . 0.0 108.433 163.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.685 HG12 ' HA ' ' A' ' 15' ' ' ARG . 3.8 p -48.51 -48.13 14.51 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.225 0 N-CA-C 117.382 2.364 . . . . 0.0 117.382 -179.287 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -75.4 -30.79 60.23 Favored 'General case' 0 CA--C 1.587 2.383 0 CA-C-O 123.213 1.482 . . . . 0.0 112.778 -171.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.274 18.4 ttp85 -73.65 -40.6 63.61 Favored 'General case' 0 CA--C 1.563 1.444 0 C-N-CA 129.084 2.954 . . . . 0.0 115.762 168.352 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -60.03 -45.1 93.93 Favored 'General case' 0 CA--C 1.563 1.474 0 C-N-CA 125.046 1.338 . . . . 0.0 114.122 161.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -66.74 -39.77 88.08 Favored 'General case' 0 CA--C 1.558 1.287 0 N-CA-C 115.099 1.518 . . . . 0.0 115.099 172.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.2 tppt? -73.67 -24.57 59.98 Favored 'General case' 0 CA--C 1.562 1.438 0 CA-C-N 121.989 2.177 . . . . 0.0 114.836 165.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 56.2 m -62.18 -52.04 65.41 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-N 121.241 1.837 . . . . 0.0 111.867 161.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.45 -46.73 83.29 Favored 'General case' 0 CA--C 1.564 1.507 0 CA-C-N 120.759 1.618 . . . . 0.0 113.465 167.062 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 -83.2 33.98 0.46 Allowed 'General case' 0 CA--C 1.583 2.227 0 CA-C-N 122.104 2.229 . . . . 0.0 115.031 169.043 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -132.54 -33.74 1.23 Allowed 'General case' 0 CA--C 1.571 1.772 0 C-N-CA 127.168 2.187 . . . . 0.0 112.882 155.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -55.81 -44.08 77.51 Favored 'General case' 0 CA--C 1.566 1.593 0 CA-C-N 121.69 2.041 . . . . 0.0 113.3 160.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 -66.34 -51.16 60.06 Favored 'General case' 0 CA--C 1.57 1.75 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 165.233 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -88.24 68.83 9.08 Favored 'General case' 0 CA--C 1.571 1.775 0 CA-C-N 119.538 1.063 . . . . 0.0 112.976 178.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.2 m . . . . . 0 N--CA 1.489 1.481 0 CA-C-O 124.835 2.255 . . . . 0.0 109.2 -179.918 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 75.1 m . . . . . 0 CA--C 1.561 1.384 0 CA-C-O 120.322 0.106 . . . . 0.0 111.149 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 80.9 p -84.67 175.38 9.25 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 122.578 1.18 . . . . 0.0 113.416 173.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 10.4 tp -73.85 -39.07 51.63 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.211 0 O-C-N 121.449 -0.782 . . . . 0.0 113.034 171.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 94.0 mt -83.06 66.06 8.47 Favored 'General case' 0 CA--C 1.574 1.875 0 CA-C-N 120.22 1.373 . . . . 0.0 111.108 169.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -131.09 -75.42 0.52 Allowed 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 -173.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 35.7 mt -89.77 85.51 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 CA-C-O 123.787 1.756 . . . . 0.0 107.247 179.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 56.9 mtm180 -92.33 39.34 1.02 Allowed 'General case' 0 CA--C 1.58 2.101 0 CA-C-N 113.224 -1.807 . . . . 0.0 113.277 -178.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -82.15 90.21 6.55 Favored 'General case' 0 CA--C 1.568 1.642 0 CA-C-O 123.084 1.421 . . . . 0.0 111.967 -170.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -156.05 155.14 26.07 Favored Glycine 0 CA--C 1.556 2.624 0 CA-C-O 118.192 -1.338 . . . . 0.0 113.428 178.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -73.3 150.88 47.82 Favored 'Trans proline' 0 CA--C 1.567 2.131 0 CA-C-N 121.74 2.77 . . . . 0.0 115.164 -178.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.6 mptt -138.26 -61.99 0.59 Allowed 'General case' 0 N--CA 1.496 1.839 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.573 174.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -77.33 -47.59 2.53 Favored Pre-proline 0 CA--C 1.578 2.035 0 CA-C-O 115.062 -2.399 . . . . 0.0 114.389 178.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -86.87 -155.91 0.06 OUTLIER 'Trans proline' 0 CA--C 1.57 2.283 0 CA-C-N 126.548 3.374 . . . . 0.0 112.836 -177.281 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -154.59 57.01 0.69 Allowed 'General case' 0 CA--C 1.567 1.599 0 CA-C-N 113.612 -1.631 . . . . 0.0 112.395 161.485 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.674 ' HA ' HG12 ' A' ' 18' ' ' VAL . 0.0 OUTLIER -135.88 -22.1 1.43 Allowed 'General case' 0 CA--C 1.577 2.015 0 N-CA-C 114.948 1.462 . . . . 0.0 114.948 -175.965 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -80.09 -5.75 56.47 Favored 'General case' 0 CA--C 1.58 2.101 0 O-C-N 119.14 -2.225 . . . . 0.0 115.187 141.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -75.01 -61.46 1.88 Allowed 'General case' 0 CA--C 1.557 1.228 0 O-C-N 121.027 -1.046 . . . . 0.0 108.448 157.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.674 HG12 ' HA ' ' A' ' 15' ' ' ARG . 3.7 p -50.27 -44.66 23.59 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.358 0 N-CA-C 117.634 2.457 . . . . 0.0 117.634 -173.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -72.76 -39.14 67.06 Favored 'General case' 0 CA--C 1.586 2.357 0 CA-C-O 124.355 2.026 . . . . 0.0 113.01 -171.364 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.302 51.4 ttt180 -68.13 -42.96 79.41 Favored 'General case' 0 CA--C 1.56 1.347 0 C-N-CA 130.424 3.489 . . . . 0.0 115.703 168.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 45.2 t80 -56.61 -46.31 80.97 Favored 'General case' 0 CA--C 1.562 1.421 0 C-N-CA 124.918 1.287 . . . . 0.0 114.35 159.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 35.1 t80 -71.81 -34.04 69.02 Favored 'General case' 0 N--CA 1.49 1.54 0 N-CA-C 115.756 1.762 . . . . 0.0 115.756 178.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.7 tptp -76.34 -26.46 55.75 Favored 'General case' 0 CA--C 1.567 1.613 0 CA-C-N 120.848 1.658 . . . . 0.0 115.176 164.25 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 62.4 m -62.56 -49.69 74.27 Favored 'General case' 0 N--CA 1.496 1.829 0 CA-C-N 120.456 1.48 . . . . 0.0 112.786 160.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -55.99 -42.76 76.84 Favored 'General case' 0 CA--C 1.562 1.406 0 CA-C-O 116.983 -1.484 . . . . 0.0 113.557 165.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 93.6 mtt-85 -82.02 16.9 1.74 Allowed 'General case' 0 CA--C 1.577 1.988 0 CA-C-N 122.056 2.207 . . . . 0.0 116.614 168.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -106.64 -36.62 6.68 Favored 'General case' 0 CA--C 1.569 1.704 0 C-N-CA 125.681 1.592 . . . . 0.0 114.189 152.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -59.28 -44.58 92.45 Favored 'General case' 0 CA--C 1.57 1.747 0 CA-C-N 120.81 1.641 . . . . 0.0 113.12 165.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -67.6 -38.1 83.5 Favored 'General case' 0 CA--C 1.573 1.858 0 N-CA-C 114.863 1.431 . . . . 0.0 114.863 161.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 55.95 75.76 0.32 Allowed 'General case' 0 N--CA 1.496 1.866 0 C-N-CA 125.572 1.549 . . . . 0.0 111.925 -163.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 52.9 m . . . . . 0 N--CA 1.493 1.676 0 CA-C-O 124.949 2.309 . . . . 0.0 109.577 -174.499 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 92.2 m . . . . . 0 CA--C 1.573 1.862 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 85.6 p -117.14 -77.5 0.57 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.716 -1.24 . . . . 0.0 111.628 -176.047 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 10.9 tp -72.69 -38.32 58.05 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.21 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 -168.147 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.9 pp -90.45 21.57 3.85 Favored 'General case' 0 N--CA 1.503 2.194 0 N-CA-C 116.286 1.958 . . . . 0.0 116.286 166.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -114.72 -64.21 1.35 Allowed 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 125.675 1.59 . . . . 0.0 109.338 177.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 14.3 mt -80.09 80.88 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.988 0 CA-C-O 123.713 1.72 . . . . 0.0 106.815 156.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 29.0 ttp180 -91.2 14.13 15.16 Favored 'General case' 0 CA--C 1.578 2.021 0 CA-C-N 113.535 -1.666 . . . . 0.0 114.874 -169.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 64.41 73.84 0.42 Allowed 'General case' 0 N--CA 1.502 2.155 0 C-N-CA 125.64 1.576 . . . . 0.0 113.241 160.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -105.47 -92.24 2.26 Favored Glycine 0 CA--C 1.55 2.223 0 CA-C-O 116.91 -2.05 . . . . 0.0 112.499 175.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -80.19 162.25 22.97 Favored 'Trans proline' 0 CA--C 1.563 1.962 0 CA-C-N 123.074 3.437 . . . . 0.0 115.587 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 59.5 pttt 64.24 -40.68 0.25 Allowed 'General case' 0 N--CA 1.512 2.626 0 C-N-CA 127.504 2.321 . . . . 0.0 116.704 167.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 58.1 tt0 -64.9 -35.08 11.79 Favored Pre-proline 0 CA--C 1.585 2.293 0 CA-C-O 114.75 -2.548 . . . . 0.0 115.516 168.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_exo -60.22 -52.95 3.43 Favored 'Trans proline' 0 C--N 1.377 2.035 0 CA-C-N 126.619 3.399 . . . . 0.0 118.557 -179.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 46.38 1.77 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.99 0 N-CA-C 119.377 3.103 . . . . 0.0 119.377 -153.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.628 ' HA ' HG12 ' A' ' 18' ' ' VAL . 2.3 mmp_? -113.65 -8.06 13.3 Favored 'General case' 0 CA--C 1.579 2.072 0 CA-C-N 121.028 1.74 . . . . 0.0 114.973 176.154 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -82.54 -10.71 58.87 Favored 'General case' 0 CA--C 1.578 2.044 0 O-C-N 119.323 -2.11 . . . . 0.0 115.431 144.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -80.63 -52.67 7.31 Favored 'General case' 0 CA--C 1.562 1.429 0 CA-C-O 117.305 -1.331 . . . . 0.0 109.578 162.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.628 HG12 ' HA ' ' A' ' 15' ' ' ARG . 3.0 p -48.27 -44.96 13.14 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.468 0 N-CA-C 117.097 2.258 . . . . 0.0 117.097 177.284 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -74.1 -36.88 64.27 Favored 'General case' 0 CA--C 1.582 2.191 0 CA-C-O 123.881 1.801 . . . . 0.0 112.98 -170.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.284 76.5 ttt-85 -66.37 -43.94 84.55 Favored 'General case' 0 CA--C 1.561 1.398 0 C-N-CA 129.742 3.217 . . . . 0.0 116.384 165.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -60.23 -43.93 95.64 Favored 'General case' 0 CA--C 1.565 1.53 0 C-N-CA 124.781 1.232 . . . . 0.0 114.083 162.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 42.1 t80 -72.25 -32.59 66.82 Favored 'General case' 0 CA--C 1.562 1.432 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 174.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.45 -25.37 54.31 Favored 'General case' 0 CA--C 1.569 1.678 0 CA-C-N 121.789 2.086 . . . . 0.0 114.299 164.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 61.6 m -62.35 -51.1 68.95 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-N 120.763 1.62 . . . . 0.0 112.422 161.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -54.59 -46.03 73.71 Favored 'General case' 0 CA--C 1.561 1.374 0 CA-C-O 117.059 -1.448 . . . . 0.0 113.873 164.148 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 37.6 mmt180 -82.01 21.11 0.91 Allowed 'General case' 0 CA--C 1.576 1.977 0 CA-C-N 122.35 2.341 . . . . 0.0 116.007 171.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -115.9 -31.62 5.7 Favored 'General case' 0 CA--C 1.569 1.687 0 C-N-CA 125.936 1.694 . . . . 0.0 114.834 152.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -60.25 -43.0 96.5 Favored 'General case' 0 CA--C 1.571 1.754 0 CA-C-N 121.258 1.844 . . . . 0.0 113.113 162.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 21.4 mm-40 -59.6 -43.18 93.8 Favored 'General case' 0 CA--C 1.569 1.696 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 165.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.15 -27.69 65.77 Favored 'General case' 0 CA--C 1.573 1.865 0 N-CA-C 116.271 1.952 . . . . 0.0 116.271 176.289 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 75.5 m . . . . . 0 N--CA 1.489 1.506 0 CA-C-O 124.645 2.164 . . . . 0.0 113.149 -170.088 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 42.4 t . . . . . 0 CA--C 1.563 1.449 0 CA-C-O 120.16 0.029 . . . . 0.0 110.98 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 54.0 p -109.36 -175.34 2.73 Favored 'General case' 0 CA--C 1.568 1.647 0 CA-C-O 122.658 1.218 . . . . 0.0 112.74 -179.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 11.0 tp -68.8 -34.47 64.8 Favored 'Isoleucine or valine' 0 CA--C 1.58 2.121 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 173.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 95.2 mt -84.92 39.55 0.76 Allowed 'General case' 0 N--CA 1.503 2.193 0 CA-C-N 120.913 1.688 . . . . 0.0 114.848 175.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -124.26 -18.47 5.82 Favored 'General case' 0 CA--C 1.574 1.868 0 C-N-CA 124.973 1.309 . . . . 0.0 114.187 179.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 69.2 mt -89.09 85.78 2.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 CA-C-N 121.244 1.838 . . . . 0.0 108.315 -164.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 79.5 mtt85 -104.34 43.6 1.09 Allowed 'General case' 0 CA--C 1.581 2.149 0 CA-C-N 113.263 -1.79 . . . . 0.0 112.539 178.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -94.42 63.73 3.03 Favored 'General case' 0 CA--C 1.571 1.774 0 O-C-N 120.794 -1.191 . . . . 0.0 113.646 -166.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -84.98 158.02 32.76 Favored Glycine 0 CA--C 1.562 2.991 0 CA-C-O 118.265 -1.297 . . . . 0.0 114.511 164.464 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -70.75 133.0 22.81 Favored 'Trans proline' 0 CA--C 1.563 1.945 0 CA-C-N 122.229 3.014 . . . . 0.0 114.554 -174.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 73.9 mttt -137.92 -65.89 0.51 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-N 113.915 -1.493 . . . . 0.0 109.611 -165.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -80.11 -43.25 1.44 Allowed Pre-proline 0 CA--C 1.586 2.334 0 CA-C-O 114.933 -2.46 . . . . 0.0 114.451 172.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -59.3 -29.45 90.3 Favored 'Trans proline' 0 C--N 1.376 1.997 0 CA-C-N 126.586 3.388 . . . . 0.0 119.613 -176.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.4 p90 -62.85 -10.68 14.1 Favored 'General case' 0 CA--C 1.574 1.872 0 N-CA-C 117.925 2.565 . . . . 0.0 117.925 -158.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.642 ' HA ' HG12 ' A' ' 18' ' ' VAL . 1.9 mmp_? -111.57 -4.29 14.83 Favored 'General case' 0 CA--C 1.576 1.973 0 N-CA-C 116.383 1.994 . . . . 0.0 116.383 172.091 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -78.48 -22.57 47.31 Favored 'General case' 0 CA--C 1.568 1.66 0 O-C-N 119.336 -2.103 . . . . 0.0 114.767 141.289 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -73.37 -52.24 14.52 Favored 'General case' 0 CA--C 1.561 1.371 0 CA-C-O 117.019 -1.467 . . . . 0.0 109.765 170.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.642 HG12 ' HA ' ' A' ' 15' ' ' ARG . 3.9 p -44.92 -47.32 2.86 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.478 0 N-CA-C 117.654 2.464 . . . . 0.0 117.654 173.362 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -72.13 -39.3 68.91 Favored 'General case' 0 CA--C 1.588 2.415 0 CA-C-O 124.629 2.156 . . . . 0.0 113.226 -170.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.317 73.4 ttt180 -67.15 -40.91 86.75 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 130.866 3.666 . . . . 0.0 116.433 167.181 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -60.93 -41.96 97.22 Favored 'General case' 0 CA--C 1.562 1.429 0 C-N-CA 124.652 1.181 . . . . 0.0 113.887 160.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -68.54 -35.78 77.91 Favored 'General case' 0 CA--C 1.565 1.541 0 N-CA-C 115.752 1.76 . . . . 0.0 115.752 173.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.9 tptp -77.28 -24.07 51.06 Favored 'General case' 0 CA--C 1.568 1.639 0 CA-C-N 120.831 1.65 . . . . 0.0 115.338 165.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 38.3 m -65.82 -47.75 73.99 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-N 120.253 1.388 . . . . 0.0 112.373 161.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 58.4 tp -56.63 -42.72 79.34 Favored 'General case' 0 CA--C 1.558 1.255 0 CA-C-O 116.847 -1.549 . . . . 0.0 114.306 162.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 92.6 mtt-85 -84.8 27.68 0.73 Allowed 'General case' 0 CA--C 1.578 2.02 0 CA-C-N 122.182 2.265 . . . . 0.0 114.746 166.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -111.76 -26.24 9.07 Favored 'General case' 0 CA--C 1.571 1.764 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 140.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -64.18 -46.23 84.87 Favored 'General case' 0 CA--C 1.572 1.801 0 CA-C-N 122.869 2.577 . . . . 0.0 112.424 165.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 82.5 mt-30 -62.78 -47.86 81.64 Favored 'General case' 0 CA--C 1.574 1.867 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 161.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 66.65 -63.78 0.25 Allowed 'General case' 0 N--CA 1.499 2.003 0 C-N-CA 126.504 1.922 . . . . 0.0 114.202 -178.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 52.9 m . . . . . 0 N--CA 1.492 1.675 0 CA-C-O 123.342 1.544 . . . . 0.0 109.373 174.481 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 42.7 t . . . . . 0 CA--C 1.567 1.626 0 CA-C-O 116.605 -1.664 . . . . 0.0 108.101 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 43.8 t -166.05 -104.49 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 CA-C-N 122.489 2.404 . . . . 0.0 107.66 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . 0.276 7.9 tp 34.98 36.8 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.512 2.653 0 N-CA-C 118.108 2.633 . . . . 0.0 118.108 -174.088 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 73.8 mt 38.91 43.24 0.73 Allowed 'General case' 0 N--CA 1.509 2.483 0 C-N-CA 126.126 1.771 . . . . 0.0 115.534 -167.363 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -162.72 -58.21 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.248 0 O-C-N 121.479 -0.763 . . . . 0.0 111.465 -165.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 53.3 mt -90.84 79.75 1.62 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.877 0 CA-C-O 124.215 1.96 . . . . 0.0 107.835 -164.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.65 -28.25 26.56 Favored 'General case' 0 CA--C 1.57 1.743 0 CA-C-N 112.696 -2.047 . . . . 0.0 114.202 -174.434 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 59.42 80.57 0.19 Allowed 'General case' 0 N--CA 1.502 2.159 0 C-N-CA 125.812 1.645 . . . . 0.0 111.233 -179.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 121.99 -174.91 16.23 Favored Glycine 0 CA--C 1.562 3.012 0 CA-C-N 115.294 -0.866 . . . . 0.0 114.477 -168.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -66.38 140.0 56.42 Favored 'Trans proline' 0 CA--C 1.565 2.052 0 CA-C-N 121.304 2.552 . . . . 0.0 115.424 -175.162 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -134.29 -54.54 0.85 Allowed 'General case' 0 N--CA 1.494 1.768 0 CA-C-N 115.32 -0.855 . . . . 0.0 111.494 178.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -88.96 -45.87 0.43 Allowed Pre-proline 0 CA--C 1.575 1.937 0 CA-C-O 115.058 -2.401 . . . . 0.0 113.982 -178.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -56.89 -47.85 21.28 Favored 'Trans proline' 0 C--N 1.377 2.063 0 CA-C-N 126.492 3.354 . . . . 0.0 117.035 179.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -75.26 -7.07 52.91 Favored 'General case' 0 CA--C 1.573 1.832 0 N-CA-C 116.059 1.874 . . . . 0.0 116.059 -164.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.717 ' HA ' HG12 ' A' ' 18' ' ' VAL . 0.0 OUTLIER -98.64 -19.47 17.53 Favored 'General case' 0 CA--C 1.576 1.955 0 N-CA-C 115.077 1.51 . . . . 0.0 115.077 165.642 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.4 m-20 -80.76 -1.13 41.57 Favored 'General case' 0 CA--C 1.576 1.952 0 CA-C-N 121.817 2.099 . . . . 0.0 116.21 152.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -90.36 -53.37 4.48 Favored 'General case' 0 CA--C 1.561 1.371 0 CA-C-O 117.331 -1.318 . . . . 0.0 108.148 159.153 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.717 HG12 ' HA ' ' A' ' 15' ' ' ARG . 2.5 p -52.8 -48.61 49.72 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.152 0 N-CA-C 116.849 2.166 . . . . 0.0 116.849 -177.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -74.16 -32.33 63.07 Favored 'General case' 0 CA--C 1.587 2.399 0 CA-C-O 123.015 1.388 . . . . 0.0 112.41 -171.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . 0.271 76.1 ttt180 -66.48 -46.23 77.02 Favored 'General case' 0 CA--C 1.559 1.309 0 C-N-CA 128.732 2.813 . . . . 0.0 115.9 165.743 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -59.0 -44.93 91.73 Favored 'General case' 0 CA--C 1.564 1.51 0 C-N-CA 124.738 1.215 . . . . 0.0 114.149 164.097 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -68.15 -36.39 79.58 Favored 'General case' 0 CA--C 1.56 1.363 0 N-CA-C 115.671 1.73 . . . . 0.0 115.671 175.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.45 -22.08 41.47 Favored 'General case' 0 CA--C 1.571 1.766 0 CA-C-N 121.445 1.93 . . . . 0.0 114.896 167.223 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 60.1 m -64.42 -49.96 69.48 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-N 120.722 1.601 . . . . 0.0 112.834 160.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.3 tt -67.97 -30.45 69.74 Favored 'General case' 0 CA--C 1.561 1.397 0 CA-C-O 116.646 -1.645 . . . . 0.0 114.387 168.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 65.7 mtt180 -90.5 27.63 1.67 Allowed 'General case' 0 CA--C 1.572 1.792 0 CA-C-N 123.615 2.916 . . . . 0.0 114.401 161.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -103.6 -29.7 10.94 Favored 'General case' 0 CA--C 1.568 1.637 0 CA-C-O 115.994 -1.955 . . . . 0.0 114.288 137.44 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -73.98 -35.24 64.45 Favored 'General case' 0 CA--C 1.584 2.263 0 CA-C-N 123.953 3.07 . . . . 0.0 112.361 171.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -72.95 -33.41 65.88 Favored 'General case' 0 CA--C 1.576 1.952 0 N-CA-C 115.492 1.664 . . . . 0.0 115.492 157.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 65.9 -67.84 0.14 Allowed 'General case' 0 N--CA 1.502 2.153 0 C-N-CA 125.737 1.615 . . . . 0.0 112.224 -155.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 28.7 t . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 124.85 2.262 . . . . 0.0 110.622 169.967 . . . . . . . . 0 0 . 1 stop_ save_